USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 988 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 145 GLN : amide:sc= -0.0474 X(o=-0.047,f=-0.049) USER MOD Set 1.2: A 148 CYS SG : rot 180:sc= 0 USER MOD Set 1.3: A 149 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 128 CYS SG : rot -84:sc=-0.00181 USER MOD Set 2.2: A 129 GLN : amide:sc= -5.02! C(o=-5!,f=-6.8!) USER MOD Set 2.3: A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 37 SER OG : rot -21:sc= 0.528 USER MOD Set 3.2: A 117 GLN : amide:sc= -1.55 K(o=-1,f=-3.5!) USER MOD Set 4.1: A 86 ASN : amide:sc= -11.2! C(o=-11!,f=-3.8!) USER MOD Set 4.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 44 THR OG1 : rot 180:sc= -0.938 USER MOD Set 5.2: A 47 LYS NZ :NH3+ -107:sc= 1.16 (180deg=0) USER MOD Set 5.3: A 98 TYR OH : rot -166:sc= 1.34 USER MOD Single : A 11 CYS SG : rot -108:sc= -12! USER MOD Single : A 19 CYS SG : rot 66:sc= 0.203 USER MOD Single : A 35 GLN : amide:sc= -1.41! K(o=-1.4!,f=-0.093) USER MOD Single : A 42 HIS : no HD1:sc= -4.67! K(o=-4.7!,f=-1.7) USER MOD Single : A 49 HIS : no HD1:sc= -7.83! C(o=-7.8!,f=-2.4!) USER MOD Single : A 59 THR OG1 : rot -62:sc= -4.39! USER MOD Single : A 64 THR OG1 : rot 72:sc= -3.69! USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 74 GLN : amide:sc= -9.09! C(o=-9.1!,f=-3!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 152:sc= -0.665 (180deg=-1.35) USER MOD Single : A 104 LYS NZ :NH3+ -177:sc= 1.04 (180deg=1.03) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 83:sc= 1.16 USER MOD Single : A 114 HIS : no HD1:sc= -2.18! C(o=-2.2!,f=-1.9!) USER MOD Single : A 116 HIS : no HD1:sc= -0.847 K(o=-0.85,f=-3.3) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ -132:sc= 0.0785 (180deg=-0.127) USER MOD Single : A 136 MET CE :methyl -123:sc= -5.95 (180deg=-13.3!) USER MOD Single : A 141 GLN : amide:sc= -1.43! K(o=-1.4!,f=-0.0061) USER MOD Single : A 144 HIS : no HE2:sc= -17.3! C(o=-17!,f=-25!) USER MOD ----------------------------------------------------------------- ATOM 105 N ARG A 9 12.067 -3.559 -7.142 1.00 0.00 N ATOM 106 CA ARG A 9 11.159 -2.467 -7.561 1.00 0.00 C ATOM 107 C ARG A 9 10.126 -3.057 -8.518 1.00 0.00 C ATOM 108 O ARG A 9 10.468 -3.699 -9.492 1.00 0.00 O ATOM 109 CB ARG A 9 11.950 -1.353 -8.261 1.00 0.00 C ATOM 110 CG ARG A 9 12.226 -1.728 -9.719 1.00 0.00 C ATOM 111 CD ARG A 9 13.065 -0.628 -10.366 1.00 0.00 C ATOM 112 NE ARG A 9 13.284 -0.953 -11.802 1.00 0.00 N ATOM 113 CZ ARG A 9 14.197 -1.818 -12.136 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.909 -2.403 -11.212 1.00 0.00 N ATOM 115 NH2 ARG A 9 14.402 -2.099 -13.394 1.00 0.00 N ATOM 0 HA ARG A 9 10.667 -2.033 -6.690 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.389 -0.419 -8.219 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.891 -1.183 -7.738 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.752 -2.681 -9.769 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.288 -1.853 -10.260 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.559 0.333 -10.272 1.00 0.00 H new ATOM 0 HD3 ARG A 9 14.022 -0.536 -9.853 1.00 0.00 H new ATOM 0 HE ARG A 9 12.721 -0.500 -12.521 1.00 0.00 H new ATOM 0 HH11 ARG A 9 14.750 -2.182 -10.229 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.625 -3.081 -11.473 1.00 0.00 H new ATOM 0 HH21 ARG A 9 13.846 -1.640 -14.116 1.00 0.00 H new ATOM 0 HH22 ARG A 9 15.118 -2.777 -13.655 1.00 0.00 H new ATOM 129 N ALA A 10 8.871 -2.851 -8.257 1.00 0.00 N ATOM 130 CA ALA A 10 7.829 -3.402 -9.160 1.00 0.00 C ATOM 131 C ALA A 10 7.157 -2.242 -9.881 1.00 0.00 C ATOM 132 O ALA A 10 7.350 -1.093 -9.541 1.00 0.00 O ATOM 133 CB ALA A 10 6.784 -4.176 -8.349 1.00 0.00 C ATOM 0 H ALA A 10 8.520 -2.325 -7.457 1.00 0.00 H new ATOM 0 HA ALA A 10 8.286 -4.082 -9.879 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.025 -4.576 -9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.269 -4.997 -7.820 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.314 -3.507 -7.628 1.00 0.00 H new ATOM 139 N CYS A 11 6.383 -2.524 -10.877 1.00 0.00 N ATOM 140 CA CYS A 11 5.715 -1.429 -11.611 1.00 0.00 C ATOM 141 C CYS A 11 4.323 -1.894 -12.027 1.00 0.00 C ATOM 142 O CYS A 11 4.117 -3.048 -12.338 1.00 0.00 O ATOM 143 CB CYS A 11 6.560 -1.062 -12.831 1.00 0.00 C ATOM 144 SG CYS A 11 8.157 -1.911 -12.728 1.00 0.00 S ATOM 0 H CYS A 11 6.183 -3.465 -11.216 1.00 0.00 H new ATOM 0 HA CYS A 11 5.614 -0.545 -10.981 1.00 0.00 H new ATOM 0 HB2 CYS A 11 6.042 -1.347 -13.746 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.710 0.017 -12.873 1.00 0.00 H new ATOM 0 HG CYS A 11 9.090 -1.049 -12.452 1.00 0.00 H new ATOM 150 N GLY A 12 3.363 -1.013 -12.010 1.00 0.00 N ATOM 151 CA GLY A 12 1.979 -1.416 -12.386 1.00 0.00 C ATOM 152 C GLY A 12 1.291 -0.283 -13.145 1.00 0.00 C ATOM 153 O GLY A 12 1.839 0.789 -13.312 1.00 0.00 O ATOM 0 H GLY A 12 3.476 -0.033 -11.752 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.008 -2.313 -13.004 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.408 -1.664 -11.491 1.00 0.00 H new ATOM 157 N LEU A 13 0.091 -0.511 -13.604 1.00 0.00 N ATOM 158 CA LEU A 13 -0.636 0.557 -14.347 1.00 0.00 C ATOM 159 C LEU A 13 -1.883 0.979 -13.588 1.00 0.00 C ATOM 160 O LEU A 13 -2.769 0.181 -13.347 1.00 0.00 O ATOM 161 CB LEU A 13 -1.114 0.035 -15.704 1.00 0.00 C ATOM 162 CG LEU A 13 0.051 -0.175 -16.664 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.517 -0.527 -18.038 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.868 1.109 -16.779 1.00 0.00 C ATOM 0 H LEU A 13 -0.417 -1.389 -13.497 1.00 0.00 H new ATOM 0 HA LEU A 13 0.055 1.392 -14.466 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.647 -0.906 -15.566 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.822 0.741 -16.138 1.00 0.00 H new ATOM 0 HG LEU A 13 0.693 -0.975 -16.296 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.301 -0.682 -18.741 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.109 -1.439 -17.964 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.149 0.288 -18.390 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.699 0.951 -17.467 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.233 1.912 -17.155 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.256 1.382 -15.798 1.00 0.00 H new ATOM 176 N ILE A 14 -2.014 2.236 -13.284 1.00 0.00 N ATOM 177 CA ILE A 14 -3.265 2.677 -12.635 1.00 0.00 C ATOM 178 C ILE A 14 -4.332 2.518 -13.704 1.00 0.00 C ATOM 179 O ILE A 14 -4.597 3.428 -14.463 1.00 0.00 O ATOM 180 CB ILE A 14 -3.155 4.150 -12.232 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.190 4.292 -11.059 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.531 4.698 -11.849 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.700 3.491 -9.858 1.00 0.00 C ATOM 0 H ILE A 14 -1.320 2.963 -13.455 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.487 2.105 -11.734 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.776 4.722 -13.079 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.200 3.939 -11.348 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.087 5.343 -10.788 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.439 5.746 -11.564 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.207 4.611 -12.700 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.929 4.128 -11.010 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.004 3.599 -9.026 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.680 3.864 -9.562 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.780 2.438 -10.130 1.00 0.00 H new ATOM 195 N ILE A 15 -4.922 1.362 -13.806 1.00 0.00 N ATOM 196 CA ILE A 15 -5.930 1.170 -14.871 1.00 0.00 C ATOM 197 C ILE A 15 -7.251 1.780 -14.450 1.00 0.00 C ATOM 198 O ILE A 15 -7.709 1.615 -13.338 1.00 0.00 O ATOM 199 CB ILE A 15 -6.146 -0.309 -15.165 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.848 -0.943 -15.673 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.234 -0.427 -16.233 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.142 -2.371 -16.135 1.00 0.00 C ATOM 0 H ILE A 15 -4.751 0.555 -13.206 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.559 1.660 -15.771 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.448 -0.830 -14.256 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.439 -0.357 -16.496 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.097 -0.949 -14.883 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.407 -1.479 -16.461 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.157 0.021 -15.864 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -6.915 0.093 -17.136 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.224 -2.832 -16.499 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.532 -2.951 -15.299 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.880 -2.349 -16.937 1.00 0.00 H new ATOM 214 N PHE A 16 -7.873 2.473 -15.351 1.00 0.00 N ATOM 215 CA PHE A 16 -9.176 3.093 -15.041 1.00 0.00 C ATOM 216 C PHE A 16 -9.950 3.272 -16.345 1.00 0.00 C ATOM 217 O PHE A 16 -9.376 3.409 -17.407 1.00 0.00 O ATOM 218 CB PHE A 16 -8.948 4.452 -14.391 1.00 0.00 C ATOM 219 CG PHE A 16 -8.476 5.423 -15.437 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.408 6.066 -16.256 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.110 5.686 -15.586 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.979 6.972 -17.225 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.676 6.594 -16.557 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.614 7.239 -17.379 1.00 0.00 C ATOM 0 H PHE A 16 -7.530 2.637 -16.297 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.741 2.460 -14.356 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.871 4.810 -13.934 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.209 4.369 -13.594 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.462 5.861 -16.138 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.391 5.188 -14.952 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.701 7.468 -17.857 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.622 6.799 -16.674 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.282 7.941 -18.130 1.00 0.00 H new ATOM 234 N ARG A 17 -11.245 3.267 -16.274 1.00 0.00 N ATOM 235 CA ARG A 17 -12.060 3.431 -17.509 1.00 0.00 C ATOM 236 C ARG A 17 -13.061 4.567 -17.308 1.00 0.00 C ATOM 237 O ARG A 17 -13.773 4.610 -16.325 1.00 0.00 O ATOM 238 CB ARG A 17 -12.814 2.130 -17.785 1.00 0.00 C ATOM 239 CG ARG A 17 -13.700 2.302 -19.018 1.00 0.00 C ATOM 240 CD ARG A 17 -14.507 1.022 -19.244 1.00 0.00 C ATOM 241 NE ARG A 17 -15.435 0.807 -18.096 1.00 0.00 N ATOM 242 CZ ARG A 17 -16.448 -0.008 -18.218 1.00 0.00 C ATOM 243 NH1 ARG A 17 -16.641 -0.647 -19.339 1.00 0.00 N ATOM 244 NH2 ARG A 17 -17.267 -0.187 -17.218 1.00 0.00 N ATOM 0 H ARG A 17 -11.780 3.156 -15.413 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.411 3.666 -18.352 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.108 1.315 -17.943 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.423 1.861 -16.922 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.372 3.150 -18.882 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -13.087 2.518 -19.893 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -15.072 1.096 -20.173 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -13.835 0.170 -19.346 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.278 1.297 -17.215 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -16.000 -0.510 -20.121 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -17.432 -1.283 -19.434 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -17.116 0.310 -16.340 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -18.058 -0.824 -17.314 1.00 0.00 H new ATOM 258 N ARG A 18 -13.125 5.488 -18.233 1.00 0.00 N ATOM 259 CA ARG A 18 -14.088 6.610 -18.085 1.00 0.00 C ATOM 260 C ARG A 18 -15.316 6.357 -18.953 1.00 0.00 C ATOM 261 O ARG A 18 -15.212 5.968 -20.098 1.00 0.00 O ATOM 262 CB ARG A 18 -13.422 7.928 -18.486 1.00 0.00 C ATOM 263 CG ARG A 18 -13.109 7.926 -19.980 1.00 0.00 C ATOM 264 CD ARG A 18 -12.226 9.133 -20.306 1.00 0.00 C ATOM 265 NE ARG A 18 -12.794 9.862 -21.474 1.00 0.00 N ATOM 266 CZ ARG A 18 -12.975 9.243 -22.610 1.00 0.00 C ATOM 267 NH1 ARG A 18 -12.665 7.978 -22.724 1.00 0.00 N ATOM 268 NH2 ARG A 18 -13.471 9.888 -23.630 1.00 0.00 N ATOM 0 H ARG A 18 -12.555 5.509 -19.078 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.399 6.677 -17.043 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.079 8.764 -18.246 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.504 8.069 -17.915 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.601 7.002 -20.257 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.032 7.968 -20.558 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -12.166 9.797 -19.444 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.210 8.805 -20.527 1.00 0.00 H new ATOM 0 HE ARG A 18 -13.042 10.847 -21.387 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.281 7.473 -21.925 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -12.807 7.496 -23.612 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -13.717 10.874 -23.540 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -13.613 9.406 -24.518 1.00 0.00 H new ATOM 282 N CYS A 19 -16.484 6.570 -18.413 1.00 0.00 N ATOM 283 CA CYS A 19 -17.720 6.341 -19.206 1.00 0.00 C ATOM 284 C CYS A 19 -18.120 7.641 -19.901 1.00 0.00 C ATOM 285 O CYS A 19 -17.456 8.652 -19.783 1.00 0.00 O ATOM 286 CB CYS A 19 -18.856 5.882 -18.285 1.00 0.00 C ATOM 287 SG CYS A 19 -18.314 4.444 -17.328 1.00 0.00 S ATOM 0 H CYS A 19 -16.634 6.893 -17.457 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.532 5.567 -19.951 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.144 6.691 -17.614 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.737 5.629 -18.875 1.00 0.00 H new ATOM 0 HG CYS A 19 -17.354 4.794 -16.525 1.00 0.00 H new ATOM 424 N ALA A 28 -17.968 8.821 -13.988 1.00 0.00 N ATOM 425 CA ALA A 28 -17.686 8.083 -15.251 1.00 0.00 C ATOM 426 C ALA A 28 -16.343 7.368 -15.138 1.00 0.00 C ATOM 427 O ALA A 28 -16.093 6.391 -15.812 1.00 0.00 O ATOM 428 CB ALA A 28 -17.637 9.071 -16.418 1.00 0.00 C ATOM 0 HA ALA A 28 -18.474 7.350 -15.424 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.431 8.532 -17.343 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.596 9.582 -16.502 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.849 9.804 -16.242 1.00 0.00 H new ATOM 434 N ILE A 29 -15.473 7.848 -14.294 1.00 0.00 N ATOM 435 CA ILE A 29 -14.142 7.198 -14.156 1.00 0.00 C ATOM 436 C ILE A 29 -14.196 6.099 -13.097 1.00 0.00 C ATOM 437 O ILE A 29 -14.711 6.284 -12.012 1.00 0.00 O ATOM 438 CB ILE A 29 -13.111 8.244 -13.750 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.158 9.414 -14.743 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.722 7.604 -13.745 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.834 9.524 -15.504 1.00 0.00 C ATOM 0 H ILE A 29 -15.626 8.660 -13.696 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.863 6.753 -15.111 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.332 8.620 -12.751 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.978 9.269 -15.447 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.356 10.344 -14.210 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.980 8.348 -13.455 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.705 6.778 -13.034 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.490 7.230 -14.742 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.885 10.358 -16.204 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.021 9.692 -14.797 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.652 8.600 -16.054 1.00 0.00 H new ATOM 453 N GLU A 30 -13.657 4.953 -13.415 1.00 0.00 N ATOM 454 CA GLU A 30 -13.655 3.827 -12.446 1.00 0.00 C ATOM 455 C GLU A 30 -12.266 3.189 -12.421 1.00 0.00 C ATOM 456 O GLU A 30 -11.501 3.333 -13.352 1.00 0.00 O ATOM 457 CB GLU A 30 -14.691 2.784 -12.873 1.00 0.00 C ATOM 458 CG GLU A 30 -16.074 3.432 -12.906 1.00 0.00 C ATOM 459 CD GLU A 30 -17.128 2.371 -13.227 1.00 0.00 C ATOM 460 OE1 GLU A 30 -17.824 1.962 -12.314 1.00 0.00 O ATOM 461 OE2 GLU A 30 -17.220 1.986 -14.382 1.00 0.00 O ATOM 0 H GLU A 30 -13.216 4.750 -14.312 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.905 4.197 -11.452 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.440 2.386 -13.856 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.686 1.944 -12.178 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.292 3.897 -11.945 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.099 4.223 -13.656 1.00 0.00 H new ATOM 469 N PHE A 31 -11.937 2.484 -11.374 1.00 0.00 N ATOM 470 CA PHE A 31 -10.596 1.839 -11.307 1.00 0.00 C ATOM 471 C PHE A 31 -10.745 0.323 -11.377 1.00 0.00 C ATOM 472 O PHE A 31 -11.676 -0.252 -10.846 1.00 0.00 O ATOM 473 CB PHE A 31 -9.894 2.197 -9.996 1.00 0.00 C ATOM 474 CG PHE A 31 -9.560 3.667 -9.980 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.648 4.186 -10.904 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.156 4.507 -9.038 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.335 5.550 -10.887 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.843 5.868 -9.019 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.932 6.390 -9.943 1.00 0.00 C ATOM 0 H PHE A 31 -12.537 2.327 -10.564 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.004 2.198 -12.149 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.536 1.951 -9.150 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -8.984 1.607 -9.887 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.185 3.535 -11.631 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.859 4.105 -8.324 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.633 5.953 -11.602 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.305 6.518 -8.290 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.690 7.442 -9.927 1.00 0.00 H new ATOM 489 N LEU A 32 -9.822 -0.323 -12.024 1.00 0.00 N ATOM 490 CA LEU A 32 -9.872 -1.801 -12.136 1.00 0.00 C ATOM 491 C LEU A 32 -8.839 -2.409 -11.170 1.00 0.00 C ATOM 492 O LEU A 32 -7.646 -2.342 -11.391 1.00 0.00 O ATOM 493 CB LEU A 32 -9.575 -2.170 -13.598 1.00 0.00 C ATOM 494 CG LEU A 32 -9.081 -3.617 -13.721 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.223 -4.586 -13.432 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.588 -3.859 -15.145 1.00 0.00 C ATOM 0 H LEU A 32 -9.025 0.116 -12.486 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.851 -2.195 -11.865 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.476 -2.039 -14.198 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.823 -1.492 -14.000 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.275 -3.778 -13.006 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.862 -5.611 -13.522 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.594 -4.419 -12.421 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.030 -4.421 -14.146 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.236 -4.886 -15.238 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.405 -3.691 -15.846 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.771 -3.173 -15.369 1.00 0.00 H new ATOM 508 N LEU A 33 -9.302 -2.998 -10.093 1.00 0.00 N ATOM 509 CA LEU A 33 -8.373 -3.615 -9.090 1.00 0.00 C ATOM 510 C LEU A 33 -8.514 -5.130 -9.148 1.00 0.00 C ATOM 511 O LEU A 33 -9.498 -5.642 -9.633 1.00 0.00 O ATOM 512 CB LEU A 33 -8.741 -3.154 -7.678 1.00 0.00 C ATOM 513 CG LEU A 33 -8.308 -1.705 -7.461 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.017 -1.153 -6.225 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.799 -1.651 -7.231 1.00 0.00 C ATOM 0 H LEU A 33 -10.292 -3.079 -9.863 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.352 -3.312 -9.322 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.817 -3.245 -7.528 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.260 -3.798 -6.942 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.566 -1.112 -8.339 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.713 -0.119 -6.063 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.096 -1.195 -6.375 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.748 -1.751 -5.354 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.491 -0.617 -7.076 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.544 -2.241 -6.351 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.284 -2.057 -8.102 1.00 0.00 H new ATOM 527 N LEU A 34 -7.540 -5.853 -8.654 1.00 0.00 N ATOM 528 CA LEU A 34 -7.633 -7.343 -8.687 1.00 0.00 C ATOM 529 C LEU A 34 -7.531 -7.938 -7.280 1.00 0.00 C ATOM 530 O LEU A 34 -6.684 -7.560 -6.494 1.00 0.00 O ATOM 531 CB LEU A 34 -6.494 -7.913 -9.540 1.00 0.00 C ATOM 532 CG LEU A 34 -6.568 -7.347 -10.955 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.585 -8.099 -11.854 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.980 -7.537 -11.495 1.00 0.00 C ATOM 0 H LEU A 34 -6.690 -5.478 -8.232 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.601 -7.606 -9.114 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.533 -7.665 -9.090 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.561 -9.001 -9.571 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.315 -6.287 -10.939 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.636 -7.696 -12.866 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.573 -7.980 -11.467 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.844 -9.158 -11.871 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.040 -7.135 -12.506 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.223 -8.599 -11.512 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.688 -7.013 -10.853 1.00 0.00 H new ATOM 546 N GLN A 35 -8.361 -8.904 -6.976 1.00 0.00 N ATOM 547 CA GLN A 35 -8.277 -9.565 -5.642 1.00 0.00 C ATOM 548 C GLN A 35 -7.606 -10.922 -5.843 1.00 0.00 C ATOM 549 O GLN A 35 -8.158 -11.807 -6.463 1.00 0.00 O ATOM 550 CB GLN A 35 -9.673 -9.776 -5.052 1.00 0.00 C ATOM 551 CG GLN A 35 -9.582 -9.781 -3.523 1.00 0.00 C ATOM 552 CD GLN A 35 -10.964 -10.059 -2.929 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.112 -10.162 -1.726 1.00 0.00 O ATOM 554 NE2 GLN A 35 -11.990 -10.184 -3.725 1.00 0.00 N ATOM 0 H GLN A 35 -9.090 -9.261 -7.593 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.709 -8.939 -4.954 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.344 -8.984 -5.385 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.091 -10.718 -5.406 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.873 -10.541 -3.193 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.208 -8.821 -3.167 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.866 -10.098 -4.734 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.916 -10.368 -3.339 1.00 0.00 H new ATOM 563 N ALA A 36 -6.412 -11.089 -5.348 1.00 0.00 N ATOM 564 CA ALA A 36 -5.709 -12.387 -5.541 1.00 0.00 C ATOM 565 C ALA A 36 -6.347 -13.459 -4.658 1.00 0.00 C ATOM 566 O ALA A 36 -6.491 -13.288 -3.466 1.00 0.00 O ATOM 567 CB ALA A 36 -4.236 -12.223 -5.171 1.00 0.00 C ATOM 0 H ALA A 36 -5.894 -10.386 -4.820 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.791 -12.692 -6.584 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.718 -13.172 -5.311 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.783 -11.464 -5.809 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.155 -11.916 -4.128 1.00 0.00 H new ATOM 573 N SER A 37 -6.731 -14.565 -5.237 1.00 0.00 N ATOM 574 CA SER A 37 -7.363 -15.648 -4.429 1.00 0.00 C ATOM 575 C SER A 37 -6.312 -16.691 -4.043 1.00 0.00 C ATOM 576 O SER A 37 -6.565 -17.576 -3.250 1.00 0.00 O ATOM 577 CB SER A 37 -8.464 -16.318 -5.252 1.00 0.00 C ATOM 578 OG SER A 37 -8.957 -17.447 -4.543 1.00 0.00 O ATOM 0 H SER A 37 -6.635 -14.765 -6.233 1.00 0.00 H new ATOM 0 HA SER A 37 -7.790 -15.217 -3.524 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.272 -15.612 -5.443 1.00 0.00 H new ATOM 0 HB3 SER A 37 -8.073 -16.625 -6.222 1.00 0.00 H new ATOM 0 HG SER A 37 -8.292 -17.735 -3.883 1.00 0.00 H new ATOM 641 N HIS A 42 -6.236 -10.057 -1.254 1.00 0.00 N ATOM 642 CA HIS A 42 -5.962 -8.594 -1.150 1.00 0.00 C ATOM 643 C HIS A 42 -6.312 -7.920 -2.480 1.00 0.00 C ATOM 644 O HIS A 42 -6.117 -8.483 -3.536 1.00 0.00 O ATOM 645 CB HIS A 42 -4.474 -8.389 -0.864 1.00 0.00 C ATOM 646 CG HIS A 42 -3.673 -8.889 -2.037 1.00 0.00 C ATOM 647 ND1 HIS A 42 -2.875 -10.026 -1.967 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.541 -8.420 -3.321 1.00 0.00 C ATOM 649 CE1 HIS A 42 -2.306 -10.197 -3.177 1.00 0.00 C ATOM 650 NE2 HIS A 42 -2.680 -9.248 -4.033 1.00 0.00 N ATOM 0 HA HIS A 42 -6.560 -8.160 -0.349 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.267 -7.333 -0.690 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.188 -8.924 0.042 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.031 -7.543 -3.717 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -1.631 -11.003 -3.422 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -2.395 -9.149 -5.007 1.00 0.00 H new ATOM 659 N TRP A 43 -6.815 -6.716 -2.440 1.00 0.00 N ATOM 660 CA TRP A 43 -7.163 -6.016 -3.711 1.00 0.00 C ATOM 661 C TRP A 43 -5.989 -5.148 -4.160 1.00 0.00 C ATOM 662 O TRP A 43 -5.397 -4.435 -3.378 1.00 0.00 O ATOM 663 CB TRP A 43 -8.374 -5.111 -3.493 1.00 0.00 C ATOM 664 CG TRP A 43 -9.643 -5.885 -3.635 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.433 -6.272 -2.608 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.294 -6.351 -4.850 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.524 -6.952 -3.114 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.483 -7.027 -4.492 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.968 -6.259 -6.215 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.323 -7.588 -5.453 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.812 -6.823 -7.186 1.00 0.00 C ATOM 672 CH2 TRP A 43 -11.984 -7.489 -6.804 1.00 0.00 C ATOM 0 H TRP A 43 -7.000 -6.188 -1.587 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.389 -6.765 -4.470 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.325 -4.662 -2.501 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.358 -4.294 -4.214 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.242 -6.081 -1.562 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.268 -7.350 -2.540 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.064 -5.752 -6.518 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.229 -8.095 -5.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.556 -6.743 -8.232 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.626 -7.926 -7.555 1.00 0.00 H new ATOM 683 N THR A 44 -5.660 -5.196 -5.415 1.00 0.00 N ATOM 684 CA THR A 44 -4.540 -4.364 -5.927 1.00 0.00 C ATOM 685 C THR A 44 -4.569 -4.392 -7.456 1.00 0.00 C ATOM 686 O THR A 44 -4.966 -5.376 -8.045 1.00 0.00 O ATOM 687 CB THR A 44 -3.208 -4.928 -5.427 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.142 -4.141 -5.937 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.049 -6.375 -5.900 1.00 0.00 C ATOM 0 H THR A 44 -6.121 -5.779 -6.114 1.00 0.00 H new ATOM 0 HA THR A 44 -4.646 -3.339 -5.571 1.00 0.00 H new ATOM 0 HB THR A 44 -3.191 -4.903 -4.337 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.288 -4.500 -5.616 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.099 -6.773 -5.542 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.867 -6.978 -5.506 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.067 -6.406 -6.989 1.00 0.00 H new ATOM 697 N PRO A 45 -4.149 -3.335 -8.101 1.00 0.00 N ATOM 698 CA PRO A 45 -4.136 -3.289 -9.580 1.00 0.00 C ATOM 699 C PRO A 45 -3.126 -4.272 -10.152 1.00 0.00 C ATOM 700 O PRO A 45 -2.243 -4.740 -9.462 1.00 0.00 O ATOM 701 CB PRO A 45 -3.735 -1.862 -9.949 1.00 0.00 C ATOM 702 CG PRO A 45 -3.541 -1.110 -8.674 1.00 0.00 C ATOM 703 CD PRO A 45 -3.643 -2.094 -7.504 1.00 0.00 C ATOM 0 HA PRO A 45 -5.110 -3.562 -9.985 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.818 -1.861 -10.539 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.507 -1.392 -10.559 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -2.569 -0.617 -8.670 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -4.295 -0.329 -8.578 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.673 -2.249 -7.032 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -4.317 -1.723 -6.732 1.00 0.00 H new ATOM 711 N PRO A 46 -3.259 -4.586 -11.400 1.00 0.00 N ATOM 712 CA PRO A 46 -2.342 -5.536 -12.083 1.00 0.00 C ATOM 713 C PRO A 46 -0.897 -5.027 -12.091 1.00 0.00 C ATOM 714 O PRO A 46 -0.488 -4.304 -12.976 1.00 0.00 O ATOM 715 CB PRO A 46 -2.894 -5.624 -13.507 1.00 0.00 C ATOM 716 CG PRO A 46 -3.770 -4.424 -13.683 1.00 0.00 C ATOM 717 CD PRO A 46 -4.293 -4.066 -12.298 1.00 0.00 C ATOM 0 HA PRO A 46 -2.306 -6.502 -11.579 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.087 -5.629 -14.239 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -3.460 -6.545 -13.650 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.210 -3.594 -14.113 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.593 -4.640 -14.365 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.421 -2.990 -12.183 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.262 -4.525 -12.103 1.00 0.00 H new ATOM 725 N LYS A 47 -0.122 -5.403 -11.107 1.00 0.00 N ATOM 726 CA LYS A 47 1.296 -4.949 -11.050 1.00 0.00 C ATOM 727 C LYS A 47 2.180 -6.114 -10.598 1.00 0.00 C ATOM 728 O LYS A 47 1.813 -6.879 -9.731 1.00 0.00 O ATOM 729 CB LYS A 47 1.419 -3.798 -10.053 1.00 0.00 C ATOM 730 CG LYS A 47 1.352 -4.341 -8.623 1.00 0.00 C ATOM 731 CD LYS A 47 1.321 -3.169 -7.650 1.00 0.00 C ATOM 732 CE LYS A 47 1.468 -3.685 -6.221 1.00 0.00 C ATOM 733 NZ LYS A 47 0.928 -2.669 -5.274 1.00 0.00 N ATOM 0 H LYS A 47 -0.413 -6.007 -10.338 1.00 0.00 H new ATOM 0 HA LYS A 47 1.614 -4.610 -12.036 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.360 -3.270 -10.208 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.618 -3.077 -10.216 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.464 -4.960 -8.496 1.00 0.00 H new ATOM 0 HG3 LYS A 47 2.214 -4.976 -8.420 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.126 -2.471 -7.880 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.385 -2.621 -7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.933 -4.628 -6.105 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.517 -3.884 -6.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 1.715 -2.205 -4.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 0.385 -1.957 -5.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.307 -3.135 -4.582 1.00 0.00 H new ATOM 747 N GLY A 48 3.344 -6.253 -11.172 1.00 0.00 N ATOM 748 CA GLY A 48 4.241 -7.373 -10.763 1.00 0.00 C ATOM 749 C GLY A 48 5.673 -6.856 -10.595 1.00 0.00 C ATOM 750 O GLY A 48 6.012 -5.778 -11.037 1.00 0.00 O ATOM 0 H GLY A 48 3.712 -5.644 -11.903 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.890 -7.809 -9.828 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.216 -8.164 -11.513 1.00 0.00 H new ATOM 754 N HIS A 49 6.513 -7.627 -9.960 1.00 0.00 N ATOM 755 CA HIS A 49 7.923 -7.193 -9.754 1.00 0.00 C ATOM 756 C HIS A 49 8.630 -7.092 -11.103 1.00 0.00 C ATOM 757 O HIS A 49 8.134 -7.558 -12.110 1.00 0.00 O ATOM 758 CB HIS A 49 8.648 -8.213 -8.879 1.00 0.00 C ATOM 759 CG HIS A 49 10.132 -7.988 -8.975 1.00 0.00 C ATOM 760 ND1 HIS A 49 10.999 -8.968 -9.442 1.00 0.00 N ATOM 761 CD2 HIS A 49 10.917 -6.896 -8.693 1.00 0.00 C ATOM 762 CE1 HIS A 49 12.242 -8.452 -9.425 1.00 0.00 C ATOM 763 NE2 HIS A 49 12.244 -7.194 -8.979 1.00 0.00 N ATOM 0 H HIS A 49 6.282 -8.542 -9.574 1.00 0.00 H new ATOM 0 HA HIS A 49 7.932 -6.219 -9.264 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.321 -8.118 -7.844 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.401 -9.225 -9.200 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.558 -5.953 -8.309 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.127 -8.989 -9.734 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.051 -6.580 -8.871 1.00 0.00 H new ATOM 772 N VAL A 50 9.783 -6.487 -11.136 1.00 0.00 N ATOM 773 CA VAL A 50 10.508 -6.359 -12.427 1.00 0.00 C ATOM 774 C VAL A 50 11.434 -7.566 -12.623 1.00 0.00 C ATOM 775 O VAL A 50 12.359 -7.787 -11.869 1.00 0.00 O ATOM 776 CB VAL A 50 11.315 -5.049 -12.425 1.00 0.00 C ATOM 777 CG1 VAL A 50 12.799 -5.325 -12.167 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.163 -4.354 -13.777 1.00 0.00 C ATOM 0 H VAL A 50 10.252 -6.078 -10.328 1.00 0.00 H new ATOM 0 HA VAL A 50 9.796 -6.335 -13.252 1.00 0.00 H new ATOM 0 HB VAL A 50 10.932 -4.410 -11.629 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.350 -4.384 -12.170 1.00 0.00 H new ATOM 0 HG12 VAL A 50 12.916 -5.811 -11.198 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.189 -5.977 -12.949 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.735 -3.426 -13.775 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.535 -5.008 -14.566 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.111 -4.132 -13.956 1.00 0.00 H new ATOM 841 N ASP A 55 12.020 -3.772 -17.939 1.00 0.00 N ATOM 842 CA ASP A 55 12.037 -2.305 -17.682 1.00 0.00 C ATOM 843 C ASP A 55 11.027 -1.989 -16.582 1.00 0.00 C ATOM 844 O ASP A 55 10.319 -2.856 -16.109 1.00 0.00 O ATOM 845 CB ASP A 55 11.660 -1.541 -18.951 1.00 0.00 C ATOM 846 CG ASP A 55 12.423 -0.219 -18.984 1.00 0.00 C ATOM 847 OD1 ASP A 55 12.682 0.264 -20.073 1.00 0.00 O ATOM 848 OD2 ASP A 55 12.737 0.289 -17.918 1.00 0.00 O ATOM 0 HA ASP A 55 13.038 -2.002 -17.375 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.899 -2.135 -19.833 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.586 -1.356 -18.973 1.00 0.00 H new ATOM 854 N ASP A 56 10.957 -0.760 -16.159 1.00 0.00 N ATOM 855 CA ASP A 56 9.993 -0.404 -15.083 1.00 0.00 C ATOM 856 C ASP A 56 8.568 -0.392 -15.646 1.00 0.00 C ATOM 857 O ASP A 56 7.738 -1.190 -15.263 1.00 0.00 O ATOM 858 CB ASP A 56 10.343 0.975 -14.531 1.00 0.00 C ATOM 859 CG ASP A 56 11.748 0.927 -13.931 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.289 1.983 -13.652 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.260 -0.167 -13.769 1.00 0.00 O ATOM 0 H ASP A 56 11.524 0.012 -16.510 1.00 0.00 H new ATOM 0 HA ASP A 56 10.051 -1.142 -14.283 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.297 1.721 -15.324 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.619 1.272 -13.772 1.00 0.00 H new ATOM 867 N LEU A 57 8.276 0.504 -16.551 1.00 0.00 N ATOM 868 CA LEU A 57 6.902 0.546 -17.129 1.00 0.00 C ATOM 869 C LEU A 57 6.627 -0.742 -17.896 1.00 0.00 C ATOM 870 O LEU A 57 5.561 -1.318 -17.791 1.00 0.00 O ATOM 871 CB LEU A 57 6.760 1.745 -18.075 1.00 0.00 C ATOM 872 CG LEU A 57 5.427 1.659 -18.832 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.269 2.054 -17.915 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.462 2.601 -20.040 1.00 0.00 C ATOM 0 H LEU A 57 8.924 1.204 -16.913 1.00 0.00 H new ATOM 0 HA LEU A 57 6.183 0.648 -16.316 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.806 2.674 -17.507 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.589 1.761 -18.782 1.00 0.00 H new ATOM 0 HG LEU A 57 5.279 0.633 -19.168 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.330 1.988 -18.465 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.236 1.379 -17.059 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.414 3.076 -17.566 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.515 2.539 -20.577 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.620 3.624 -19.699 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.276 2.310 -20.705 1.00 0.00 H new ATOM 886 N GLU A 58 7.569 -1.214 -18.660 1.00 0.00 N ATOM 887 CA GLU A 58 7.321 -2.471 -19.409 1.00 0.00 C ATOM 888 C GLU A 58 6.887 -3.523 -18.398 1.00 0.00 C ATOM 889 O GLU A 58 6.040 -4.353 -18.666 1.00 0.00 O ATOM 890 CB GLU A 58 8.601 -2.921 -20.114 1.00 0.00 C ATOM 891 CG GLU A 58 8.995 -1.884 -21.168 1.00 0.00 C ATOM 892 CD GLU A 58 7.898 -1.785 -22.231 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.882 -0.795 -22.944 1.00 0.00 O ATOM 894 OE2 GLU A 58 7.094 -2.700 -22.316 1.00 0.00 O ATOM 0 H GLU A 58 8.487 -0.790 -18.797 1.00 0.00 H new ATOM 0 HA GLU A 58 6.551 -2.323 -20.166 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.405 -3.041 -19.388 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.448 -3.893 -20.584 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.147 -0.913 -20.697 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.940 -2.165 -21.632 1.00 0.00 H new ATOM 902 N THR A 59 7.436 -3.466 -17.217 1.00 0.00 N ATOM 903 CA THR A 59 7.032 -4.431 -16.170 1.00 0.00 C ATOM 904 C THR A 59 5.587 -4.127 -15.782 1.00 0.00 C ATOM 905 O THR A 59 4.775 -5.015 -15.623 1.00 0.00 O ATOM 906 CB THR A 59 7.944 -4.277 -14.953 1.00 0.00 C ATOM 907 OG1 THR A 59 8.964 -5.264 -15.006 1.00 0.00 O ATOM 908 CG2 THR A 59 7.130 -4.441 -13.670 1.00 0.00 C ATOM 0 H THR A 59 8.147 -2.791 -16.936 1.00 0.00 H new ATOM 0 HA THR A 59 7.115 -5.454 -16.538 1.00 0.00 H new ATOM 0 HB THR A 59 8.396 -3.285 -14.960 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.559 -6.155 -14.967 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.786 -4.330 -12.806 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.351 -3.680 -13.634 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.672 -5.430 -13.653 1.00 0.00 H new ATOM 916 N ALA A 60 5.249 -2.870 -15.659 1.00 0.00 N ATOM 917 CA ALA A 60 3.845 -2.523 -15.320 1.00 0.00 C ATOM 918 C ALA A 60 2.972 -3.011 -16.460 1.00 0.00 C ATOM 919 O ALA A 60 1.952 -3.641 -16.262 1.00 0.00 O ATOM 920 CB ALA A 60 3.695 -1.004 -15.181 1.00 0.00 C ATOM 0 H ALA A 60 5.881 -2.078 -15.778 1.00 0.00 H new ATOM 0 HA ALA A 60 3.557 -2.985 -14.376 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.662 -0.762 -14.932 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.353 -0.644 -14.390 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.964 -0.524 -16.122 1.00 0.00 H new ATOM 926 N LEU A 61 3.392 -2.750 -17.664 1.00 0.00 N ATOM 927 CA LEU A 61 2.622 -3.221 -18.838 1.00 0.00 C ATOM 928 C LEU A 61 2.620 -4.748 -18.824 1.00 0.00 C ATOM 929 O LEU A 61 1.644 -5.380 -19.166 1.00 0.00 O ATOM 930 CB LEU A 61 3.289 -2.701 -20.119 1.00 0.00 C ATOM 931 CG LEU A 61 3.100 -1.185 -20.210 1.00 0.00 C ATOM 932 CD1 LEU A 61 4.045 -0.596 -21.260 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.658 -0.883 -20.612 1.00 0.00 C ATOM 0 H LEU A 61 4.240 -2.228 -17.883 1.00 0.00 H new ATOM 0 HA LEU A 61 1.597 -2.852 -18.803 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.351 -2.947 -20.115 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.853 -3.186 -20.992 1.00 0.00 H new ATOM 0 HG LEU A 61 3.322 -0.740 -19.240 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.901 0.483 -21.315 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.077 -0.810 -20.982 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.831 -1.041 -22.232 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.517 0.196 -20.678 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.448 -1.337 -21.580 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.979 -1.292 -19.864 1.00 0.00 H new ATOM 945 N ARG A 62 3.710 -5.338 -18.410 1.00 0.00 N ATOM 946 CA ARG A 62 3.789 -6.825 -18.345 1.00 0.00 C ATOM 947 C ARG A 62 2.726 -7.350 -17.375 1.00 0.00 C ATOM 948 O ARG A 62 1.970 -8.250 -17.690 1.00 0.00 O ATOM 949 CB ARG A 62 5.182 -7.218 -17.835 1.00 0.00 C ATOM 950 CG ARG A 62 5.290 -8.738 -17.692 1.00 0.00 C ATOM 951 CD ARG A 62 6.596 -9.085 -16.974 1.00 0.00 C ATOM 952 NE ARG A 62 6.682 -10.560 -16.776 1.00 0.00 N ATOM 953 CZ ARG A 62 6.849 -11.349 -17.799 1.00 0.00 C ATOM 954 NH1 ARG A 62 6.947 -10.851 -19.003 1.00 0.00 N ATOM 955 NH2 ARG A 62 6.925 -12.640 -17.616 1.00 0.00 N ATOM 0 H ARG A 62 4.554 -4.849 -18.112 1.00 0.00 H new ATOM 0 HA ARG A 62 3.617 -7.252 -19.333 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.944 -6.856 -18.525 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.372 -6.742 -16.873 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.439 -9.124 -17.131 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.264 -9.210 -18.674 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.448 -8.736 -17.558 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.640 -8.576 -16.011 1.00 0.00 H new ATOM 0 HE ARG A 62 6.610 -10.952 -15.837 1.00 0.00 H new ATOM 0 HH11 ARG A 62 6.893 -9.842 -19.144 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.078 -11.471 -19.802 1.00 0.00 H new ATOM 0 HH21 ARG A 62 6.854 -13.027 -16.675 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.056 -13.261 -18.414 1.00 0.00 H new ATOM 969 N ALA A 63 2.665 -6.793 -16.197 1.00 0.00 N ATOM 970 CA ALA A 63 1.654 -7.253 -15.204 1.00 0.00 C ATOM 971 C ALA A 63 0.265 -6.771 -15.620 1.00 0.00 C ATOM 972 O ALA A 63 -0.728 -7.427 -15.381 1.00 0.00 O ATOM 973 CB ALA A 63 1.998 -6.688 -13.824 1.00 0.00 C ATOM 0 H ALA A 63 3.273 -6.038 -15.879 1.00 0.00 H new ATOM 0 HA ALA A 63 1.660 -8.342 -15.163 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.258 -7.025 -13.098 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.986 -7.037 -13.524 1.00 0.00 H new ATOM 0 HB3 ALA A 63 1.995 -5.599 -13.866 1.00 0.00 H new ATOM 979 N THR A 64 0.184 -5.626 -16.237 1.00 0.00 N ATOM 980 CA THR A 64 -1.144 -5.103 -16.654 1.00 0.00 C ATOM 981 C THR A 64 -1.882 -6.170 -17.462 1.00 0.00 C ATOM 982 O THR A 64 -3.032 -6.472 -17.211 1.00 0.00 O ATOM 983 CB THR A 64 -0.937 -3.857 -17.512 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.139 -2.928 -16.795 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.287 -3.220 -17.834 1.00 0.00 C ATOM 0 H THR A 64 0.979 -5.031 -16.470 1.00 0.00 H new ATOM 0 HA THR A 64 -1.736 -4.849 -15.775 1.00 0.00 H new ATOM 0 HB THR A 64 -0.440 -4.135 -18.442 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.783 -3.256 -16.749 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.133 -2.331 -18.446 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.905 -3.934 -18.379 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.787 -2.940 -16.907 1.00 0.00 H new ATOM 993 N GLN A 65 -1.229 -6.748 -18.428 1.00 0.00 N ATOM 994 CA GLN A 65 -1.891 -7.802 -19.245 1.00 0.00 C ATOM 995 C GLN A 65 -1.934 -9.125 -18.475 1.00 0.00 C ATOM 996 O GLN A 65 -2.973 -9.717 -18.292 1.00 0.00 O ATOM 997 CB GLN A 65 -1.111 -8.011 -20.543 1.00 0.00 C ATOM 998 CG GLN A 65 0.084 -7.059 -20.586 1.00 0.00 C ATOM 999 CD GLN A 65 0.870 -7.301 -21.875 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.696 -8.313 -22.525 1.00 0.00 O ATOM 1001 NE2 GLN A 65 1.734 -6.410 -22.277 1.00 0.00 N ATOM 0 H GLN A 65 -0.266 -6.537 -18.688 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.909 -7.481 -19.467 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.768 -9.043 -20.610 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.760 -7.834 -21.401 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.257 -6.025 -20.542 1.00 0.00 H new ATOM 0 HG3 GLN A 65 0.725 -7.220 -19.719 1.00 0.00 H new ATOM 0 HE21 GLN A 65 1.881 -5.560 -21.732 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.262 -6.563 -23.136 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.804 -9.613 -18.060 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.771 -10.924 -17.349 1.00 0.00 C ATOM 1012 C GLU A 66 -1.616 -10.911 -16.065 1.00 0.00 C ATOM 1013 O GLU A 66 -2.336 -11.850 -15.794 1.00 0.00 O ATOM 1014 CB GLU A 66 0.676 -11.256 -16.988 1.00 0.00 C ATOM 1015 CG GLU A 66 0.747 -12.668 -16.405 1.00 0.00 C ATOM 1016 CD GLU A 66 2.178 -12.961 -15.951 1.00 0.00 C ATOM 1017 OE1 GLU A 66 3.016 -12.086 -16.097 1.00 0.00 O ATOM 1018 OE2 GLU A 66 2.413 -14.055 -15.465 1.00 0.00 O ATOM 0 H GLU A 66 0.103 -9.163 -18.181 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.192 -11.676 -18.017 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.308 -11.185 -17.873 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.056 -10.534 -16.266 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.061 -12.760 -15.563 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.435 -13.398 -17.152 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.522 -9.893 -15.255 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.312 -9.902 -13.986 1.00 0.00 C ATOM 1028 C GLU A 67 -3.805 -9.645 -14.238 1.00 0.00 C ATOM 1029 O GLU A 67 -4.647 -10.238 -13.593 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.749 -8.861 -13.020 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.317 -9.254 -12.664 1.00 0.00 C ATOM 1032 CD GLU A 67 0.182 -8.404 -11.497 1.00 0.00 C ATOM 1033 OE1 GLU A 67 1.341 -8.543 -11.143 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -0.605 -7.638 -10.970 1.00 0.00 O ATOM 0 H GLU A 67 -0.944 -9.067 -15.410 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.225 -10.895 -13.544 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.768 -7.871 -13.477 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.362 -8.809 -12.120 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.276 -10.311 -12.399 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.332 -9.117 -13.529 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.152 -8.785 -15.159 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.607 -8.531 -15.414 1.00 0.00 C ATOM 1044 C ALA A 68 -5.982 -9.033 -16.804 1.00 0.00 C ATOM 1045 O ALA A 68 -7.127 -9.327 -17.080 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.902 -7.037 -15.339 1.00 0.00 C ATOM 0 H ALA A 68 -3.504 -8.253 -15.740 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.188 -9.057 -14.657 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.962 -6.866 -15.526 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.643 -6.664 -14.348 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.312 -6.511 -16.090 1.00 0.00 H new ATOM 1052 N GLY A 69 -5.035 -9.139 -17.685 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.361 -9.622 -19.051 1.00 0.00 C ATOM 1054 C GLY A 69 -5.470 -8.440 -20.008 1.00 0.00 C ATOM 1055 O GLY A 69 -5.815 -8.604 -21.161 1.00 0.00 O ATOM 0 H GLY A 69 -4.054 -8.914 -17.522 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.590 -10.310 -19.396 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.299 -10.176 -19.036 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.181 -7.245 -19.558 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.286 -6.091 -20.485 1.00 0.00 C ATOM 1061 C ILE A 70 -3.908 -5.765 -21.052 1.00 0.00 C ATOM 1062 O ILE A 70 -2.976 -5.483 -20.325 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.805 -4.849 -19.763 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.935 -5.220 -18.813 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.339 -3.865 -20.804 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.347 -3.976 -18.026 1.00 0.00 C ATOM 0 H ILE A 70 -4.883 -7.026 -18.607 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.981 -6.364 -21.279 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.992 -4.402 -19.191 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.785 -5.611 -19.372 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.612 -6.007 -18.132 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.713 -2.972 -20.303 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.537 -3.588 -21.488 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.148 -4.332 -21.365 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.157 -4.230 -17.342 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.494 -3.606 -17.457 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.685 -3.204 -18.717 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.775 -5.780 -22.343 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.463 -5.456 -22.955 1.00 0.00 C ATOM 1080 C GLU A 71 -2.377 -3.950 -23.172 1.00 0.00 C ATOM 1081 O GLU A 71 -3.369 -3.250 -23.157 1.00 0.00 O ATOM 1082 CB GLU A 71 -2.326 -6.176 -24.295 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.384 -5.657 -25.266 1.00 0.00 C ATOM 1084 CD GLU A 71 -3.321 -6.463 -26.561 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -4.247 -6.362 -27.347 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -2.344 -7.170 -26.745 1.00 0.00 O ATOM 0 H GLU A 71 -4.520 -6.003 -23.003 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.659 -5.781 -22.294 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.330 -6.014 -24.706 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.442 -7.251 -24.155 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.375 -5.741 -24.820 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.216 -4.600 -25.474 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.198 -3.443 -23.368 1.00 0.00 N ATOM 1095 CA ALA A 72 -1.049 -1.982 -23.584 1.00 0.00 C ATOM 1096 C ALA A 72 -1.740 -1.587 -24.891 1.00 0.00 C ATOM 1097 O ALA A 72 -2.153 -0.457 -25.077 1.00 0.00 O ATOM 1098 CB ALA A 72 0.433 -1.633 -23.661 1.00 0.00 C ATOM 0 H ALA A 72 -0.329 -3.977 -23.388 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.507 -1.440 -22.757 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.546 -0.561 -23.820 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.922 -1.916 -22.729 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.891 -2.173 -24.490 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.857 -2.513 -25.803 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.506 -2.205 -27.110 1.00 0.00 C ATOM 1106 C GLY A 73 -3.899 -1.609 -26.891 1.00 0.00 C ATOM 1107 O GLY A 73 -4.338 -0.758 -27.638 1.00 0.00 O ATOM 0 H GLY A 73 -1.530 -3.474 -25.699 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.889 -1.505 -27.673 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.583 -3.113 -27.707 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.603 -2.043 -25.881 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.966 -1.482 -25.642 1.00 0.00 C ATOM 1113 C GLN A 74 -5.902 -0.419 -24.544 1.00 0.00 C ATOM 1114 O GLN A 74 -6.903 0.143 -24.150 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.938 -2.600 -25.247 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.373 -3.400 -24.076 1.00 0.00 C ATOM 1117 CD GLN A 74 -7.041 -4.776 -24.039 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -8.090 -4.969 -24.622 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -6.475 -5.749 -23.379 1.00 0.00 N ATOM 0 H GLN A 74 -4.299 -2.754 -25.216 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.327 -1.020 -26.561 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.903 -2.173 -24.973 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.111 -3.259 -26.098 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.294 -3.509 -24.181 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.550 -2.871 -23.139 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -5.595 -5.589 -22.889 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.913 -6.670 -23.353 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.724 -0.129 -24.055 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.591 0.908 -22.991 1.00 0.00 C ATOM 1130 C LEU A 75 -3.801 2.101 -23.510 1.00 0.00 C ATOM 1131 O LEU A 75 -2.918 1.972 -24.335 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.831 0.350 -21.793 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.564 -0.849 -21.224 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.615 -1.616 -20.310 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.759 -0.363 -20.406 1.00 0.00 C ATOM 0 H LEU A 75 -3.850 -0.566 -24.347 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.597 1.209 -22.700 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.824 0.061 -22.094 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.727 1.119 -21.028 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.908 -1.494 -22.033 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.131 -2.482 -19.894 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.749 -1.950 -20.882 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.286 -0.966 -19.500 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.291 -1.221 -19.994 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.409 0.272 -19.592 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.431 0.207 -21.047 1.00 0.00 H new ATOM 1147 N THR A 76 -4.090 3.257 -22.993 1.00 0.00 N ATOM 1148 CA THR A 76 -3.337 4.468 -23.401 1.00 0.00 C ATOM 1149 C THR A 76 -2.596 4.990 -22.175 1.00 0.00 C ATOM 1150 O THR A 76 -3.202 5.396 -21.204 1.00 0.00 O ATOM 1151 CB THR A 76 -4.310 5.533 -23.911 1.00 0.00 C ATOM 1152 OG1 THR A 76 -4.415 5.434 -25.324 1.00 0.00 O ATOM 1153 CG2 THR A 76 -3.803 6.923 -23.528 1.00 0.00 C ATOM 0 H THR A 76 -4.821 3.416 -22.300 1.00 0.00 H new ATOM 0 HA THR A 76 -2.633 4.231 -24.199 1.00 0.00 H new ATOM 0 HB THR A 76 -5.290 5.375 -23.460 1.00 0.00 H new ATOM 0 HG1 THR A 76 -5.039 6.114 -25.654 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.499 7.678 -23.893 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.725 6.996 -22.443 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.822 7.088 -23.974 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.294 4.974 -22.189 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.561 5.465 -20.996 1.00 0.00 C ATOM 1163 C ILE A 77 -0.710 6.978 -20.900 1.00 0.00 C ATOM 1164 O ILE A 77 0.107 7.724 -21.399 1.00 0.00 O ATOM 1165 CB ILE A 77 0.923 5.121 -21.096 1.00 0.00 C ATOM 1166 CG1 ILE A 77 1.099 3.602 -21.219 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.634 5.627 -19.836 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.321 2.991 -19.834 1.00 0.00 C ATOM 0 H ILE A 77 -0.715 4.647 -22.962 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.978 4.985 -20.111 1.00 0.00 H new ATOM 0 HB ILE A 77 1.353 5.596 -21.978 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.217 3.161 -21.684 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.947 3.376 -21.866 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.696 5.387 -19.896 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.510 6.707 -19.757 1.00 0.00 H new ATOM 0 HG23 ILE A 77 1.203 5.147 -18.957 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.445 1.912 -19.928 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.216 3.422 -19.386 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.460 3.203 -19.200 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.727 7.438 -20.235 1.00 0.00 N ATOM 1181 CA ILE A 78 -1.895 8.905 -20.083 1.00 0.00 C ATOM 1182 C ILE A 78 -0.581 9.455 -19.578 1.00 0.00 C ATOM 1183 O ILE A 78 -0.112 10.501 -19.984 1.00 0.00 O ATOM 1184 CB ILE A 78 -2.957 9.205 -19.026 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.356 9.029 -19.618 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.774 10.638 -18.517 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.722 7.544 -19.611 1.00 0.00 C ATOM 0 H ILE A 78 -2.446 6.866 -19.792 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.191 9.346 -21.035 1.00 0.00 H new ATOM 0 HB ILE A 78 -2.845 8.510 -18.194 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.083 9.598 -19.039 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.385 9.418 -20.636 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.530 10.856 -17.763 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.782 10.744 -18.078 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.879 11.336 -19.348 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.719 7.413 -20.032 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.000 6.988 -20.209 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.709 7.171 -18.587 1.00 0.00 H new ATOM 1199 N GLU A 79 0.003 8.744 -18.666 1.00 0.00 N ATOM 1200 CA GLU A 79 1.280 9.190 -18.075 1.00 0.00 C ATOM 1201 C GLU A 79 1.000 10.420 -17.210 1.00 0.00 C ATOM 1202 O GLU A 79 0.107 10.406 -16.386 1.00 0.00 O ATOM 1203 CB GLU A 79 2.266 9.518 -19.201 1.00 0.00 C ATOM 1204 CG GLU A 79 3.575 8.781 -18.935 1.00 0.00 C ATOM 1205 CD GLU A 79 4.586 9.115 -20.033 1.00 0.00 C ATOM 1206 OE1 GLU A 79 4.230 9.859 -20.933 1.00 0.00 O ATOM 1207 OE2 GLU A 79 5.698 8.618 -19.957 1.00 0.00 O ATOM 0 H GLU A 79 -0.356 7.862 -18.301 1.00 0.00 H new ATOM 0 HA GLU A 79 1.721 8.410 -17.454 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.853 9.219 -20.164 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.441 10.593 -19.249 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.973 9.067 -17.961 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.399 7.706 -18.904 1.00 0.00 H new ATOM 1215 N GLY A 80 1.736 11.480 -17.374 1.00 0.00 N ATOM 1216 CA GLY A 80 1.475 12.682 -16.540 1.00 0.00 C ATOM 1217 C GLY A 80 1.778 12.339 -15.084 1.00 0.00 C ATOM 1218 O GLY A 80 2.630 12.939 -14.462 1.00 0.00 O ATOM 0 H GLY A 80 2.501 11.567 -18.043 1.00 0.00 H new ATOM 0 HA2 GLY A 80 2.097 13.514 -16.870 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.437 12.998 -16.646 1.00 0.00 H new ATOM 1222 N PHE A 81 1.098 11.365 -14.536 1.00 0.00 N ATOM 1223 CA PHE A 81 1.375 10.983 -13.123 1.00 0.00 C ATOM 1224 C PHE A 81 2.149 9.668 -13.098 1.00 0.00 C ATOM 1225 O PHE A 81 1.680 8.648 -13.564 1.00 0.00 O ATOM 1226 CB PHE A 81 0.066 10.793 -12.358 1.00 0.00 C ATOM 1227 CG PHE A 81 0.380 10.651 -10.888 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.836 9.428 -10.381 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.236 11.751 -10.039 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.143 9.306 -9.020 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.545 11.633 -8.679 1.00 0.00 C ATOM 1232 CZ PHE A 81 0.998 10.409 -8.169 1.00 0.00 C ATOM 0 H PHE A 81 0.370 10.823 -15.002 1.00 0.00 H new ATOM 0 HA PHE A 81 1.957 11.776 -12.654 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.595 11.644 -12.523 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.458 9.908 -12.720 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.951 8.579 -11.039 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -0.114 12.694 -10.433 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.491 8.362 -8.627 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.434 12.484 -8.024 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.235 10.316 -7.120 1.00 0.00 H new ATOM 1242 N LYS A 82 3.325 9.678 -12.542 1.00 0.00 N ATOM 1243 CA LYS A 82 4.124 8.429 -12.467 1.00 0.00 C ATOM 1244 C LYS A 82 5.169 8.558 -11.376 1.00 0.00 C ATOM 1245 O LYS A 82 6.078 9.352 -11.471 1.00 0.00 O ATOM 1246 CB LYS A 82 4.841 8.175 -13.786 1.00 0.00 C ATOM 1247 CG LYS A 82 5.837 7.027 -13.597 1.00 0.00 C ATOM 1248 CD LYS A 82 7.172 7.540 -13.047 1.00 0.00 C ATOM 1249 CE LYS A 82 8.307 6.755 -13.707 1.00 0.00 C ATOM 1250 NZ LYS A 82 8.332 7.050 -15.167 1.00 0.00 N ATOM 0 H LYS A 82 3.768 10.501 -12.135 1.00 0.00 H new ATOM 0 HA LYS A 82 3.447 7.602 -12.252 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.120 7.924 -14.564 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.361 9.076 -14.112 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.419 6.287 -12.914 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.002 6.524 -14.550 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.281 8.605 -13.251 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.207 7.417 -11.964 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.261 7.025 -13.254 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.167 5.686 -13.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.301 6.938 -15.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 7.700 6.392 -15.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.013 8.026 -15.329 1.00 0.00 H new ATOM 1264 N ARG A 83 5.071 7.762 -10.359 1.00 0.00 N ATOM 1265 CA ARG A 83 6.086 7.820 -9.281 1.00 0.00 C ATOM 1266 C ARG A 83 6.262 6.425 -8.708 1.00 0.00 C ATOM 1267 O ARG A 83 5.500 5.526 -8.999 1.00 0.00 O ATOM 1268 CB ARG A 83 5.643 8.789 -8.183 1.00 0.00 C ATOM 1269 CG ARG A 83 5.696 10.228 -8.712 1.00 0.00 C ATOM 1270 CD ARG A 83 7.133 10.579 -9.104 1.00 0.00 C ATOM 1271 NE ARG A 83 7.518 11.873 -8.482 1.00 0.00 N ATOM 1272 CZ ARG A 83 8.540 12.537 -8.942 1.00 0.00 C ATOM 1273 NH1 ARG A 83 9.212 12.076 -9.963 1.00 0.00 N ATOM 1274 NH2 ARG A 83 8.892 13.662 -8.383 1.00 0.00 N ATOM 0 H ARG A 83 4.332 7.072 -10.226 1.00 0.00 H new ATOM 0 HA ARG A 83 7.033 8.178 -9.686 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.631 8.548 -7.858 1.00 0.00 H new ATOM 0 HB3 ARG A 83 6.290 8.687 -7.312 1.00 0.00 H new ATOM 0 HG2 ARG A 83 5.037 10.334 -9.574 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.337 10.920 -7.950 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.812 9.791 -8.778 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.219 10.646 -10.189 1.00 0.00 H new ATOM 0 HE ARG A 83 6.982 12.241 -7.696 1.00 0.00 H new ATOM 0 HH11 ARG A 83 8.936 11.196 -10.400 1.00 0.00 H new ATOM 0 HH12 ARG A 83 10.012 12.596 -10.323 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.367 14.022 -7.586 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.692 14.182 -8.743 1.00 0.00 H new ATOM 1288 N GLU A 84 7.262 6.226 -7.905 1.00 0.00 N ATOM 1289 CA GLU A 84 7.474 4.875 -7.339 1.00 0.00 C ATOM 1290 C GLU A 84 6.526 4.656 -6.166 1.00 0.00 C ATOM 1291 O GLU A 84 6.781 5.074 -5.055 1.00 0.00 O ATOM 1292 CB GLU A 84 8.918 4.741 -6.864 1.00 0.00 C ATOM 1293 CG GLU A 84 9.856 4.840 -8.065 1.00 0.00 C ATOM 1294 CD GLU A 84 10.197 6.307 -8.338 1.00 0.00 C ATOM 1295 OE1 GLU A 84 10.930 6.558 -9.280 1.00 0.00 O ATOM 1296 OE2 GLU A 84 9.718 7.156 -7.602 1.00 0.00 O ATOM 0 H GLU A 84 7.937 6.935 -7.618 1.00 0.00 H new ATOM 0 HA GLU A 84 7.275 4.127 -8.106 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.149 5.524 -6.142 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.059 3.787 -6.356 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.768 4.275 -7.873 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.385 4.397 -8.943 1.00 0.00 H new ATOM 1304 N LEU A 85 5.447 3.969 -6.404 1.00 0.00 N ATOM 1305 CA LEU A 85 4.497 3.686 -5.304 1.00 0.00 C ATOM 1306 C LEU A 85 5.203 2.731 -4.350 1.00 0.00 C ATOM 1307 O LEU A 85 5.750 1.732 -4.766 1.00 0.00 O ATOM 1308 CB LEU A 85 3.243 3.008 -5.863 1.00 0.00 C ATOM 1309 CG LEU A 85 2.041 3.367 -4.984 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.179 4.430 -5.665 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.185 2.128 -4.725 1.00 0.00 C ATOM 0 H LEU A 85 5.184 3.592 -7.315 1.00 0.00 H new ATOM 0 HA LEU A 85 4.198 4.605 -4.800 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.067 3.331 -6.889 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.380 1.927 -5.888 1.00 0.00 H new ATOM 0 HG LEU A 85 2.419 3.756 -4.038 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.330 4.673 -5.027 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.774 5.327 -5.835 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.818 4.048 -6.620 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.334 2.398 -4.099 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.825 1.729 -5.674 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.784 1.372 -4.217 1.00 0.00 H new ATOM 1323 N ASN A 86 5.224 3.023 -3.086 1.00 0.00 N ATOM 1324 CA ASN A 86 5.932 2.111 -2.150 1.00 0.00 C ATOM 1325 C ASN A 86 5.024 1.766 -0.978 1.00 0.00 C ATOM 1326 O ASN A 86 4.488 2.630 -0.312 1.00 0.00 O ATOM 1327 CB ASN A 86 7.211 2.786 -1.659 1.00 0.00 C ATOM 1328 CG ASN A 86 8.157 2.969 -2.849 1.00 0.00 C ATOM 1329 OD1 ASN A 86 9.208 3.568 -2.724 1.00 0.00 O ATOM 1330 ND2 ASN A 86 7.824 2.465 -4.009 1.00 0.00 N ATOM 0 H ASN A 86 4.789 3.842 -2.662 1.00 0.00 H new ATOM 0 HA ASN A 86 6.194 1.187 -2.665 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.980 3.751 -1.208 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.686 2.180 -0.888 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.446 2.574 -4.810 1.00 0.00 H new ATOM 0 HD22 ASN A 86 6.942 1.963 -4.113 1.00 0.00 H new ATOM 1480 N THR A 95 9.639 -1.529 -3.947 1.00 0.00 N ATOM 1481 CA THR A 95 9.180 -0.277 -4.608 1.00 0.00 C ATOM 1482 C THR A 95 8.185 -0.629 -5.710 1.00 0.00 C ATOM 1483 O THR A 95 8.292 -1.649 -6.360 1.00 0.00 O ATOM 1484 CB THR A 95 10.369 0.471 -5.220 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.889 1.393 -4.270 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.896 1.220 -6.469 1.00 0.00 C ATOM 0 HA THR A 95 8.706 0.364 -3.865 1.00 0.00 H new ATOM 0 HB THR A 95 11.152 -0.236 -5.494 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.650 1.871 -4.661 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.736 1.756 -6.912 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.498 0.508 -7.192 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.117 1.931 -6.194 1.00 0.00 H new ATOM 1494 N VAL A 96 7.214 0.211 -5.913 1.00 0.00 N ATOM 1495 CA VAL A 96 6.196 -0.060 -6.961 1.00 0.00 C ATOM 1496 C VAL A 96 5.937 1.218 -7.756 1.00 0.00 C ATOM 1497 O VAL A 96 5.780 2.275 -7.192 1.00 0.00 O ATOM 1498 CB VAL A 96 4.915 -0.525 -6.275 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.750 -0.533 -7.271 1.00 0.00 C ATOM 1500 CG2 VAL A 96 5.135 -1.939 -5.730 1.00 0.00 C ATOM 0 H VAL A 96 7.080 1.079 -5.395 1.00 0.00 H new ATOM 0 HA VAL A 96 6.546 -0.832 -7.646 1.00 0.00 H new ATOM 0 HB VAL A 96 4.671 0.158 -5.461 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.843 -0.867 -6.767 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.599 0.473 -7.662 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.979 -1.211 -8.093 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.226 -2.284 -5.237 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.380 -2.612 -6.552 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.956 -1.929 -5.013 1.00 0.00 H new ATOM 1510 N ILE A 97 5.889 1.138 -9.059 1.00 0.00 N ATOM 1511 CA ILE A 97 5.634 2.368 -9.863 1.00 0.00 C ATOM 1512 C ILE A 97 4.246 2.272 -10.484 1.00 0.00 C ATOM 1513 O ILE A 97 3.821 1.221 -10.921 1.00 0.00 O ATOM 1514 CB ILE A 97 6.695 2.511 -10.949 1.00 0.00 C ATOM 1515 CG1 ILE A 97 8.036 2.031 -10.391 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.808 3.987 -11.343 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.170 2.443 -11.329 1.00 0.00 C ATOM 0 H ILE A 97 6.014 0.281 -9.598 1.00 0.00 H new ATOM 0 HA ILE A 97 5.683 3.247 -9.220 1.00 0.00 H new ATOM 0 HB ILE A 97 6.424 1.918 -11.823 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.200 2.455 -9.401 1.00 0.00 H new ATOM 0 HG13 ILE A 97 8.024 0.947 -10.275 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.565 4.099 -12.119 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.847 4.338 -11.719 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.093 4.576 -10.471 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.121 2.097 -10.924 1.00 0.00 H new ATOM 0 HD12 ILE A 97 9.010 1.997 -12.311 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.189 3.529 -11.422 1.00 0.00 H new ATOM 1529 N TYR A 98 3.521 3.355 -10.482 1.00 0.00 N ATOM 1530 CA TYR A 98 2.131 3.336 -11.022 1.00 0.00 C ATOM 1531 C TYR A 98 1.963 4.354 -12.159 1.00 0.00 C ATOM 1532 O TYR A 98 2.286 5.517 -12.026 1.00 0.00 O ATOM 1533 CB TYR A 98 1.192 3.700 -9.862 1.00 0.00 C ATOM 1534 CG TYR A 98 0.773 2.474 -9.062 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.239 1.185 -9.382 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.102 2.643 -7.984 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.832 0.084 -8.622 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.506 1.541 -7.226 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.044 0.261 -7.546 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.448 -0.825 -6.793 1.00 0.00 O ATOM 0 H TYR A 98 3.833 4.259 -10.127 1.00 0.00 H new ATOM 0 HA TYR A 98 1.903 2.351 -11.429 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.689 4.411 -9.202 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.305 4.197 -10.255 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.912 1.046 -10.215 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.467 3.629 -7.737 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.194 -0.904 -8.866 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.177 1.678 -6.391 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.217 -0.572 -6.240 1.00 0.00 H new ATOM 1550 N TRP A 99 1.431 3.915 -13.277 1.00 0.00 N ATOM 1551 CA TRP A 99 1.206 4.834 -14.436 1.00 0.00 C ATOM 1552 C TRP A 99 -0.292 4.953 -14.707 1.00 0.00 C ATOM 1553 O TRP A 99 -1.058 4.056 -14.413 1.00 0.00 O ATOM 1554 CB TRP A 99 1.865 4.274 -15.696 1.00 0.00 C ATOM 1555 CG TRP A 99 3.300 4.666 -15.751 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.768 5.835 -16.242 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.459 3.903 -15.328 1.00 0.00 C ATOM 1558 NE1 TRP A 99 5.146 5.836 -16.145 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.618 4.667 -15.584 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.615 2.636 -14.749 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.889 4.192 -15.276 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.893 2.151 -14.439 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.031 2.930 -14.701 1.00 0.00 C ATOM 0 H TRP A 99 1.141 2.950 -13.435 1.00 0.00 H new ATOM 0 HA TRP A 99 1.636 5.805 -14.191 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.778 3.188 -15.707 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.346 4.644 -16.580 1.00 0.00 H new ATOM 0 HD1 TRP A 99 3.165 6.636 -16.644 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.741 6.606 -16.450 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.746 2.030 -14.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.760 4.797 -15.481 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.003 1.172 -13.996 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.013 2.553 -14.458 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.716 6.035 -15.297 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.162 6.181 -15.612 1.00 0.00 C ATOM 1576 C LEU A 100 -2.450 5.486 -16.940 1.00 0.00 C ATOM 1577 O LEU A 100 -1.706 5.608 -17.892 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.530 7.665 -15.706 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.577 8.278 -14.304 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.912 9.768 -14.407 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.662 7.583 -13.480 1.00 0.00 C ATOM 0 H LEU A 100 -0.127 6.820 -15.573 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.759 5.725 -14.822 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.799 8.192 -16.319 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.497 7.779 -16.195 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.607 8.150 -13.824 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.945 10.203 -13.408 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.148 10.273 -14.998 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.882 9.890 -14.889 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.696 8.019 -12.482 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.629 7.714 -13.966 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.436 6.519 -13.404 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.523 4.746 -17.007 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.854 4.032 -18.272 1.00 0.00 C ATOM 1595 C ALA A 101 -5.368 4.034 -18.472 1.00 0.00 C ATOM 1596 O ALA A 101 -6.129 3.903 -17.533 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.355 2.582 -18.180 1.00 0.00 C ATOM 0 H ALA A 101 -4.183 4.605 -16.242 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.374 4.533 -19.113 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.595 2.055 -19.104 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.275 2.578 -18.030 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.840 2.083 -17.341 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.808 4.170 -19.692 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.271 4.173 -19.966 1.00 0.00 C ATOM 1605 C GLU A 102 -7.591 3.075 -20.979 1.00 0.00 C ATOM 1606 O GLU A 102 -6.932 2.948 -21.992 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.676 5.528 -20.552 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.194 5.566 -20.743 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.582 6.851 -21.475 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.752 7.001 -21.785 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.704 7.667 -21.712 1.00 0.00 O ATOM 0 H GLU A 102 -5.214 4.280 -20.514 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.818 3.996 -19.040 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.362 6.333 -19.887 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.174 5.689 -21.506 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.522 4.697 -21.313 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.695 5.520 -19.776 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.599 2.285 -20.730 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.936 1.213 -21.706 1.00 0.00 C ATOM 1621 C VAL A 103 -9.817 1.790 -22.805 1.00 0.00 C ATOM 1622 O VAL A 103 -10.963 2.126 -22.587 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.682 0.061 -21.018 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.753 -0.665 -20.050 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.885 0.607 -20.249 1.00 0.00 C ATOM 0 H VAL A 103 -9.196 2.334 -19.905 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.008 0.827 -22.129 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.023 -0.638 -21.781 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.294 -1.480 -19.569 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.901 -1.069 -20.597 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.399 0.034 -19.292 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.410 -0.215 -19.763 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.543 1.316 -19.494 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.561 1.111 -20.940 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.301 1.883 -23.996 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.124 2.409 -25.111 1.00 0.00 C ATOM 1637 C LYS A 104 -11.180 1.354 -25.422 1.00 0.00 C ATOM 1638 O LYS A 104 -12.097 1.565 -26.191 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.232 2.663 -26.329 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.560 1.358 -26.756 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.429 1.665 -27.739 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.301 2.405 -27.010 1.00 0.00 C ATOM 1643 NZ LYS A 104 -4.989 2.033 -27.610 1.00 0.00 N ATOM 0 H LYS A 104 -8.348 1.618 -24.243 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.601 3.353 -24.846 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.827 3.063 -27.150 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.476 3.411 -26.089 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.166 0.837 -25.883 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.290 0.695 -27.221 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.050 0.740 -28.173 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.804 2.273 -28.562 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.453 3.482 -27.082 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.312 2.152 -25.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.222 2.496 -27.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -4.867 1.001 -27.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -4.961 2.342 -28.603 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.053 0.219 -24.790 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.033 -0.879 -24.986 1.00 0.00 C ATOM 1659 C ASP A 105 -12.995 -0.890 -23.800 1.00 0.00 C ATOM 1660 O ASP A 105 -12.718 -1.469 -22.769 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.296 -2.216 -25.036 1.00 0.00 C ATOM 1662 CG ASP A 105 -10.677 -2.417 -26.420 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -10.977 -1.630 -27.302 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -9.910 -3.352 -26.572 1.00 0.00 O ATOM 0 H ASP A 105 -10.299 0.006 -24.137 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.578 -0.727 -25.918 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.518 -2.241 -24.273 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -11.986 -3.030 -24.815 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.122 -0.257 -23.933 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.093 -0.241 -22.806 1.00 0.00 C ATOM 1672 C TYR A 106 -15.450 -1.682 -22.441 1.00 0.00 C ATOM 1673 O TYR A 106 -15.822 -1.980 -21.321 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.353 0.528 -23.225 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.320 0.603 -22.063 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.257 -0.419 -21.871 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.281 1.691 -21.180 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -19.155 -0.355 -20.796 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -18.177 1.755 -20.107 1.00 0.00 C ATOM 1680 CZ TYR A 106 -19.115 0.732 -19.914 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.999 0.796 -18.857 1.00 0.00 O ATOM 0 H TYR A 106 -14.414 0.249 -24.769 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.653 0.254 -21.940 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.085 1.533 -23.552 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -16.827 0.033 -24.073 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.288 -1.257 -22.551 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.559 2.480 -21.328 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.878 -1.144 -20.648 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -18.146 2.594 -19.427 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.835 1.614 -18.343 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.339 -2.577 -23.382 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.668 -4.006 -23.110 1.00 0.00 C ATOM 1693 C ASP A 107 -14.376 -4.811 -22.926 1.00 0.00 C ATOM 1694 O ASP A 107 -14.374 -6.020 -23.049 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.459 -4.577 -24.290 1.00 0.00 C ATOM 1696 CG ASP A 107 -15.570 -4.615 -25.535 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -16.106 -4.788 -26.617 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -14.367 -4.470 -25.387 1.00 0.00 O ATOM 0 H ASP A 107 -15.033 -2.380 -24.335 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.265 -4.072 -22.200 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.812 -5.580 -24.052 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -17.341 -3.965 -24.479 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.275 -4.161 -22.648 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.000 -4.920 -22.480 1.00 0.00 C ATOM 1706 C VAL A 108 -12.263 -6.175 -21.665 1.00 0.00 C ATOM 1707 O VAL A 108 -13.041 -6.178 -20.731 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.952 -4.063 -21.763 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.461 -3.665 -20.377 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.650 -4.859 -21.613 1.00 0.00 C ATOM 0 H VAL A 108 -13.203 -3.150 -22.531 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.621 -5.187 -23.466 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.768 -3.164 -22.352 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.710 -3.056 -19.874 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.383 -3.093 -20.479 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.654 -4.562 -19.789 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.906 -4.247 -21.103 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.840 -5.761 -21.030 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.277 -5.136 -22.599 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.606 -7.241 -22.009 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.795 -8.502 -21.257 1.00 0.00 C ATOM 1722 C GLU A 109 -10.665 -8.636 -20.248 1.00 0.00 C ATOM 1723 O GLU A 109 -9.530 -8.895 -20.597 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.762 -9.693 -22.211 1.00 0.00 C ATOM 1725 CG GLU A 109 -12.034 -10.974 -21.423 1.00 0.00 C ATOM 1726 CD GLU A 109 -13.458 -10.937 -20.867 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -13.702 -11.599 -19.872 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -14.280 -10.244 -21.444 1.00 0.00 O ATOM 0 H GLU A 109 -10.943 -7.292 -22.783 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.759 -8.484 -20.749 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.509 -9.568 -22.994 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.791 -9.753 -22.703 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.906 -11.844 -22.067 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.316 -11.072 -20.608 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.966 -8.459 -19.001 1.00 0.00 N ATOM 1737 CA ILE A 110 -9.913 -8.570 -17.960 1.00 0.00 C ATOM 1738 C ILE A 110 -9.552 -10.037 -17.767 1.00 0.00 C ATOM 1739 O ILE A 110 -10.117 -10.720 -16.936 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.446 -8.009 -16.649 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.086 -6.648 -16.912 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.298 -7.844 -15.649 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.125 -5.783 -17.697 1.00 0.00 C ATOM 0 H ILE A 110 -11.900 -8.241 -18.653 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.029 -8.011 -18.268 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.186 -8.694 -16.236 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -12.016 -6.772 -17.466 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.340 -6.165 -15.968 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.686 -7.442 -14.713 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -8.835 -8.813 -15.464 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.555 -7.159 -16.058 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.581 -4.811 -17.885 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.207 -5.648 -17.125 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.894 -6.265 -18.647 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.611 -10.530 -18.516 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.225 -11.956 -18.348 1.00 0.00 C ATOM 1757 C ARG A 111 -7.245 -12.060 -17.194 1.00 0.00 C ATOM 1758 O ARG A 111 -6.193 -11.453 -17.191 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.594 -12.482 -19.633 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.693 -13.100 -20.489 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.212 -13.250 -21.932 1.00 0.00 C ATOM 1762 NE ARG A 111 -9.311 -13.836 -22.747 1.00 0.00 N ATOM 1763 CZ ARG A 111 -9.385 -13.590 -24.026 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -8.479 -12.850 -24.602 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -10.369 -14.084 -24.726 1.00 0.00 N ATOM 0 H ARG A 111 -8.096 -10.015 -19.230 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.108 -12.558 -18.133 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.102 -11.673 -20.173 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.829 -13.224 -19.404 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -8.973 -14.074 -20.088 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.585 -12.474 -20.458 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -7.920 -12.280 -22.335 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.331 -13.890 -21.971 1.00 0.00 H new ATOM 0 HE ARG A 111 -10.009 -14.433 -22.303 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.712 -12.463 -24.053 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -8.538 -12.658 -25.602 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -11.078 -14.661 -24.273 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -10.429 -13.893 -25.726 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.597 -12.813 -16.199 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.708 -12.942 -15.021 1.00 0.00 C ATOM 1781 C LEU A 112 -5.824 -14.179 -15.177 1.00 0.00 C ATOM 1782 O LEU A 112 -6.273 -15.299 -15.040 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.572 -13.079 -13.769 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.749 -12.102 -13.855 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.560 -12.154 -12.561 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.224 -10.680 -14.073 1.00 0.00 C ATOM 0 H LEU A 112 -8.465 -13.347 -16.150 1.00 0.00 H new ATOM 0 HA LEU A 112 -6.071 -12.061 -14.937 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.939 -14.101 -13.677 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.978 -12.873 -12.879 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.388 -12.385 -14.692 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.396 -11.457 -12.627 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.941 -13.164 -12.410 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.923 -11.877 -11.721 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.064 -9.988 -14.134 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.581 -10.398 -13.240 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.654 -10.641 -15.001 1.00 0.00 H new ATOM 1798 N SER A 113 -4.564 -13.980 -15.452 1.00 0.00 N ATOM 1799 CA SER A 113 -3.645 -15.140 -15.606 1.00 0.00 C ATOM 1800 C SER A 113 -3.544 -15.868 -14.265 1.00 0.00 C ATOM 1801 O SER A 113 -3.993 -15.374 -13.252 1.00 0.00 O ATOM 1802 CB SER A 113 -2.263 -14.646 -16.029 1.00 0.00 C ATOM 1803 OG SER A 113 -2.384 -13.907 -17.237 1.00 0.00 O ATOM 0 H SER A 113 -4.133 -13.064 -15.576 1.00 0.00 H new ATOM 0 HA SER A 113 -4.028 -15.819 -16.368 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.831 -14.021 -15.247 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.589 -15.491 -16.171 1.00 0.00 H new ATOM 0 HG SER A 113 -2.655 -12.988 -17.032 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.969 -17.039 -14.250 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.858 -17.794 -12.971 1.00 0.00 C ATOM 1811 C HIS A 114 -2.232 -16.901 -11.888 1.00 0.00 C ATOM 1812 O HIS A 114 -1.085 -17.065 -11.525 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.965 -19.012 -13.195 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.542 -18.551 -13.339 1.00 0.00 C ATOM 1815 ND1 HIS A 114 0.498 -19.130 -12.628 1.00 0.00 N ATOM 1816 CD2 HIS A 114 0.026 -17.550 -14.088 1.00 0.00 C ATOM 1817 CE1 HIS A 114 1.629 -18.479 -12.960 1.00 0.00 C ATOM 1818 NE2 HIS A 114 1.393 -17.508 -13.844 1.00 0.00 N ATOM 0 H HIS A 114 -2.572 -17.504 -15.066 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.850 -18.108 -12.646 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -2.054 -19.704 -12.358 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -2.279 -19.551 -14.089 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -0.507 -16.897 -14.762 1.00 0.00 H new ATOM 0 HE1 HIS A 114 2.605 -18.713 -12.561 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.074 -16.869 -14.255 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.983 -15.977 -11.359 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.447 -15.085 -10.290 1.00 0.00 C ATOM 1829 C GLU A 115 -3.605 -14.361 -9.612 1.00 0.00 C ATOM 1830 O GLU A 115 -3.609 -14.150 -8.414 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.506 -14.034 -10.891 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.184 -14.674 -11.310 1.00 0.00 C ATOM 1833 CD GLU A 115 0.820 -13.570 -11.645 1.00 0.00 C ATOM 1834 OE1 GLU A 115 1.981 -13.888 -11.845 1.00 0.00 O ATOM 1835 OE2 GLU A 115 0.410 -12.422 -11.695 1.00 0.00 O ATOM 0 H GLU A 115 -3.952 -15.799 -11.622 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.900 -15.694 -9.571 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.979 -13.565 -11.754 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.320 -13.245 -10.162 1.00 0.00 H new ATOM 0 HG2 GLU A 115 0.201 -15.302 -10.507 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -0.336 -15.320 -12.175 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.583 -13.964 -10.377 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.741 -13.236 -9.797 1.00 0.00 C ATOM 1845 C HIS A 116 -7.043 -13.909 -10.235 1.00 0.00 C ATOM 1846 O HIS A 116 -7.169 -14.370 -11.352 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.725 -11.790 -10.301 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.419 -11.146 -9.932 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.243 -11.420 -10.619 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.086 -10.232 -8.964 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.265 -10.684 -10.056 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -2.728 -9.943 -9.048 1.00 0.00 N ATOM 0 H HIS A 116 -4.628 -14.114 -11.385 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.675 -13.251 -8.709 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.860 -11.769 -11.382 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.554 -11.232 -9.865 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -4.772 -9.804 -8.248 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.235 -10.693 -10.380 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.197 -9.299 -8.461 1.00 0.00 H new ATOM 1861 N GLN A 117 -8.014 -13.961 -9.367 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.314 -14.588 -9.735 1.00 0.00 C ATOM 1863 C GLN A 117 -10.434 -13.572 -9.518 1.00 0.00 C ATOM 1864 O GLN A 117 -11.603 -13.902 -9.554 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.564 -15.816 -8.860 1.00 0.00 C ATOM 1866 CG GLN A 117 -8.444 -16.833 -9.075 1.00 0.00 C ATOM 1867 CD GLN A 117 -8.686 -18.060 -8.193 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.557 -18.052 -7.345 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -7.948 -19.122 -8.360 1.00 0.00 N ATOM 0 H GLN A 117 -7.963 -13.595 -8.416 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.288 -14.895 -10.780 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -9.608 -15.525 -7.811 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.527 -16.262 -9.108 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -8.404 -17.129 -10.123 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -7.481 -16.384 -8.834 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -7.217 -19.128 -9.072 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -8.102 -19.946 -7.779 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.088 -12.336 -9.284 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.141 -11.311 -9.055 1.00 0.00 C ATOM 1880 C ALA A 118 -10.717 -9.975 -9.658 1.00 0.00 C ATOM 1881 O ALA A 118 -9.605 -9.526 -9.481 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.344 -11.123 -7.553 1.00 0.00 C ATOM 0 H ALA A 118 -9.128 -11.994 -9.242 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.065 -11.646 -9.526 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.115 -10.372 -7.381 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.652 -12.068 -7.106 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.410 -10.794 -7.098 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.613 -9.329 -10.348 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.293 -8.006 -10.941 1.00 0.00 C ATOM 1890 C TYR A 119 -12.590 -7.209 -11.069 1.00 0.00 C ATOM 1891 O TYR A 119 -13.589 -7.716 -11.540 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.653 -8.202 -12.310 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.700 -8.551 -13.329 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.190 -9.855 -13.409 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.162 -7.567 -14.205 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -13.155 -10.178 -14.367 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.125 -7.884 -15.164 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.621 -9.194 -15.249 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.569 -9.513 -16.199 1.00 0.00 O ATOM 0 H TYR A 119 -12.559 -9.665 -10.527 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.592 -7.464 -10.307 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.133 -7.292 -12.610 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.906 -8.994 -12.260 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.824 -10.613 -12.732 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.774 -6.561 -14.141 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.541 -11.185 -14.427 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.488 -7.123 -15.839 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.783 -8.716 -16.728 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.602 -5.980 -10.632 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.863 -5.186 -10.709 1.00 0.00 C ATOM 1911 C ARG A 120 -13.583 -3.759 -11.180 1.00 0.00 C ATOM 1912 O ARG A 120 -12.541 -3.198 -10.913 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.482 -5.094 -9.315 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.758 -6.487 -8.760 1.00 0.00 C ATOM 1915 CD ARG A 120 -14.759 -6.414 -7.230 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.004 -7.770 -6.665 1.00 0.00 N ATOM 1917 CZ ARG A 120 -15.693 -7.901 -5.567 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.109 -6.841 -4.930 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -15.951 -9.090 -5.096 1.00 0.00 N ATOM 0 H ARG A 120 -11.802 -5.494 -10.228 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.532 -5.681 -11.413 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.809 -4.557 -8.647 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.410 -4.524 -9.360 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.718 -6.854 -9.121 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.998 -7.189 -9.104 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -13.804 -6.028 -6.874 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.530 -5.722 -6.889 1.00 0.00 H new ATOM 0 HE ARG A 120 -14.633 -8.595 -7.137 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.895 -5.912 -5.292 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.649 -6.942 -4.070 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -15.613 -9.918 -5.587 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -16.490 -9.192 -4.236 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.538 -3.151 -11.826 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.375 -1.739 -12.262 1.00 0.00 C ATOM 1935 C TRP A 121 -15.187 -0.879 -11.290 1.00 0.00 C ATOM 1936 O TRP A 121 -16.403 -0.906 -11.301 1.00 0.00 O ATOM 1937 CB TRP A 121 -14.924 -1.570 -13.681 1.00 0.00 C ATOM 1938 CG TRP A 121 -13.960 -2.130 -14.679 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.023 -3.371 -15.221 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.800 -1.486 -15.274 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -12.974 -3.523 -16.113 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.192 -2.387 -16.178 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.222 -0.218 -15.115 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.052 -2.038 -16.903 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.076 0.132 -15.842 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.492 -0.774 -16.732 1.00 0.00 C ATOM 0 H TRP A 121 -15.432 -3.577 -12.072 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.325 -1.447 -12.263 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -15.885 -2.076 -13.769 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.100 -0.514 -13.887 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.769 -4.119 -14.995 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.801 -4.370 -16.655 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.662 0.491 -14.430 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.608 -2.742 -17.591 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.640 1.112 -15.713 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.608 -0.494 -17.286 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.537 -0.150 -10.418 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.298 0.664 -9.423 1.00 0.00 C ATOM 1959 C LEU A 122 -14.837 2.121 -9.441 1.00 0.00 C ATOM 1960 O LEU A 122 -13.900 2.486 -10.120 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.078 0.113 -8.011 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.634 -1.354 -8.059 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.268 -1.484 -7.394 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.647 -2.228 -7.314 1.00 0.00 C ATOM 0 H LEU A 122 -13.521 -0.083 -10.352 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.353 0.610 -9.693 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.324 0.709 -7.497 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -15.999 0.200 -7.435 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.574 -1.681 -9.097 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.946 -2.525 -7.425 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.545 -0.865 -7.924 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.335 -1.155 -6.357 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.326 -3.269 -7.351 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.711 -1.905 -6.275 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.625 -2.133 -7.785 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.500 2.953 -8.677 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.124 4.392 -8.619 1.00 0.00 C ATOM 1978 C GLY A 123 -13.985 4.597 -7.615 1.00 0.00 C ATOM 1979 O GLY A 123 -13.492 3.663 -7.013 1.00 0.00 O ATOM 0 H GLY A 123 -16.291 2.691 -8.088 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.815 4.736 -9.606 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -15.988 4.990 -8.329 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.561 5.819 -7.445 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.449 6.121 -6.496 1.00 0.00 C ATOM 1985 C LEU A 124 -12.793 5.665 -5.081 1.00 0.00 C ATOM 1986 O LEU A 124 -12.019 4.994 -4.429 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.216 7.634 -6.493 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.285 8.031 -5.344 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.030 7.160 -5.354 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.883 9.496 -5.518 1.00 0.00 C ATOM 0 H LEU A 124 -13.942 6.632 -7.929 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.554 5.588 -6.817 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.782 7.943 -7.444 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.169 8.154 -6.393 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.804 7.891 -4.396 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.377 7.453 -4.532 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.312 6.114 -5.238 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.504 7.291 -6.300 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.219 9.790 -4.705 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.368 9.621 -6.470 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.775 10.122 -5.503 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.938 6.029 -4.588 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.303 5.628 -3.204 1.00 0.00 C ATOM 2004 C GLU A 125 -14.289 4.106 -3.080 1.00 0.00 C ATOM 2005 O GLU A 125 -13.685 3.561 -2.178 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.690 6.172 -2.866 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.764 5.359 -3.588 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.123 6.041 -3.409 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -19.048 5.669 -4.110 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.217 6.922 -2.569 1.00 0.00 O ATOM 0 H GLU A 125 -14.637 6.585 -5.081 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.576 6.041 -2.504 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.853 6.129 -1.789 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.759 7.220 -3.158 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.523 5.277 -4.648 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.798 4.345 -3.189 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.928 3.406 -3.974 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.914 1.924 -3.879 1.00 0.00 C ATOM 2020 C GLU A 126 -13.493 1.420 -4.100 1.00 0.00 C ATOM 2021 O GLU A 126 -13.036 0.505 -3.451 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.829 1.323 -4.940 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.871 -0.187 -4.754 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.155 -0.742 -5.372 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.449 -1.901 -5.135 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.829 0.003 -6.068 1.00 0.00 O ATOM 0 H GLU A 126 -15.454 3.792 -4.758 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.266 1.626 -2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.832 1.742 -4.855 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.464 1.570 -5.937 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -15.001 -0.646 -5.223 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.829 -0.435 -3.693 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.787 2.019 -5.007 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.393 1.586 -5.261 1.00 0.00 C ATOM 2036 C ALA A 127 -10.547 1.912 -4.030 1.00 0.00 C ATOM 2037 O ALA A 127 -9.581 1.241 -3.722 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.854 2.345 -6.470 1.00 0.00 C ATOM 0 H ALA A 127 -13.115 2.792 -5.586 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.356 0.515 -5.458 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.828 2.034 -6.667 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.472 2.128 -7.341 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.876 3.416 -6.267 1.00 0.00 H new ATOM 2044 N CYS A 128 -10.907 2.955 -3.331 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.139 3.363 -2.122 1.00 0.00 C ATOM 2046 C CYS A 128 -10.255 2.300 -1.022 1.00 0.00 C ATOM 2047 O CYS A 128 -9.290 1.986 -0.354 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.696 4.693 -1.608 1.00 0.00 C ATOM 2049 SG CYS A 128 -10.810 4.644 0.199 1.00 0.00 S ATOM 0 H CYS A 128 -11.709 3.547 -3.549 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.087 3.471 -2.387 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.051 5.514 -1.920 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.679 4.879 -2.040 1.00 0.00 H new ATOM 0 HG CYS A 128 -11.928 4.080 0.548 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.422 1.745 -0.814 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.559 0.711 0.261 1.00 0.00 C ATOM 2057 C GLN A 129 -10.782 -0.542 -0.129 1.00 0.00 C ATOM 2058 O GLN A 129 -10.017 -1.083 0.647 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.029 0.318 0.473 1.00 0.00 C ATOM 2060 CG GLN A 129 -13.891 0.782 -0.699 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.545 2.115 -0.351 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -13.897 3.007 0.158 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -15.811 2.291 -0.605 1.00 0.00 N ATOM 0 H GLN A 129 -12.275 1.957 -1.332 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.166 1.138 1.183 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.108 -0.764 0.582 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.398 0.760 1.399 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.279 0.888 -1.595 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.655 0.037 -0.920 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.354 1.541 -1.033 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.258 3.179 -0.376 1.00 0.00 H new ATOM 2072 N LEU A 130 -10.984 -1.016 -1.322 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.277 -2.245 -1.767 1.00 0.00 C ATOM 2074 C LEU A 130 -8.763 -2.030 -1.702 1.00 0.00 C ATOM 2075 O LEU A 130 -8.024 -2.888 -1.264 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.685 -2.544 -3.203 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.211 -2.559 -3.310 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.608 -2.797 -4.758 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.785 -3.679 -2.445 1.00 0.00 C ATOM 0 H LEU A 130 -11.611 -0.604 -2.012 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.542 -3.079 -1.117 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.271 -1.791 -3.874 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.279 -3.506 -3.514 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.603 -1.602 -2.966 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.695 -2.809 -4.840 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.206 -1.999 -5.382 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.209 -3.755 -5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.872 -3.682 -2.528 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.393 -4.638 -2.784 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.501 -3.518 -1.405 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.290 -0.894 -2.133 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.824 -0.652 -2.089 1.00 0.00 C ATOM 2093 C ALA A 131 -6.357 -0.679 -0.633 1.00 0.00 C ATOM 2094 O ALA A 131 -5.405 -1.346 -0.290 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.507 0.708 -2.704 1.00 0.00 C ATOM 0 H ALA A 131 -8.850 -0.130 -2.510 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.308 -1.427 -2.655 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.431 0.881 -2.670 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.844 0.726 -3.740 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.018 1.490 -2.142 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.036 0.024 0.230 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.647 0.025 1.668 1.00 0.00 C ATOM 2103 C GLN A 132 -5.212 0.543 1.837 1.00 0.00 C ATOM 2104 O GLN A 132 -4.723 0.684 2.940 1.00 0.00 O ATOM 2105 CB GLN A 132 -6.760 -1.404 2.212 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.374 -1.958 2.568 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.495 -3.446 2.897 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -5.574 -4.273 2.011 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -5.519 -3.825 4.146 1.00 0.00 N ATOM 0 H GLN A 132 -7.846 0.600 0.001 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.313 0.686 2.223 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.399 -1.413 3.095 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.234 -2.045 1.469 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.686 -1.813 1.735 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -4.961 -1.418 3.420 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.453 -3.131 4.891 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -5.604 -4.815 4.377 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.531 0.832 0.761 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.135 1.341 0.890 1.00 0.00 C ATOM 2120 C PHE A 133 -3.143 2.865 0.747 1.00 0.00 C ATOM 2121 O PHE A 133 -3.841 3.416 -0.082 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.260 0.737 -0.208 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.626 -0.716 -0.417 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.246 -1.677 0.529 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.340 -1.106 -1.561 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.580 -3.022 0.333 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.672 -2.449 -1.754 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.291 -3.410 -0.808 1.00 0.00 C ATOM 0 H PHE A 133 -4.877 0.739 -0.194 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.735 1.060 1.864 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.392 1.292 -1.137 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.208 0.820 0.066 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.695 -1.380 1.409 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.633 -0.367 -2.292 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.288 -3.762 1.064 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.223 -2.747 -2.634 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.546 -4.449 -0.959 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.383 3.554 1.554 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.364 5.042 1.463 1.00 0.00 C ATOM 2140 C LYS A 134 -1.867 5.464 0.082 1.00 0.00 C ATOM 2141 O LYS A 134 -2.424 6.343 -0.546 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.417 5.603 2.524 1.00 0.00 C ATOM 2143 CG LYS A 134 -0.896 4.462 3.399 1.00 0.00 C ATOM 2144 CD LYS A 134 0.015 5.031 4.491 1.00 0.00 C ATOM 2145 CE LYS A 134 0.745 3.887 5.193 1.00 0.00 C ATOM 2146 NZ LYS A 134 1.861 3.412 4.329 1.00 0.00 N ATOM 0 H LYS A 134 -1.777 3.153 2.270 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.371 5.425 1.624 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -0.584 6.119 2.047 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -1.937 6.338 3.138 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.731 3.925 3.850 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -0.347 3.744 2.790 1.00 0.00 H new ATOM 0 HD2 LYS A 134 0.735 5.723 4.054 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -0.574 5.598 5.212 1.00 0.00 H new ATOM 0 HE2 LYS A 134 1.132 4.223 6.155 1.00 0.00 H new ATOM 0 HE3 LYS A 134 0.053 3.069 5.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 1.833 2.374 4.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 1.762 3.821 3.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 2.769 3.709 4.740 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.819 4.854 -0.397 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.296 5.241 -1.736 1.00 0.00 C ATOM 2162 C GLU A 135 -1.343 4.927 -2.796 1.00 0.00 C ATOM 2163 O GLU A 135 -1.646 5.745 -3.638 1.00 0.00 O ATOM 2164 CB GLU A 135 0.975 4.460 -2.043 1.00 0.00 C ATOM 2165 CG GLU A 135 2.030 4.745 -0.972 1.00 0.00 C ATOM 2166 CD GLU A 135 1.783 3.848 0.241 1.00 0.00 C ATOM 2167 OE1 GLU A 135 0.940 2.970 0.145 1.00 0.00 O ATOM 2168 OE2 GLU A 135 2.441 4.055 1.247 1.00 0.00 O ATOM 0 H GLU A 135 -0.306 4.110 0.076 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.073 6.308 -1.738 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.757 3.392 -2.077 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.356 4.739 -3.025 1.00 0.00 H new ATOM 0 HG2 GLU A 135 3.028 4.566 -1.373 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.989 5.793 -0.676 1.00 0.00 H new ATOM 2176 N MET A 136 -1.909 3.752 -2.764 1.00 0.00 N ATOM 2177 CA MET A 136 -2.941 3.412 -3.778 1.00 0.00 C ATOM 2178 C MET A 136 -4.117 4.363 -3.634 1.00 0.00 C ATOM 2179 O MET A 136 -4.620 4.900 -4.600 1.00 0.00 O ATOM 2180 CB MET A 136 -3.441 1.991 -3.558 1.00 0.00 C ATOM 2181 CG MET A 136 -2.355 0.994 -3.946 1.00 0.00 C ATOM 2182 SD MET A 136 -3.017 -0.188 -5.145 1.00 0.00 S ATOM 2183 CE MET A 136 -3.572 1.015 -6.381 1.00 0.00 C ATOM 0 H MET A 136 -1.703 3.019 -2.085 1.00 0.00 H new ATOM 0 HA MET A 136 -2.501 3.497 -4.772 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.719 1.851 -2.513 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.338 1.815 -4.152 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.500 1.519 -4.372 1.00 0.00 H new ATOM 0 HG3 MET A 136 -1.997 0.468 -3.061 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.637 0.880 -6.568 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.394 2.025 -6.011 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.019 0.865 -7.308 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.555 4.584 -2.429 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.692 5.509 -2.229 1.00 0.00 C ATOM 2195 C LYS A 137 -5.303 6.867 -2.805 1.00 0.00 C ATOM 2196 O LYS A 137 -6.050 7.481 -3.537 1.00 0.00 O ATOM 2197 CB LYS A 137 -5.974 5.648 -0.733 1.00 0.00 C ATOM 2198 CG LYS A 137 -7.293 6.391 -0.530 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.401 6.843 0.928 1.00 0.00 C ATOM 2200 CE LYS A 137 -7.509 5.620 1.842 1.00 0.00 C ATOM 2201 NZ LYS A 137 -8.528 5.875 2.901 1.00 0.00 N ATOM 0 H LYS A 137 -4.175 4.165 -1.580 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.586 5.130 -2.725 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -6.024 4.663 -0.269 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -5.161 6.189 -0.248 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.344 7.253 -1.195 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -8.131 5.743 -0.785 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -6.528 7.436 1.200 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -8.274 7.483 1.056 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -7.787 4.742 1.260 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -6.542 5.407 2.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -8.600 5.043 3.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -8.244 6.703 3.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -9.451 6.057 2.458 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.122 7.328 -2.485 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.658 8.640 -3.015 1.00 0.00 C ATOM 2217 C ALA A 138 -3.313 8.508 -4.501 1.00 0.00 C ATOM 2218 O ALA A 138 -3.707 9.328 -5.309 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.424 9.097 -2.240 1.00 0.00 C ATOM 0 H ALA A 138 -3.458 6.849 -1.877 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.453 9.376 -2.897 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -2.085 10.057 -2.629 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.675 9.201 -1.184 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.630 8.359 -2.353 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.584 7.484 -4.877 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.240 7.327 -6.319 1.00 0.00 C ATOM 2227 C ALA A 139 -3.541 7.296 -7.112 1.00 0.00 C ATOM 2228 O ALA A 139 -3.665 7.902 -8.158 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.473 6.017 -6.534 1.00 0.00 C ATOM 0 H ALA A 139 -2.219 6.762 -4.256 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.612 8.154 -6.649 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.225 5.910 -7.590 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.555 6.032 -5.946 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.092 5.177 -6.219 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.526 6.616 -6.594 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.841 6.567 -7.281 1.00 0.00 C ATOM 2237 C LEU A 140 -6.477 7.953 -7.214 1.00 0.00 C ATOM 2238 O LEU A 140 -7.080 8.420 -8.159 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.750 5.560 -6.570 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.372 4.138 -6.993 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.803 3.147 -5.907 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.083 3.794 -8.302 1.00 0.00 C ATOM 0 H LEU A 140 -4.474 6.091 -5.721 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.708 6.264 -8.319 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.653 5.667 -5.490 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.793 5.759 -6.817 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.293 4.076 -7.133 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.533 2.135 -6.210 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.301 3.392 -4.971 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.882 3.208 -5.766 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.816 2.782 -8.606 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.162 3.857 -8.158 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.779 4.498 -9.077 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.343 8.613 -6.094 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.935 9.968 -5.944 1.00 0.00 C ATOM 2256 C GLN A 141 -6.132 10.978 -6.765 1.00 0.00 C ATOM 2257 O GLN A 141 -6.685 11.746 -7.527 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.932 10.360 -4.461 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.296 11.740 -4.269 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.428 12.155 -2.802 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -5.901 13.172 -2.397 1.00 0.00 O ATOM 2262 NE2 GLN A 141 -7.115 11.407 -1.984 1.00 0.00 N ATOM 0 H GLN A 141 -5.845 8.267 -5.274 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.962 9.963 -6.309 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.953 10.368 -4.079 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.382 9.617 -3.884 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.246 11.713 -4.559 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.785 12.472 -4.912 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -7.558 10.553 -2.324 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -7.210 11.676 -1.005 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.832 10.986 -6.631 1.00 0.00 N ATOM 2272 CA GLU A 142 -4.021 11.950 -7.424 1.00 0.00 C ATOM 2273 C GLU A 142 -4.150 11.592 -8.901 1.00 0.00 C ATOM 2274 O GLU A 142 -4.213 12.453 -9.758 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.557 11.878 -6.989 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.441 12.340 -5.535 1.00 0.00 C ATOM 2277 CD GLU A 142 -0.969 12.374 -5.122 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -0.688 12.873 -4.046 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -0.146 11.906 -5.891 1.00 0.00 O ATOM 0 H GLU A 142 -4.302 10.372 -6.012 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.380 12.966 -7.259 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.185 10.858 -7.090 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.942 12.507 -7.633 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.884 13.329 -5.421 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -2.996 11.665 -4.883 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.215 10.324 -9.204 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.371 9.909 -10.623 1.00 0.00 C ATOM 2289 C GLY A 143 -5.700 10.458 -11.137 1.00 0.00 C ATOM 2290 O GLY A 143 -5.793 10.964 -12.236 1.00 0.00 O ATOM 0 H GLY A 143 -4.167 9.560 -8.530 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.545 10.290 -11.223 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.351 8.822 -10.706 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.724 10.381 -10.332 1.00 0.00 N ATOM 2295 CA HIS A 144 -8.049 10.914 -10.748 1.00 0.00 C ATOM 2296 C HIS A 144 -7.922 12.415 -11.005 1.00 0.00 C ATOM 2297 O HIS A 144 -8.512 12.953 -11.922 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.069 10.677 -9.631 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.089 9.672 -10.088 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.571 8.671 -9.255 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.731 9.504 -11.288 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.464 7.953 -9.963 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.595 8.420 -11.203 1.00 0.00 N ATOM 0 H HIS A 144 -6.698 9.969 -9.399 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.381 10.408 -11.655 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.565 10.317 -8.734 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.559 11.614 -9.367 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.299 8.509 -8.285 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.587 10.119 -12.164 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -12.006 7.104 -9.573 1.00 0.00 H new ATOM 2312 N GLN A 145 -7.153 13.091 -10.196 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.981 14.560 -10.379 1.00 0.00 C ATOM 2314 C GLN A 145 -6.468 14.850 -11.790 1.00 0.00 C ATOM 2315 O GLN A 145 -6.966 15.722 -12.475 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.964 15.071 -9.355 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.813 16.590 -9.485 1.00 0.00 C ATOM 2318 CD GLN A 145 -7.044 17.280 -8.895 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -7.267 17.235 -7.702 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -7.858 17.922 -9.688 1.00 0.00 N ATOM 0 H GLN A 145 -6.635 12.688 -9.415 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.939 15.061 -10.237 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -6.289 14.814 -8.347 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -5.001 14.586 -9.513 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.914 16.922 -8.966 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.696 16.866 -10.533 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -7.670 17.959 -10.690 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -8.682 18.386 -9.306 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.479 14.126 -12.235 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.944 14.368 -13.603 1.00 0.00 C ATOM 2331 C PHE A 146 -6.052 14.117 -14.623 1.00 0.00 C ATOM 2332 O PHE A 146 -6.273 14.907 -15.517 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.781 13.411 -13.877 1.00 0.00 C ATOM 2334 CG PHE A 146 -3.078 13.810 -15.155 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.701 13.613 -16.393 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.796 14.378 -15.105 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.046 13.977 -17.572 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.146 14.740 -16.291 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.776 14.537 -17.524 1.00 0.00 C ATOM 0 H PHE A 146 -5.020 13.380 -11.713 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.592 15.397 -13.681 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -3.079 13.430 -13.044 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.151 12.389 -13.959 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.689 13.179 -16.437 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.311 14.536 -14.153 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.529 13.822 -18.525 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.159 15.176 -16.254 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.274 14.816 -18.439 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.750 13.020 -14.493 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.840 12.714 -15.462 1.00 0.00 C ATOM 2351 C LEU A 147 -8.802 13.899 -15.526 1.00 0.00 C ATOM 2352 O LEU A 147 -9.256 14.285 -16.585 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.590 11.456 -15.009 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.585 10.322 -14.781 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.327 9.022 -14.472 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.731 10.129 -16.034 1.00 0.00 C ATOM 0 H LEU A 147 -6.612 12.325 -13.759 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.416 12.538 -16.451 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.142 11.658 -14.091 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.321 11.163 -15.763 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.944 10.582 -13.938 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.606 8.221 -14.311 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.931 9.152 -13.574 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.974 8.765 -15.310 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.018 9.322 -15.867 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.374 9.877 -16.877 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.191 11.051 -16.252 1.00 0.00 H new ATOM 2368 N CYS A 148 -9.105 14.497 -14.408 1.00 0.00 N ATOM 2369 CA CYS A 148 -10.020 15.668 -14.425 1.00 0.00 C ATOM 2370 C CYS A 148 -9.404 16.753 -15.307 1.00 0.00 C ATOM 2371 O CYS A 148 -10.094 17.562 -15.896 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.200 16.203 -13.003 1.00 0.00 C ATOM 2373 SG CYS A 148 -9.797 17.967 -12.975 1.00 0.00 S ATOM 0 H CYS A 148 -8.759 14.226 -13.487 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.993 15.374 -14.818 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -11.226 16.047 -12.670 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -9.555 15.659 -12.313 1.00 0.00 H new ATOM 0 HG CYS A 148 -9.950 18.428 -11.769 1.00 0.00 H new ATOM 2379 N SER A 149 -8.101 16.767 -15.399 1.00 0.00 N ATOM 2380 CA SER A 149 -7.410 17.786 -16.236 1.00 0.00 C ATOM 2381 C SER A 149 -7.361 17.325 -17.695 1.00 0.00 C ATOM 2382 O SER A 149 -6.920 18.050 -18.564 1.00 0.00 O ATOM 2383 CB SER A 149 -5.979 17.960 -15.731 1.00 0.00 C ATOM 2384 OG SER A 149 -6.002 18.451 -14.398 1.00 0.00 O ATOM 0 H SER A 149 -7.482 16.109 -14.925 1.00 0.00 H new ATOM 0 HA SER A 149 -7.955 18.728 -16.171 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.450 17.008 -15.770 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.437 18.652 -16.375 1.00 0.00 H new ATOM 0 HG SER A 149 -5.084 18.561 -14.074 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.792 16.128 -17.976 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.749 15.636 -19.376 1.00 0.00 C ATOM 2392 C ILE A 150 -9.112 15.830 -20.022 1.00 0.00 C ATOM 2393 O ILE A 150 -9.810 16.788 -19.760 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.393 14.149 -19.375 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.154 13.927 -18.512 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.098 13.694 -20.801 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.693 12.474 -18.648 1.00 0.00 C ATOM 0 H ILE A 150 -8.172 15.470 -17.295 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.999 16.192 -19.938 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.229 13.576 -18.974 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.357 14.603 -18.820 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.378 14.153 -17.469 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.844 12.634 -20.800 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.978 13.856 -21.424 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.261 14.267 -21.200 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.808 12.314 -18.032 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.490 11.807 -18.319 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.452 12.265 -19.690 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.492 14.917 -20.861 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.811 15.028 -21.534 1.00 0.00 C ATOM 2411 C GLU A 151 -11.871 14.380 -20.646 1.00 0.00 C ATOM 2412 O GLU A 151 -12.959 14.062 -21.078 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.756 14.332 -22.899 1.00 0.00 C ATOM 2414 CG GLU A 151 -10.681 12.817 -22.705 1.00 0.00 C ATOM 2415 CD GLU A 151 -10.458 12.144 -24.060 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -10.345 10.929 -24.085 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -10.403 12.854 -25.052 1.00 0.00 O ATOM 0 H GLU A 151 -8.945 14.094 -21.112 1.00 0.00 H new ATOM 0 HA GLU A 151 -11.064 16.076 -21.693 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -11.638 14.590 -23.485 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -9.888 14.679 -23.460 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.868 12.566 -22.023 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -11.602 12.451 -22.251 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.547 14.190 -19.398 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.515 13.573 -18.446 1.00 0.00 C ATOM 2427 C ALA A 152 -13.665 14.551 -18.185 1.00 0.00 C ATOM 2428 O ALA A 152 -14.817 14.169 -18.126 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.798 13.253 -17.132 1.00 0.00 C ATOM 0 H ALA A 152 -10.645 14.438 -18.992 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.915 12.653 -18.872 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.503 12.802 -16.434 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.981 12.557 -17.323 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.399 14.172 -16.702 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.359 15.813 -18.037 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.432 16.821 -17.791 1.00 0.00 C ATOM 2437 C LEU A 153 -14.601 17.691 -19.040 1.00 0.00 C ATOM 2438 O LEU A 153 -13.914 17.493 -20.041 1.00 0.00 O ATOM 2439 CB LEU A 153 -14.051 17.710 -16.602 1.00 0.00 C ATOM 2440 CG LEU A 153 -13.900 16.857 -15.338 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -13.614 17.766 -14.141 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -15.195 16.083 -15.082 1.00 0.00 C ATOM 0 H LEU A 153 -12.412 16.190 -18.076 1.00 0.00 H new ATOM 0 HA LEU A 153 -15.366 16.306 -17.568 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -13.118 18.232 -16.812 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -14.815 18.472 -16.447 1.00 0.00 H new ATOM 0 HG LEU A 153 -13.076 16.156 -15.474 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -13.506 17.160 -13.241 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -12.692 18.321 -14.317 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -14.439 18.466 -14.010 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -15.085 15.477 -14.183 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -16.018 16.785 -14.948 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -15.406 15.435 -15.933 1.00 0.00 H new