USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=20 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 128 CYS SG : rot -81:sc= 0.312 USER MOD Set 1.2: A 129 GLN : amide:sc= -5.91! C(o=-5.6!,f=-8.6!) USER MOD Set 2.1: A 19 CYS SG : rot 35:sc= -0.996 USER MOD Set 2.2: A 106 TYR OH : rot 166:sc= 0.233 USER MOD Set 3.1: A 86 ASN : amide:sc= -13.4! C(o=-13!,f=-5.8!) USER MOD Set 3.2: A 95 THR OG1 : rot -56:sc= 0.0545 USER MOD Single : A 11 CYS SG : rot -115:sc= -9.02! USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 37 SER OG : rot -13:sc= 0.375! USER MOD Single : A 42 HIS : no HE2:sc= -4.92! K(o=-4.9!,f=-2.7) USER MOD Single : A 44 THR OG1 : rot 180:sc= -1.61! USER MOD Single : A 47 LYS NZ :NH3+ -169:sc= -1.21 (180deg=-1.46!) USER MOD Single : A 49 HIS : no HD1:sc= -9.21! C(o=-9.2!,f=-3.4!) USER MOD Single : A 59 THR OG1 : rot -60:sc= -3.95! USER MOD Single : A 64 THR OG1 : rot 32:sc= -3.38! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 74 GLN : amide:sc= -9.78! C(o=-9.8!,f=-5.5!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 178:sc= -2.17 USER MOD Single : A 104 LYS NZ :NH3+ -158:sc= 0.587 (180deg=0.0773) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= -2.74! C(o=-2.7!,f=-2!) USER MOD Single : A 116 HIS : no HD1:sc= -4.24 K(o=-4.2,f=-5.5!) USER MOD Single : A 117 GLN : amide:sc= -1.29 K(o=-1.3,f=-2.6) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl 151:sc= -2.72 (180deg=-5.58!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN : amide:sc= -1.37! K(o=-1.4!,f=-0.0019) USER MOD Single : A 144 HIS : no HE2:sc= -12.8! C(o=-13!,f=-19!) USER MOD Single : A 145 GLN : amide:sc= -0.101 K(o=-0.1,f=-2.4!) USER MOD Single : A 148 CYS SG : rot 71:sc= 1.16 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 105 N ARG A 9 12.323 -3.735 -7.609 1.00 0.00 N ATOM 106 CA ARG A 9 11.282 -2.710 -7.865 1.00 0.00 C ATOM 107 C ARG A 9 10.237 -3.308 -8.811 1.00 0.00 C ATOM 108 O ARG A 9 10.567 -3.890 -9.826 1.00 0.00 O ATOM 109 CB ARG A 9 11.922 -1.470 -8.493 1.00 0.00 C ATOM 110 CG ARG A 9 12.205 -1.719 -9.976 1.00 0.00 C ATOM 111 CD ARG A 9 12.969 -0.526 -10.549 1.00 0.00 C ATOM 112 NE ARG A 9 14.428 -0.735 -10.361 1.00 0.00 N ATOM 113 CZ ARG A 9 15.218 0.289 -10.177 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.730 1.500 -10.154 1.00 0.00 N ATOM 115 NH2 ARG A 9 16.497 0.101 -10.013 1.00 0.00 N ATOM 0 HA ARG A 9 10.804 -2.414 -6.931 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.259 -0.612 -8.380 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.849 -1.227 -7.974 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.787 -2.632 -10.099 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.270 -1.862 -10.518 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.741 -0.410 -11.609 1.00 0.00 H new ATOM 0 HD3 ARG A 9 12.656 0.392 -10.053 1.00 0.00 H new ATOM 0 HE ARG A 9 14.813 -1.679 -10.376 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.729 1.649 -10.280 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.350 2.297 -10.010 1.00 0.00 H new ATOM 0 HH21 ARG A 9 16.880 -0.844 -10.028 1.00 0.00 H new ATOM 0 HH22 ARG A 9 17.116 0.899 -9.869 1.00 0.00 H new ATOM 129 N ALA A 10 8.985 -3.170 -8.489 1.00 0.00 N ATOM 130 CA ALA A 10 7.922 -3.729 -9.368 1.00 0.00 C ATOM 131 C ALA A 10 7.132 -2.564 -9.956 1.00 0.00 C ATOM 132 O ALA A 10 7.262 -1.441 -9.517 1.00 0.00 O ATOM 133 CB ALA A 10 6.998 -4.625 -8.539 1.00 0.00 C ATOM 0 H ALA A 10 8.649 -2.693 -7.652 1.00 0.00 H new ATOM 0 HA ALA A 10 8.359 -4.324 -10.170 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.218 -5.036 -9.180 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.576 -5.440 -8.103 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.541 -4.038 -7.742 1.00 0.00 H new ATOM 139 N CYS A 11 6.333 -2.800 -10.960 1.00 0.00 N ATOM 140 CA CYS A 11 5.570 -1.671 -11.560 1.00 0.00 C ATOM 141 C CYS A 11 4.169 -2.125 -11.988 1.00 0.00 C ATOM 142 O CYS A 11 3.939 -3.278 -12.292 1.00 0.00 O ATOM 143 CB CYS A 11 6.337 -1.138 -12.769 1.00 0.00 C ATOM 144 SG CYS A 11 8.047 -1.740 -12.720 1.00 0.00 S ATOM 0 H CYS A 11 6.177 -3.714 -11.386 1.00 0.00 H new ATOM 0 HA CYS A 11 5.457 -0.883 -10.815 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.853 -1.462 -13.691 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.325 -0.048 -12.768 1.00 0.00 H new ATOM 0 HG CYS A 11 8.857 -0.735 -12.566 1.00 0.00 H new ATOM 150 N GLY A 12 3.232 -1.210 -12.011 1.00 0.00 N ATOM 151 CA GLY A 12 1.837 -1.564 -12.414 1.00 0.00 C ATOM 152 C GLY A 12 1.130 -0.330 -12.985 1.00 0.00 C ATOM 153 O GLY A 12 1.682 0.750 -13.023 1.00 0.00 O ATOM 0 H GLY A 12 3.374 -0.230 -11.767 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.855 -2.360 -13.158 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.286 -1.944 -11.554 1.00 0.00 H new ATOM 157 N LEU A 13 -0.090 -0.486 -13.430 1.00 0.00 N ATOM 158 CA LEU A 13 -0.838 0.677 -13.999 1.00 0.00 C ATOM 159 C LEU A 13 -2.130 0.915 -13.217 1.00 0.00 C ATOM 160 O LEU A 13 -2.898 -0.002 -13.001 1.00 0.00 O ATOM 161 CB LEU A 13 -1.281 0.363 -15.433 1.00 0.00 C ATOM 162 CG LEU A 13 -0.114 -0.088 -16.307 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.644 -0.340 -17.721 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.939 1.010 -16.361 1.00 0.00 C ATOM 0 H LEU A 13 -0.602 -1.368 -13.424 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.176 1.541 -13.954 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -2.042 -0.417 -15.415 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.742 1.248 -15.872 1.00 0.00 H new ATOM 0 HG LEU A 13 0.332 -0.994 -15.896 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.174 -0.664 -18.364 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.410 -1.115 -17.690 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.075 0.579 -18.117 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.771 0.686 -16.986 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.500 1.915 -16.782 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.301 1.217 -15.354 1.00 0.00 H new ATOM 176 N ILE A 14 -2.446 2.137 -12.877 1.00 0.00 N ATOM 177 CA ILE A 14 -3.764 2.354 -12.225 1.00 0.00 C ATOM 178 C ILE A 14 -4.754 2.262 -13.375 1.00 0.00 C ATOM 179 O ILE A 14 -4.956 3.206 -14.111 1.00 0.00 O ATOM 180 CB ILE A 14 -3.850 3.738 -11.539 1.00 0.00 C ATOM 181 CG1 ILE A 14 -4.009 3.559 -10.026 1.00 0.00 C ATOM 182 CG2 ILE A 14 -5.068 4.526 -12.047 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.639 3.418 -9.381 1.00 0.00 C ATOM 0 H ILE A 14 -1.869 2.966 -13.017 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.953 1.629 -11.433 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.934 4.281 -11.772 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -4.535 4.414 -9.602 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.613 2.677 -9.816 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.107 5.495 -11.550 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -4.983 4.673 -13.124 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.979 3.969 -11.828 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.755 3.291 -8.305 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.129 2.549 -9.796 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.050 4.313 -9.579 1.00 0.00 H new ATOM 195 N ILE A 15 -5.330 1.123 -13.591 1.00 0.00 N ATOM 196 CA ILE A 15 -6.242 1.014 -14.750 1.00 0.00 C ATOM 197 C ILE A 15 -7.573 1.665 -14.435 1.00 0.00 C ATOM 198 O ILE A 15 -8.141 1.488 -13.376 1.00 0.00 O ATOM 199 CB ILE A 15 -6.472 -0.439 -15.129 1.00 0.00 C ATOM 200 CG1 ILE A 15 -5.142 -1.081 -15.532 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.452 -0.467 -16.300 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.411 -2.434 -16.179 1.00 0.00 C ATOM 0 H ILE A 15 -5.214 0.279 -13.030 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.774 1.527 -15.590 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.880 -0.998 -14.287 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.608 -0.433 -16.227 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.504 -1.204 -14.657 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.637 -1.500 -16.595 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.391 -0.002 -16.000 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.029 0.081 -17.142 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.466 -2.894 -16.467 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.928 -3.080 -15.469 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -6.032 -2.297 -17.064 1.00 0.00 H new ATOM 214 N PHE A 16 -8.079 2.414 -15.360 1.00 0.00 N ATOM 215 CA PHE A 16 -9.377 3.079 -15.141 1.00 0.00 C ATOM 216 C PHE A 16 -10.065 3.284 -16.487 1.00 0.00 C ATOM 217 O PHE A 16 -9.423 3.439 -17.504 1.00 0.00 O ATOM 218 CB PHE A 16 -9.145 4.441 -14.501 1.00 0.00 C ATOM 219 CG PHE A 16 -8.602 5.377 -15.546 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.477 6.007 -16.436 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.227 5.616 -15.626 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.978 6.877 -17.407 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.725 6.487 -16.598 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.602 7.119 -17.488 1.00 0.00 C ATOM 0 H PHE A 16 -7.645 2.595 -16.265 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.997 2.463 -14.490 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.077 4.830 -14.092 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.445 4.354 -13.670 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.539 5.821 -16.372 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.553 5.128 -14.938 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.653 7.363 -18.095 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.663 6.672 -16.662 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.216 7.794 -18.238 1.00 0.00 H new ATOM 234 N ARG A 17 -11.362 3.302 -16.495 1.00 0.00 N ATOM 235 CA ARG A 17 -12.103 3.513 -17.769 1.00 0.00 C ATOM 236 C ARG A 17 -13.054 4.693 -17.592 1.00 0.00 C ATOM 237 O ARG A 17 -13.834 4.738 -16.663 1.00 0.00 O ATOM 238 CB ARG A 17 -12.898 2.247 -18.105 1.00 0.00 C ATOM 239 CG ARG A 17 -13.932 2.540 -19.200 1.00 0.00 C ATOM 240 CD ARG A 17 -13.231 3.000 -20.477 1.00 0.00 C ATOM 241 NE ARG A 17 -14.236 3.121 -21.567 1.00 0.00 N ATOM 242 CZ ARG A 17 -13.998 3.886 -22.594 1.00 0.00 C ATOM 243 NH1 ARG A 17 -12.873 4.539 -22.675 1.00 0.00 N ATOM 244 NH2 ARG A 17 -14.885 3.991 -23.546 1.00 0.00 N ATOM 0 H ARG A 17 -11.949 3.179 -15.670 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.407 3.723 -18.581 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.220 1.461 -18.437 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.400 1.877 -17.211 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.522 1.646 -19.402 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.625 3.309 -18.860 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -12.739 3.958 -20.311 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -12.455 2.287 -20.758 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.113 2.604 -21.510 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -12.178 4.451 -21.934 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.688 5.138 -23.480 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -15.762 3.475 -23.485 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.701 4.590 -24.351 1.00 0.00 H new ATOM 258 N ARG A 18 -12.999 5.651 -18.474 1.00 0.00 N ATOM 259 CA ARG A 18 -13.906 6.820 -18.343 1.00 0.00 C ATOM 260 C ARG A 18 -15.093 6.649 -19.289 1.00 0.00 C ATOM 261 O ARG A 18 -14.930 6.351 -20.454 1.00 0.00 O ATOM 262 CB ARG A 18 -13.136 8.100 -18.667 1.00 0.00 C ATOM 263 CG ARG A 18 -12.673 8.083 -20.120 1.00 0.00 C ATOM 264 CD ARG A 18 -11.542 9.100 -20.290 1.00 0.00 C ATOM 265 NE ARG A 18 -11.324 9.368 -21.737 1.00 0.00 N ATOM 266 CZ ARG A 18 -12.229 10.017 -22.419 1.00 0.00 C ATOM 267 NH1 ARG A 18 -13.317 10.432 -21.829 1.00 0.00 N ATOM 268 NH2 ARG A 18 -12.046 10.250 -23.686 1.00 0.00 N ATOM 0 H ARG A 18 -12.368 5.674 -19.275 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.281 6.888 -17.322 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.770 8.969 -18.490 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.275 8.193 -18.005 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.328 7.086 -20.394 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.503 8.327 -20.783 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.791 10.026 -19.772 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -10.626 8.719 -19.839 1.00 0.00 H new ATOM 0 HE ARG A 18 -10.471 9.046 -22.195 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -13.460 10.249 -20.836 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -14.024 10.939 -22.361 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -11.196 9.926 -24.147 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -12.753 10.757 -24.219 1.00 0.00 H new ATOM 282 N CYS A 19 -16.290 6.818 -18.794 1.00 0.00 N ATOM 283 CA CYS A 19 -17.482 6.647 -19.668 1.00 0.00 C ATOM 284 C CYS A 19 -17.860 7.985 -20.291 1.00 0.00 C ATOM 285 O CYS A 19 -17.233 9.000 -20.056 1.00 0.00 O ATOM 286 CB CYS A 19 -18.664 6.128 -18.843 1.00 0.00 C ATOM 287 SG CYS A 19 -18.042 5.171 -17.439 1.00 0.00 S ATOM 0 H CYS A 19 -16.492 7.066 -17.825 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.243 5.930 -20.453 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.269 6.963 -18.489 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.310 5.507 -19.463 1.00 0.00 H new ATOM 0 HG CYS A 19 -16.932 5.696 -17.014 1.00 0.00 H new ATOM 424 N ALA A 28 -18.340 8.399 -14.505 1.00 0.00 N ATOM 425 CA ALA A 28 -17.717 8.188 -15.838 1.00 0.00 C ATOM 426 C ALA A 28 -16.372 7.480 -15.673 1.00 0.00 C ATOM 427 O ALA A 28 -15.998 6.665 -16.485 1.00 0.00 O ATOM 428 CB ALA A 28 -17.497 9.538 -16.526 1.00 0.00 C ATOM 0 HA ALA A 28 -18.380 7.573 -16.447 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.040 9.378 -17.503 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.455 10.043 -16.652 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.839 10.155 -15.914 1.00 0.00 H new ATOM 434 N ILE A 29 -15.643 7.787 -14.635 1.00 0.00 N ATOM 435 CA ILE A 29 -14.316 7.131 -14.444 1.00 0.00 C ATOM 436 C ILE A 29 -14.368 6.124 -13.300 1.00 0.00 C ATOM 437 O ILE A 29 -14.824 6.411 -12.210 1.00 0.00 O ATOM 438 CB ILE A 29 -13.255 8.197 -14.152 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.202 9.187 -15.328 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.892 7.524 -13.959 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.752 9.406 -15.777 1.00 0.00 C ATOM 0 H ILE A 29 -15.906 8.459 -13.914 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.057 6.597 -15.358 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.510 8.737 -13.240 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.793 8.805 -16.160 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.645 10.138 -15.032 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -11.138 8.283 -13.751 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.945 6.827 -13.123 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.622 6.983 -14.866 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.731 10.109 -16.610 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.171 9.809 -14.947 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.322 8.456 -16.093 1.00 0.00 H new ATOM 453 N GLU A 30 -13.885 4.941 -13.552 1.00 0.00 N ATOM 454 CA GLU A 30 -13.872 3.883 -12.508 1.00 0.00 C ATOM 455 C GLU A 30 -12.487 3.239 -12.486 1.00 0.00 C ATOM 456 O GLU A 30 -11.730 3.373 -13.423 1.00 0.00 O ATOM 457 CB GLU A 30 -14.925 2.823 -12.847 1.00 0.00 C ATOM 458 CG GLU A 30 -16.315 3.460 -12.842 1.00 0.00 C ATOM 459 CD GLU A 30 -17.366 2.382 -13.102 1.00 0.00 C ATOM 460 OE1 GLU A 30 -18.538 2.679 -12.952 1.00 0.00 O ATOM 461 OE2 GLU A 30 -16.981 1.277 -13.447 1.00 0.00 O ATOM 0 H GLU A 30 -13.493 4.659 -14.451 1.00 0.00 H new ATOM 0 HA GLU A 30 -14.098 4.314 -11.533 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.717 2.389 -13.825 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.884 2.010 -12.122 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.503 3.943 -11.883 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.375 4.235 -13.606 1.00 0.00 H new ATOM 469 N PHE A 31 -12.145 2.541 -11.437 1.00 0.00 N ATOM 470 CA PHE A 31 -10.800 1.896 -11.388 1.00 0.00 C ATOM 471 C PHE A 31 -10.938 0.379 -11.463 1.00 0.00 C ATOM 472 O PHE A 31 -11.867 -0.204 -10.938 1.00 0.00 O ATOM 473 CB PHE A 31 -10.088 2.250 -10.086 1.00 0.00 C ATOM 474 CG PHE A 31 -9.718 3.710 -10.082 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.865 4.217 -11.065 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.221 4.553 -9.090 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.517 5.573 -11.059 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.872 5.906 -9.082 1.00 0.00 C ATOM 479 CZ PHE A 31 -9.021 6.418 -10.066 1.00 0.00 C ATOM 0 H PHE A 31 -12.733 2.390 -10.617 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.222 2.260 -12.237 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.734 2.028 -9.237 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.192 1.639 -9.974 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.474 3.563 -11.830 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.879 4.160 -8.329 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.860 5.966 -11.821 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.261 6.558 -8.314 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.754 7.464 -10.059 1.00 0.00 H new ATOM 489 N LEU A 32 -10.003 -0.262 -12.099 1.00 0.00 N ATOM 490 CA LEU A 32 -10.039 -1.740 -12.203 1.00 0.00 C ATOM 491 C LEU A 32 -8.980 -2.321 -11.249 1.00 0.00 C ATOM 492 O LEU A 32 -7.792 -2.229 -11.492 1.00 0.00 O ATOM 493 CB LEU A 32 -9.766 -2.114 -13.669 1.00 0.00 C ATOM 494 CG LEU A 32 -9.233 -3.542 -13.799 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.330 -4.543 -13.451 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.802 -3.779 -15.245 1.00 0.00 C ATOM 0 H LEU A 32 -9.206 0.182 -12.556 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.007 -2.150 -11.916 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.685 -2.015 -14.247 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.045 -1.416 -14.094 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.391 -3.673 -13.120 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.941 -5.557 -13.546 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.662 -4.377 -12.426 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.172 -4.412 -14.131 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.420 -4.795 -15.349 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.658 -3.643 -15.907 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -8.020 -3.068 -15.513 1.00 0.00 H new ATOM 508 N LEU A 33 -9.413 -2.907 -10.154 1.00 0.00 N ATOM 509 CA LEU A 33 -8.456 -3.489 -9.153 1.00 0.00 C ATOM 510 C LEU A 33 -8.539 -5.017 -9.201 1.00 0.00 C ATOM 511 O LEU A 33 -9.451 -5.573 -9.776 1.00 0.00 O ATOM 512 CB LEU A 33 -8.845 -3.041 -7.735 1.00 0.00 C ATOM 513 CG LEU A 33 -8.231 -1.683 -7.391 1.00 0.00 C ATOM 514 CD1 LEU A 33 -8.977 -1.099 -6.189 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.758 -1.866 -7.017 1.00 0.00 C ATOM 0 H LEU A 33 -10.398 -3.008 -9.909 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.449 -3.149 -9.393 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.930 -2.982 -7.655 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.512 -3.786 -7.012 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.309 -1.016 -8.249 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.550 -0.130 -5.932 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.031 -0.976 -6.439 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.882 -1.774 -5.339 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.322 -0.898 -6.772 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.681 -2.527 -6.154 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.221 -2.304 -7.858 1.00 0.00 H new ATOM 527 N LEU A 34 -7.598 -5.703 -8.600 1.00 0.00 N ATOM 528 CA LEU A 34 -7.647 -7.196 -8.622 1.00 0.00 C ATOM 529 C LEU A 34 -7.505 -7.768 -7.209 1.00 0.00 C ATOM 530 O LEU A 34 -6.656 -7.352 -6.447 1.00 0.00 O ATOM 531 CB LEU A 34 -6.506 -7.742 -9.484 1.00 0.00 C ATOM 532 CG LEU A 34 -6.511 -7.082 -10.862 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.534 -7.823 -11.772 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.911 -7.152 -11.475 1.00 0.00 C ATOM 0 H LEU A 34 -6.806 -5.298 -8.100 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.610 -7.494 -9.036 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.551 -7.560 -8.991 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.609 -8.822 -9.591 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.216 -6.038 -10.759 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.531 -7.358 -12.758 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.532 -7.775 -11.346 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.840 -8.865 -11.863 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.902 -6.679 -12.457 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.212 -8.195 -11.578 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.618 -6.633 -10.828 1.00 0.00 H new ATOM 546 N GLN A 35 -8.300 -8.752 -6.869 1.00 0.00 N ATOM 547 CA GLN A 35 -8.163 -9.372 -5.520 1.00 0.00 C ATOM 548 C GLN A 35 -7.454 -10.712 -5.690 1.00 0.00 C ATOM 549 O GLN A 35 -7.981 -11.631 -6.286 1.00 0.00 O ATOM 550 CB GLN A 35 -9.532 -9.613 -4.880 1.00 0.00 C ATOM 551 CG GLN A 35 -9.364 -9.780 -3.368 1.00 0.00 C ATOM 552 CD GLN A 35 -10.731 -9.999 -2.718 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.747 -9.963 -3.380 1.00 0.00 O ATOM 554 NE2 GLN A 35 -10.793 -10.223 -1.434 1.00 0.00 N ATOM 0 H GLN A 35 -9.030 -9.148 -7.462 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.598 -8.701 -4.873 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.198 -8.776 -5.093 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -9.993 -10.504 -5.306 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.710 -10.626 -3.156 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -8.887 -8.895 -2.946 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -9.937 -10.253 -0.880 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -11.697 -10.368 -0.985 1.00 0.00 H new ATOM 563 N ALA A 36 -6.259 -10.830 -5.187 1.00 0.00 N ATOM 564 CA ALA A 36 -5.513 -12.109 -5.340 1.00 0.00 C ATOM 565 C ALA A 36 -6.128 -13.191 -4.450 1.00 0.00 C ATOM 566 O ALA A 36 -6.369 -12.986 -3.278 1.00 0.00 O ATOM 567 CB ALA A 36 -4.051 -11.892 -4.951 1.00 0.00 C ATOM 0 H ALA A 36 -5.766 -10.097 -4.677 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.572 -12.434 -6.379 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.502 -12.827 -5.062 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.611 -11.134 -5.599 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.996 -11.560 -3.914 1.00 0.00 H new ATOM 573 N SER A 37 -6.375 -14.347 -5.002 1.00 0.00 N ATOM 574 CA SER A 37 -6.965 -15.452 -4.198 1.00 0.00 C ATOM 575 C SER A 37 -5.853 -16.392 -3.726 1.00 0.00 C ATOM 576 O SER A 37 -6.065 -17.251 -2.894 1.00 0.00 O ATOM 577 CB SER A 37 -7.956 -16.230 -5.059 1.00 0.00 C ATOM 578 OG SER A 37 -8.352 -17.406 -4.368 1.00 0.00 O ATOM 0 H SER A 37 -6.192 -14.574 -5.980 1.00 0.00 H new ATOM 0 HA SER A 37 -7.480 -15.037 -3.332 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.827 -15.613 -5.280 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.500 -16.491 -6.014 1.00 0.00 H new ATOM 0 HG SER A 37 -7.750 -17.559 -3.610 1.00 0.00 H new ATOM 641 N HIS A 42 -6.211 -9.603 -1.075 1.00 0.00 N ATOM 642 CA HIS A 42 -6.030 -8.129 -1.006 1.00 0.00 C ATOM 643 C HIS A 42 -6.313 -7.537 -2.385 1.00 0.00 C ATOM 644 O HIS A 42 -6.070 -8.164 -3.395 1.00 0.00 O ATOM 645 CB HIS A 42 -4.583 -7.813 -0.615 1.00 0.00 C ATOM 646 CG HIS A 42 -3.652 -8.336 -1.680 1.00 0.00 C ATOM 647 ND1 HIS A 42 -2.735 -9.355 -1.443 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.491 -7.994 -3.001 1.00 0.00 C ATOM 649 CE1 HIS A 42 -2.075 -9.585 -2.593 1.00 0.00 C ATOM 650 NE2 HIS A 42 -2.499 -8.783 -3.569 1.00 0.00 N ATOM 0 HA HIS A 42 -6.709 -7.705 -0.266 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.453 -6.737 -0.499 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.346 -8.269 0.346 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -2.589 -9.840 -0.558 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.050 -7.229 -3.519 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -1.299 -10.327 -2.710 1.00 0.00 H new ATOM 659 N TRP A 43 -6.816 -6.335 -2.444 1.00 0.00 N ATOM 660 CA TRP A 43 -7.094 -5.723 -3.770 1.00 0.00 C ATOM 661 C TRP A 43 -5.857 -4.972 -4.244 1.00 0.00 C ATOM 662 O TRP A 43 -5.203 -4.290 -3.482 1.00 0.00 O ATOM 663 CB TRP A 43 -8.271 -4.758 -3.654 1.00 0.00 C ATOM 664 CG TRP A 43 -9.545 -5.537 -3.692 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.302 -5.846 -2.619 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.221 -6.104 -4.846 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.405 -6.568 -3.043 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.395 -6.754 -4.409 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.924 -6.115 -6.215 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.249 -7.396 -5.305 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.777 -6.760 -7.119 1.00 0.00 C ATOM 672 CH2 TRP A 43 -11.937 -7.399 -6.664 1.00 0.00 C ATOM 0 H TRP A 43 -7.045 -5.755 -1.637 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.344 -6.504 -4.488 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.203 -4.192 -2.725 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.247 -4.035 -4.470 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.084 -5.575 -1.597 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.134 -6.919 -2.422 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.032 -5.623 -6.575 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.143 -7.886 -4.950 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.539 -6.765 -8.172 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.591 -7.895 -7.366 1.00 0.00 H new ATOM 683 N THR A 44 -5.522 -5.098 -5.495 1.00 0.00 N ATOM 684 CA THR A 44 -4.317 -4.399 -6.009 1.00 0.00 C ATOM 685 C THR A 44 -4.402 -4.285 -7.533 1.00 0.00 C ATOM 686 O THR A 44 -4.999 -5.112 -8.189 1.00 0.00 O ATOM 687 CB THR A 44 -3.068 -5.197 -5.622 1.00 0.00 C ATOM 688 OG1 THR A 44 -1.948 -4.713 -6.346 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.271 -6.678 -5.945 1.00 0.00 C ATOM 0 H THR A 44 -6.030 -5.654 -6.183 1.00 0.00 H new ATOM 0 HA THR A 44 -4.261 -3.400 -5.577 1.00 0.00 H new ATOM 0 HB THR A 44 -2.894 -5.080 -4.552 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.150 -5.224 -6.095 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.378 -7.237 -5.666 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.126 -7.058 -5.386 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.454 -6.796 -7.013 1.00 0.00 H new ATOM 697 N PRO A 45 -3.804 -3.265 -8.088 1.00 0.00 N ATOM 698 CA PRO A 45 -3.804 -3.033 -9.553 1.00 0.00 C ATOM 699 C PRO A 45 -2.790 -3.932 -10.254 1.00 0.00 C ATOM 700 O PRO A 45 -1.831 -4.381 -9.660 1.00 0.00 O ATOM 701 CB PRO A 45 -3.394 -1.569 -9.677 1.00 0.00 C ATOM 702 CG PRO A 45 -2.491 -1.353 -8.515 1.00 0.00 C ATOM 703 CD PRO A 45 -3.055 -2.214 -7.382 1.00 0.00 C ATOM 0 HA PRO A 45 -4.767 -3.254 -10.014 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.885 -1.375 -10.621 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.259 -0.907 -9.640 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.468 -1.644 -8.755 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.465 -0.301 -8.231 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.261 -2.633 -6.764 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -3.701 -1.635 -6.722 1.00 0.00 H new ATOM 711 N PRO A 46 -2.996 -4.192 -11.504 1.00 0.00 N ATOM 712 CA PRO A 46 -2.080 -5.055 -12.294 1.00 0.00 C ATOM 713 C PRO A 46 -0.612 -4.611 -12.173 1.00 0.00 C ATOM 714 O PRO A 46 -0.146 -3.777 -12.922 1.00 0.00 O ATOM 715 CB PRO A 46 -2.573 -4.867 -13.727 1.00 0.00 C ATOM 716 CG PRO A 46 -4.005 -4.477 -13.609 1.00 0.00 C ATOM 717 CD PRO A 46 -4.125 -3.697 -12.309 1.00 0.00 C ATOM 0 HA PRO A 46 -2.096 -6.090 -11.952 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.998 -4.097 -14.242 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.463 -5.786 -14.303 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -4.314 -3.868 -14.459 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.649 -5.357 -13.596 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.056 -2.622 -12.478 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.080 -3.882 -11.817 1.00 0.00 H new ATOM 725 N LYS A 47 0.122 -5.168 -11.241 1.00 0.00 N ATOM 726 CA LYS A 47 1.558 -4.780 -11.090 1.00 0.00 C ATOM 727 C LYS A 47 2.401 -6.031 -10.810 1.00 0.00 C ATOM 728 O LYS A 47 2.020 -6.892 -10.042 1.00 0.00 O ATOM 729 CB LYS A 47 1.705 -3.759 -9.946 1.00 0.00 C ATOM 730 CG LYS A 47 1.975 -4.462 -8.613 1.00 0.00 C ATOM 731 CD LYS A 47 3.474 -4.726 -8.448 1.00 0.00 C ATOM 732 CE LYS A 47 3.695 -5.642 -7.241 1.00 0.00 C ATOM 733 NZ LYS A 47 2.421 -5.773 -6.471 1.00 0.00 N ATOM 0 H LYS A 47 -0.210 -5.872 -10.581 1.00 0.00 H new ATOM 0 HA LYS A 47 1.911 -4.319 -12.012 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.521 -3.072 -10.170 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.797 -3.161 -9.868 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.614 -3.846 -7.789 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.426 -5.403 -8.572 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.875 -5.189 -9.349 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.008 -3.786 -8.309 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.033 -6.623 -7.574 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.478 -5.235 -6.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.612 -6.236 -5.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 2.019 -4.829 -6.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.744 -6.345 -7.015 1.00 0.00 H new ATOM 747 N GLY A 48 3.551 -6.139 -11.433 1.00 0.00 N ATOM 748 CA GLY A 48 4.422 -7.331 -11.203 1.00 0.00 C ATOM 749 C GLY A 48 5.881 -6.893 -11.019 1.00 0.00 C ATOM 750 O GLY A 48 6.243 -5.767 -11.298 1.00 0.00 O ATOM 0 H GLY A 48 3.922 -5.453 -12.090 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.083 -7.873 -10.320 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.344 -8.016 -12.047 1.00 0.00 H new ATOM 754 N HIS A 49 6.718 -7.780 -10.543 1.00 0.00 N ATOM 755 CA HIS A 49 8.156 -7.436 -10.321 1.00 0.00 C ATOM 756 C HIS A 49 8.877 -7.259 -11.662 1.00 0.00 C ATOM 757 O HIS A 49 8.386 -7.653 -12.703 1.00 0.00 O ATOM 758 CB HIS A 49 8.825 -8.555 -9.518 1.00 0.00 C ATOM 759 CG HIS A 49 10.318 -8.408 -9.584 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.150 -9.470 -9.904 1.00 0.00 N ATOM 761 CD2 HIS A 49 11.148 -7.329 -9.381 1.00 0.00 C ATOM 762 CE1 HIS A 49 12.415 -9.017 -9.888 1.00 0.00 C ATOM 763 NE2 HIS A 49 12.467 -7.720 -9.575 1.00 0.00 N ATOM 0 H HIS A 49 6.464 -8.737 -10.296 1.00 0.00 H new ATOM 0 HA HIS A 49 8.216 -6.499 -9.768 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.493 -8.519 -8.481 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.528 -9.526 -9.914 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.825 -6.334 -9.113 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.281 -9.626 -10.102 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.301 -7.138 -9.495 1.00 0.00 H new ATOM 772 N VAL A 50 10.036 -6.657 -11.639 1.00 0.00 N ATOM 773 CA VAL A 50 10.799 -6.433 -12.899 1.00 0.00 C ATOM 774 C VAL A 50 11.755 -7.605 -13.143 1.00 0.00 C ATOM 775 O VAL A 50 12.424 -8.070 -12.243 1.00 0.00 O ATOM 776 CB VAL A 50 11.602 -5.130 -12.772 1.00 0.00 C ATOM 777 CG1 VAL A 50 13.099 -5.433 -12.655 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.365 -4.260 -14.006 1.00 0.00 C ATOM 0 H VAL A 50 10.489 -6.309 -10.794 1.00 0.00 H new ATOM 0 HA VAL A 50 10.107 -6.360 -13.738 1.00 0.00 H new ATOM 0 HB VAL A 50 11.272 -4.605 -11.876 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.653 -4.499 -12.566 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.278 -6.047 -11.772 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.432 -5.969 -13.544 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.935 -3.336 -13.915 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.687 -4.798 -14.898 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.304 -4.025 -14.087 1.00 0.00 H new ATOM 841 N ASP A 55 11.791 -3.479 -18.211 1.00 0.00 N ATOM 842 CA ASP A 55 11.893 -2.035 -17.862 1.00 0.00 C ATOM 843 C ASP A 55 10.920 -1.738 -16.728 1.00 0.00 C ATOM 844 O ASP A 55 10.153 -2.584 -16.326 1.00 0.00 O ATOM 845 CB ASP A 55 11.528 -1.172 -19.069 1.00 0.00 C ATOM 846 CG ASP A 55 12.268 0.163 -18.982 1.00 0.00 C ATOM 847 OD1 ASP A 55 12.245 0.897 -19.956 1.00 0.00 O ATOM 848 OD2 ASP A 55 12.842 0.432 -17.939 1.00 0.00 O ATOM 0 HA ASP A 55 12.915 -1.808 -17.560 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.793 -1.688 -19.992 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.452 -1.002 -19.096 1.00 0.00 H new ATOM 854 N ASP A 56 10.942 -0.547 -16.209 1.00 0.00 N ATOM 855 CA ASP A 56 10.008 -0.210 -15.099 1.00 0.00 C ATOM 856 C ASP A 56 8.576 -0.169 -15.636 1.00 0.00 C ATOM 857 O ASP A 56 7.723 -0.926 -15.214 1.00 0.00 O ATOM 858 CB ASP A 56 10.383 1.153 -14.522 1.00 0.00 C ATOM 859 CG ASP A 56 11.780 1.070 -13.908 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.278 -0.035 -13.769 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.329 2.112 -13.591 1.00 0.00 O ATOM 0 H ASP A 56 11.563 0.207 -16.502 1.00 0.00 H new ATOM 0 HA ASP A 56 10.077 -0.965 -14.316 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.361 1.911 -15.305 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.657 1.454 -13.766 1.00 0.00 H new ATOM 867 N LEU A 57 8.300 0.701 -16.574 1.00 0.00 N ATOM 868 CA LEU A 57 6.920 0.767 -17.132 1.00 0.00 C ATOM 869 C LEU A 57 6.639 -0.476 -17.966 1.00 0.00 C ATOM 870 O LEU A 57 5.581 -1.064 -17.878 1.00 0.00 O ATOM 871 CB LEU A 57 6.755 2.010 -18.005 1.00 0.00 C ATOM 872 CG LEU A 57 5.402 1.950 -18.729 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.261 2.235 -17.747 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.383 2.989 -19.849 1.00 0.00 C ATOM 0 H LEU A 57 8.966 1.362 -16.973 1.00 0.00 H new ATOM 0 HA LEU A 57 6.214 0.819 -16.303 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.812 2.909 -17.391 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.566 2.068 -18.731 1.00 0.00 H new ATOM 0 HG LEU A 57 5.265 0.953 -19.147 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.308 2.189 -18.274 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.272 1.491 -16.951 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.391 3.228 -17.317 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.424 2.950 -20.366 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.527 3.983 -19.426 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.185 2.777 -20.556 1.00 0.00 H new ATOM 886 N GLU A 58 7.569 -0.893 -18.775 1.00 0.00 N ATOM 887 CA GLU A 58 7.311 -2.104 -19.591 1.00 0.00 C ATOM 888 C GLU A 58 6.922 -3.210 -18.624 1.00 0.00 C ATOM 889 O GLU A 58 6.097 -4.052 -18.918 1.00 0.00 O ATOM 890 CB GLU A 58 8.564 -2.503 -20.372 1.00 0.00 C ATOM 891 CG GLU A 58 8.933 -1.385 -21.351 1.00 0.00 C ATOM 892 CD GLU A 58 7.804 -1.195 -22.368 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.787 -0.162 -23.018 1.00 0.00 O ATOM 894 OE2 GLU A 58 6.978 -2.086 -22.486 1.00 0.00 O ATOM 0 H GLU A 58 8.481 -0.455 -18.905 1.00 0.00 H new ATOM 0 HA GLU A 58 6.519 -1.919 -20.317 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.390 -2.687 -19.685 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.387 -3.432 -20.914 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.106 -0.456 -20.808 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.862 -1.631 -21.866 1.00 0.00 H new ATOM 902 N THR A 59 7.492 -3.185 -17.449 1.00 0.00 N ATOM 903 CA THR A 59 7.134 -4.201 -16.429 1.00 0.00 C ATOM 904 C THR A 59 5.688 -3.955 -16.002 1.00 0.00 C ATOM 905 O THR A 59 4.897 -4.867 -15.876 1.00 0.00 O ATOM 906 CB THR A 59 8.060 -4.064 -15.221 1.00 0.00 C ATOM 907 OG1 THR A 59 9.150 -4.965 -15.362 1.00 0.00 O ATOM 908 CG2 THR A 59 7.289 -4.379 -13.942 1.00 0.00 C ATOM 0 H THR A 59 8.190 -2.502 -17.155 1.00 0.00 H new ATOM 0 HA THR A 59 7.241 -5.205 -16.839 1.00 0.00 H new ATOM 0 HB THR A 59 8.438 -3.043 -15.164 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.811 -5.883 -15.412 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.953 -4.280 -13.083 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.456 -3.684 -13.839 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.907 -5.399 -13.989 1.00 0.00 H new ATOM 916 N ALA A 60 5.326 -2.715 -15.805 1.00 0.00 N ATOM 917 CA ALA A 60 3.923 -2.416 -15.419 1.00 0.00 C ATOM 918 C ALA A 60 3.033 -2.862 -16.568 1.00 0.00 C ATOM 919 O ALA A 60 2.052 -3.554 -16.382 1.00 0.00 O ATOM 920 CB ALA A 60 3.756 -0.914 -15.201 1.00 0.00 C ATOM 0 H ALA A 60 5.938 -1.904 -15.895 1.00 0.00 H new ATOM 0 HA ALA A 60 3.659 -2.933 -14.496 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.725 -0.700 -14.918 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.426 -0.585 -14.407 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.997 -0.384 -16.122 1.00 0.00 H new ATOM 926 N LEU A 61 3.401 -2.496 -17.763 1.00 0.00 N ATOM 927 CA LEU A 61 2.618 -2.915 -18.950 1.00 0.00 C ATOM 928 C LEU A 61 2.655 -4.444 -19.024 1.00 0.00 C ATOM 929 O LEU A 61 1.686 -5.086 -19.374 1.00 0.00 O ATOM 930 CB LEU A 61 3.252 -2.298 -20.202 1.00 0.00 C ATOM 931 CG LEU A 61 3.063 -0.776 -20.171 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.960 -0.114 -21.220 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.603 -0.437 -20.476 1.00 0.00 C ATOM 0 H LEU A 61 4.218 -1.920 -17.967 1.00 0.00 H new ATOM 0 HA LEU A 61 1.583 -2.579 -18.881 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.313 -2.543 -20.244 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.793 -2.714 -21.099 1.00 0.00 H new ATOM 0 HG LEU A 61 3.331 -0.406 -19.181 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.819 0.966 -21.190 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.003 -0.349 -21.008 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.698 -0.487 -22.210 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.468 0.644 -20.454 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.340 -0.815 -21.464 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.958 -0.898 -19.728 1.00 0.00 H new ATOM 945 N ARG A 62 3.769 -5.031 -18.666 1.00 0.00 N ATOM 946 CA ARG A 62 3.880 -6.519 -18.679 1.00 0.00 C ATOM 947 C ARG A 62 2.884 -7.103 -17.674 1.00 0.00 C ATOM 948 O ARG A 62 2.114 -7.991 -17.986 1.00 0.00 O ATOM 949 CB ARG A 62 5.297 -6.911 -18.260 1.00 0.00 C ATOM 950 CG ARG A 62 5.437 -8.435 -18.218 1.00 0.00 C ATOM 951 CD ARG A 62 6.768 -8.795 -17.551 1.00 0.00 C ATOM 952 NE ARG A 62 6.921 -10.278 -17.514 1.00 0.00 N ATOM 953 CZ ARG A 62 6.236 -10.982 -16.656 1.00 0.00 C ATOM 954 NH1 ARG A 62 5.419 -10.390 -15.828 1.00 0.00 N ATOM 955 NH2 ARG A 62 6.371 -12.280 -16.625 1.00 0.00 N ATOM 0 H ARG A 62 4.610 -4.540 -18.364 1.00 0.00 H new ATOM 0 HA ARG A 62 3.666 -6.901 -19.677 1.00 0.00 H new ATOM 0 HB2 ARG A 62 6.020 -6.492 -18.960 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.523 -6.491 -17.280 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.607 -8.874 -17.664 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.399 -8.845 -19.227 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.595 -8.347 -18.101 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.801 -8.390 -16.540 1.00 0.00 H new ATOM 0 HE ARG A 62 7.561 -10.741 -18.159 1.00 0.00 H new ATOM 0 HH11 ARG A 62 5.316 -9.376 -15.851 1.00 0.00 H new ATOM 0 HH12 ARG A 62 4.884 -10.942 -15.158 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.011 -12.742 -17.271 1.00 0.00 H new ATOM 0 HH22 ARG A 62 5.836 -12.832 -15.955 1.00 0.00 H new ATOM 969 N ALA A 63 2.896 -6.601 -16.467 1.00 0.00 N ATOM 970 CA ALA A 63 1.953 -7.109 -15.432 1.00 0.00 C ATOM 971 C ALA A 63 0.537 -6.672 -15.788 1.00 0.00 C ATOM 972 O ALA A 63 -0.430 -7.328 -15.462 1.00 0.00 O ATOM 973 CB ALA A 63 2.325 -6.528 -14.066 1.00 0.00 C ATOM 0 H ALA A 63 3.521 -5.858 -16.154 1.00 0.00 H new ATOM 0 HA ALA A 63 2.010 -8.197 -15.393 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.633 -6.902 -13.311 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.341 -6.828 -13.808 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.267 -5.440 -14.105 1.00 0.00 H new ATOM 979 N THR A 64 0.406 -5.562 -16.451 1.00 0.00 N ATOM 980 CA THR A 64 -0.948 -5.082 -16.813 1.00 0.00 C ATOM 981 C THR A 64 -1.697 -6.199 -17.527 1.00 0.00 C ATOM 982 O THR A 64 -2.806 -6.544 -17.173 1.00 0.00 O ATOM 983 CB THR A 64 -0.807 -3.877 -17.733 1.00 0.00 C ATOM 984 OG1 THR A 64 0.116 -2.962 -17.163 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.155 -3.192 -17.892 1.00 0.00 C ATOM 0 H THR A 64 1.177 -4.968 -16.757 1.00 0.00 H new ATOM 0 HA THR A 64 -1.503 -4.795 -15.920 1.00 0.00 H new ATOM 0 HB THR A 64 -0.451 -4.206 -18.709 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.792 -3.455 -16.653 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.050 -2.330 -18.551 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.871 -3.893 -18.322 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.512 -2.861 -16.917 1.00 0.00 H new ATOM 993 N GLN A 65 -1.088 -6.784 -18.514 1.00 0.00 N ATOM 994 CA GLN A 65 -1.749 -7.899 -19.235 1.00 0.00 C ATOM 995 C GLN A 65 -1.654 -9.180 -18.400 1.00 0.00 C ATOM 996 O GLN A 65 -2.628 -9.862 -18.170 1.00 0.00 O ATOM 997 CB GLN A 65 -1.064 -8.103 -20.588 1.00 0.00 C ATOM 998 CG GLN A 65 -0.976 -9.594 -20.908 1.00 0.00 C ATOM 999 CD GLN A 65 -0.453 -9.772 -22.332 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.564 -9.216 -22.692 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -1.112 -10.529 -23.166 1.00 0.00 N ATOM 0 H GLN A 65 -0.158 -6.537 -18.853 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.800 -7.659 -19.397 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -1.622 -7.587 -21.369 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -0.065 -7.667 -20.569 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.314 -10.092 -20.200 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -1.957 -10.058 -20.807 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -1.967 -10.997 -22.864 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -0.772 -10.653 -24.120 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.479 -9.519 -17.960 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.306 -10.769 -17.167 1.00 0.00 C ATOM 1012 C GLU A 66 -1.145 -10.742 -15.883 1.00 0.00 C ATOM 1013 O GLU A 66 -1.631 -11.764 -15.443 1.00 0.00 O ATOM 1014 CB GLU A 66 1.170 -10.929 -16.804 1.00 0.00 C ATOM 1015 CG GLU A 66 1.969 -11.286 -18.058 1.00 0.00 C ATOM 1016 CD GLU A 66 1.519 -12.652 -18.581 1.00 0.00 C ATOM 1017 OE1 GLU A 66 0.877 -13.373 -17.832 1.00 0.00 O ATOM 1018 OE2 GLU A 66 1.824 -12.957 -19.723 1.00 0.00 O ATOM 0 H GLU A 66 0.375 -8.983 -18.115 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.644 -11.609 -17.773 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.550 -10.005 -16.369 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.288 -11.708 -16.051 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.821 -10.525 -18.824 1.00 0.00 H new ATOM 0 HG3 GLU A 66 3.035 -11.306 -17.829 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.306 -9.607 -15.257 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.097 -9.579 -13.990 1.00 0.00 C ATOM 1028 C GLU A 67 -3.602 -9.486 -14.282 1.00 0.00 C ATOM 1029 O GLU A 67 -4.386 -10.265 -13.775 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.668 -8.379 -13.142 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.178 -8.485 -12.804 1.00 0.00 C ATOM 1032 CD GLU A 67 0.090 -9.762 -12.007 1.00 0.00 C ATOM 1033 OE1 GLU A 67 1.246 -10.149 -11.925 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -0.857 -10.332 -11.492 1.00 0.00 O ATOM 0 H GLU A 67 -0.930 -8.709 -15.562 1.00 0.00 H new ATOM 0 HA GLU A 67 -1.906 -10.505 -13.447 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.862 -7.453 -13.683 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.256 -8.342 -12.225 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.412 -8.489 -13.721 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.135 -7.615 -12.227 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.018 -8.541 -15.085 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.479 -8.407 -15.386 1.00 0.00 C ATOM 1044 C ALA A 68 -5.788 -8.975 -16.764 1.00 0.00 C ATOM 1045 O ALA A 68 -6.928 -9.221 -17.101 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.883 -6.935 -15.377 1.00 0.00 C ATOM 0 H ALA A 68 -3.415 -7.859 -15.544 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.033 -8.955 -14.624 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.947 -6.848 -15.597 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.679 -6.508 -14.395 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.311 -6.396 -16.133 1.00 0.00 H new ATOM 1052 N GLY A 69 -4.792 -9.179 -17.572 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.061 -9.721 -18.928 1.00 0.00 C ATOM 1054 C GLY A 69 -5.166 -8.565 -19.923 1.00 0.00 C ATOM 1055 O GLY A 69 -5.477 -8.767 -21.081 1.00 0.00 O ATOM 0 H GLY A 69 -3.812 -8.996 -17.356 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.262 -10.400 -19.225 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -5.986 -10.298 -18.925 1.00 0.00 H new ATOM 1059 N ILE A 70 -4.913 -7.354 -19.490 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.011 -6.213 -20.438 1.00 0.00 C ATOM 1061 C ILE A 70 -3.625 -5.846 -20.965 1.00 0.00 C ATOM 1062 O ILE A 70 -2.702 -5.601 -20.211 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.595 -4.986 -19.744 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.725 -5.409 -18.814 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.143 -4.033 -20.807 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.301 -4.173 -18.131 1.00 0.00 C ATOM 0 H ILE A 70 -4.647 -7.113 -18.535 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.660 -6.517 -21.259 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.819 -4.490 -19.161 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.503 -5.923 -19.378 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.354 -6.112 -18.068 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.564 -3.151 -20.323 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.337 -3.730 -21.475 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -6.920 -4.537 -21.382 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.110 -4.470 -17.464 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.519 -3.678 -17.555 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.686 -3.487 -18.885 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.479 -5.782 -22.254 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.165 -5.408 -22.829 1.00 0.00 C ATOM 1080 C GLU A 71 -2.163 -3.907 -23.091 1.00 0.00 C ATOM 1081 O GLU A 71 -3.198 -3.274 -23.119 1.00 0.00 O ATOM 1082 CB GLU A 71 -1.933 -6.162 -24.139 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.025 -5.792 -25.141 1.00 0.00 C ATOM 1084 CD GLU A 71 -2.900 -6.685 -26.375 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -1.792 -7.106 -26.669 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -3.914 -6.938 -27.004 1.00 0.00 O ATOM 0 H GLU A 71 -4.214 -5.973 -22.935 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.368 -5.669 -22.133 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.953 -5.913 -24.545 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.940 -7.237 -23.958 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.008 -5.915 -24.687 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.934 -4.744 -25.425 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.017 -3.332 -23.274 1.00 0.00 N ATOM 1095 CA ALA A 72 -0.960 -1.871 -23.526 1.00 0.00 C ATOM 1096 C ALA A 72 -1.625 -1.565 -24.871 1.00 0.00 C ATOM 1097 O ALA A 72 -2.034 -0.452 -25.139 1.00 0.00 O ATOM 1098 CB ALA A 72 0.496 -1.413 -23.545 1.00 0.00 C ATOM 0 H ALA A 72 -0.115 -3.808 -23.261 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.488 -1.339 -22.735 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.537 -0.340 -23.730 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.959 -1.633 -22.583 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.032 -1.938 -24.335 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.730 -2.548 -25.721 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.358 -2.321 -27.052 1.00 0.00 C ATOM 1106 C GLY A 73 -3.762 -1.734 -26.879 1.00 0.00 C ATOM 1107 O GLY A 73 -4.212 -0.945 -27.686 1.00 0.00 O ATOM 0 H GLY A 73 -1.407 -3.501 -25.551 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.742 -1.643 -27.642 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.414 -3.261 -27.601 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.459 -2.108 -25.841 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.830 -1.557 -25.639 1.00 0.00 C ATOM 1113 C GLN A 74 -5.788 -0.453 -24.581 1.00 0.00 C ATOM 1114 O GLN A 74 -6.791 0.161 -24.272 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.793 -2.668 -25.209 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.255 -3.401 -23.982 1.00 0.00 C ATOM 1117 CD GLN A 74 -6.941 -4.764 -23.875 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -8.075 -4.921 -24.280 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -6.296 -5.770 -23.345 1.00 0.00 N ATOM 0 H GLN A 74 -4.142 -2.766 -25.129 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.188 -1.138 -26.580 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.771 -2.242 -24.985 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.932 -3.373 -26.028 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.175 -3.528 -24.063 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.440 -2.815 -23.082 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -5.343 -5.642 -23.004 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -6.745 -6.683 -23.273 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.632 -0.189 -24.031 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.526 0.884 -23.000 1.00 0.00 C ATOM 1130 C LEU A 75 -3.690 2.039 -23.528 1.00 0.00 C ATOM 1131 O LEU A 75 -2.755 1.856 -24.283 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.815 0.363 -21.757 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.552 -0.833 -21.183 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.614 -1.584 -20.252 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.753 -0.345 -20.384 1.00 0.00 C ATOM 0 H LEU A 75 -3.759 -0.669 -24.251 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.539 1.207 -22.761 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.792 0.081 -22.008 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.754 1.153 -21.008 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.886 -1.486 -21.989 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.132 -2.447 -19.832 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.740 -1.921 -20.810 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.296 -0.924 -19.445 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.286 -1.201 -19.969 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.413 0.299 -19.573 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.421 0.217 -21.037 1.00 0.00 H new ATOM 1147 N THR A 76 -3.984 3.222 -23.078 1.00 0.00 N ATOM 1148 CA THR A 76 -3.182 4.400 -23.481 1.00 0.00 C ATOM 1149 C THR A 76 -2.601 4.975 -22.192 1.00 0.00 C ATOM 1150 O THR A 76 -3.321 5.245 -21.252 1.00 0.00 O ATOM 1151 CB THR A 76 -4.075 5.428 -24.192 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.366 5.995 -25.287 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.486 6.540 -23.222 1.00 0.00 C ATOM 0 H THR A 76 -4.755 3.423 -22.441 1.00 0.00 H new ATOM 0 HA THR A 76 -2.389 4.132 -24.179 1.00 0.00 H new ATOM 0 HB THR A 76 -4.972 4.925 -24.553 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.936 6.650 -25.742 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.118 7.260 -23.741 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.038 6.109 -22.387 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.595 7.043 -22.847 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.313 5.125 -22.109 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.726 5.639 -20.842 1.00 0.00 C ATOM 1163 C ILE A 77 -0.903 7.148 -20.735 1.00 0.00 C ATOM 1164 O ILE A 77 -0.081 7.910 -21.200 1.00 0.00 O ATOM 1165 CB ILE A 77 0.767 5.316 -20.779 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.971 3.798 -20.833 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.347 5.874 -19.473 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.096 3.237 -19.415 1.00 0.00 C ATOM 0 H ILE A 77 -0.646 4.918 -22.852 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.246 5.154 -20.016 1.00 0.00 H new ATOM 0 HB ILE A 77 1.277 5.771 -21.628 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.132 3.328 -21.346 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.868 3.563 -21.406 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.412 5.647 -19.422 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.204 6.954 -19.444 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.837 5.418 -18.624 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.241 2.158 -19.462 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.949 3.696 -18.916 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.187 3.457 -18.855 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.941 7.593 -20.083 1.00 0.00 N ATOM 1181 CA ILE A 78 -2.108 9.056 -19.909 1.00 0.00 C ATOM 1182 C ILE A 78 -0.808 9.584 -19.359 1.00 0.00 C ATOM 1183 O ILE A 78 -0.313 10.626 -19.739 1.00 0.00 O ATOM 1184 CB ILE A 78 -3.181 9.341 -18.865 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.558 9.116 -19.472 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -3.040 10.784 -18.372 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.719 7.629 -19.782 1.00 0.00 C ATOM 0 H ILE A 78 -2.671 7.013 -19.669 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.384 9.514 -20.859 1.00 0.00 H new ATOM 0 HB ILE A 78 -3.060 8.666 -18.018 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.334 9.444 -18.780 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.671 9.706 -20.381 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.807 10.990 -17.625 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -2.054 10.922 -17.928 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.159 11.469 -19.212 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.702 7.453 -20.218 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.948 7.319 -20.488 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.621 7.053 -18.862 1.00 0.00 H new ATOM 1199 N GLU A 79 -0.274 8.853 -18.430 1.00 0.00 N ATOM 1200 CA GLU A 79 0.985 9.269 -17.785 1.00 0.00 C ATOM 1201 C GLU A 79 0.670 10.423 -16.838 1.00 0.00 C ATOM 1202 O GLU A 79 -0.204 10.321 -16.001 1.00 0.00 O ATOM 1203 CB GLU A 79 1.982 9.691 -18.862 1.00 0.00 C ATOM 1204 CG GLU A 79 3.310 8.996 -18.596 1.00 0.00 C ATOM 1205 CD GLU A 79 4.320 9.397 -19.670 1.00 0.00 C ATOM 1206 OE1 GLU A 79 3.916 10.037 -20.625 1.00 0.00 O ATOM 1207 OE2 GLU A 79 5.482 9.055 -19.517 1.00 0.00 O ATOM 0 H GLU A 79 -0.664 7.975 -18.088 1.00 0.00 H new ATOM 0 HA GLU A 79 1.429 8.452 -17.217 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.607 9.424 -19.850 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.113 10.773 -18.853 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.684 9.270 -17.610 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.173 7.915 -18.596 1.00 0.00 H new ATOM 1215 N GLY A 80 1.360 11.513 -16.948 1.00 0.00 N ATOM 1216 CA GLY A 80 1.077 12.646 -16.037 1.00 0.00 C ATOM 1217 C GLY A 80 1.495 12.256 -14.621 1.00 0.00 C ATOM 1218 O GLY A 80 2.296 12.923 -13.998 1.00 0.00 O ATOM 0 H GLY A 80 2.106 11.670 -17.626 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.620 13.534 -16.360 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.016 12.895 -16.062 1.00 0.00 H new ATOM 1222 N PHE A 81 0.959 11.179 -14.102 1.00 0.00 N ATOM 1223 CA PHE A 81 1.336 10.761 -12.723 1.00 0.00 C ATOM 1224 C PHE A 81 2.176 9.480 -12.766 1.00 0.00 C ATOM 1225 O PHE A 81 1.749 8.457 -13.266 1.00 0.00 O ATOM 1226 CB PHE A 81 0.066 10.508 -11.910 1.00 0.00 C ATOM 1227 CG PHE A 81 0.432 10.334 -10.454 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.813 9.077 -9.974 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.397 11.434 -9.591 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.160 8.920 -8.627 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.746 11.279 -8.244 1.00 0.00 C ATOM 1232 CZ PHE A 81 1.128 10.019 -7.762 1.00 0.00 C ATOM 0 H PHE A 81 0.282 10.578 -14.572 1.00 0.00 H new ATOM 0 HA PHE A 81 1.924 11.553 -12.259 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.626 11.342 -12.026 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.444 9.617 -12.278 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.839 8.229 -10.642 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.101 12.403 -9.964 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.453 7.949 -8.255 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.721 12.128 -7.577 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.397 9.897 -6.723 1.00 0.00 H new ATOM 1242 N LYS A 82 3.361 9.529 -12.219 1.00 0.00 N ATOM 1243 CA LYS A 82 4.236 8.321 -12.192 1.00 0.00 C ATOM 1244 C LYS A 82 5.191 8.432 -11.017 1.00 0.00 C ATOM 1245 O LYS A 82 6.046 9.292 -10.984 1.00 0.00 O ATOM 1246 CB LYS A 82 5.064 8.216 -13.481 1.00 0.00 C ATOM 1247 CG LYS A 82 6.092 7.074 -13.355 1.00 0.00 C ATOM 1248 CD LYS A 82 7.290 7.507 -12.493 1.00 0.00 C ATOM 1249 CE LYS A 82 8.535 6.708 -12.898 1.00 0.00 C ATOM 1250 NZ LYS A 82 9.754 7.400 -12.394 1.00 0.00 N ATOM 0 H LYS A 82 3.763 10.360 -11.786 1.00 0.00 H new ATOM 0 HA LYS A 82 3.605 7.437 -12.101 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.407 8.033 -14.331 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.577 9.159 -13.672 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.617 6.199 -12.911 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.439 6.780 -14.346 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.474 8.574 -12.619 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.069 7.344 -11.438 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.481 5.699 -12.490 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.581 6.611 -13.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.599 6.859 -12.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.806 8.354 -12.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.710 7.471 -11.357 1.00 0.00 H new ATOM 1264 N ARG A 83 5.082 7.555 -10.069 1.00 0.00 N ATOM 1265 CA ARG A 83 6.012 7.594 -8.911 1.00 0.00 C ATOM 1266 C ARG A 83 6.193 6.169 -8.401 1.00 0.00 C ATOM 1267 O ARG A 83 5.463 5.274 -8.778 1.00 0.00 O ATOM 1268 CB ARG A 83 5.449 8.487 -7.799 1.00 0.00 C ATOM 1269 CG ARG A 83 5.476 9.953 -8.246 1.00 0.00 C ATOM 1270 CD ARG A 83 6.920 10.393 -8.503 1.00 0.00 C ATOM 1271 NE ARG A 83 7.181 11.679 -7.806 1.00 0.00 N ATOM 1272 CZ ARG A 83 8.410 12.059 -7.587 1.00 0.00 C ATOM 1273 NH1 ARG A 83 9.405 11.321 -7.996 1.00 0.00 N ATOM 1274 NH2 ARG A 83 8.647 13.177 -6.965 1.00 0.00 N ATOM 0 H ARG A 83 4.387 6.809 -10.043 1.00 0.00 H new ATOM 0 HA ARG A 83 6.972 8.010 -9.219 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.428 8.188 -7.562 1.00 0.00 H new ATOM 0 HB3 ARG A 83 6.036 8.364 -6.889 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.882 10.077 -9.152 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.025 10.584 -7.480 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.612 9.629 -8.149 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.091 10.507 -9.573 1.00 0.00 H new ATOM 0 HE ARG A 83 6.402 12.263 -7.500 1.00 0.00 H new ATOM 0 HH11 ARG A 83 9.223 10.446 -8.488 1.00 0.00 H new ATOM 0 HH12 ARG A 83 10.365 11.619 -7.824 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.871 13.758 -6.647 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.608 13.472 -6.795 1.00 0.00 H new ATOM 1288 N GLU A 84 7.156 5.937 -7.559 1.00 0.00 N ATOM 1289 CA GLU A 84 7.352 4.552 -7.061 1.00 0.00 C ATOM 1290 C GLU A 84 6.390 4.280 -5.907 1.00 0.00 C ATOM 1291 O GLU A 84 6.601 4.699 -4.787 1.00 0.00 O ATOM 1292 CB GLU A 84 8.795 4.363 -6.593 1.00 0.00 C ATOM 1293 CG GLU A 84 9.740 4.558 -7.778 1.00 0.00 C ATOM 1294 CD GLU A 84 10.089 6.040 -7.918 1.00 0.00 C ATOM 1295 OE1 GLU A 84 10.848 6.366 -8.815 1.00 0.00 O ATOM 1296 OE2 GLU A 84 9.592 6.824 -7.127 1.00 0.00 O ATOM 0 H GLU A 84 7.807 6.634 -7.198 1.00 0.00 H new ATOM 0 HA GLU A 84 7.150 3.850 -7.870 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.030 5.078 -5.804 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.925 3.367 -6.170 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.648 3.973 -7.632 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.271 4.196 -8.693 1.00 0.00 H new ATOM 1304 N LEU A 85 5.342 3.558 -6.184 1.00 0.00 N ATOM 1305 CA LEU A 85 4.354 3.215 -5.128 1.00 0.00 C ATOM 1306 C LEU A 85 4.974 2.125 -4.262 1.00 0.00 C ATOM 1307 O LEU A 85 5.468 1.144 -4.770 1.00 0.00 O ATOM 1308 CB LEU A 85 3.089 2.670 -5.801 1.00 0.00 C ATOM 1309 CG LEU A 85 1.868 2.948 -4.918 1.00 0.00 C ATOM 1310 CD1 LEU A 85 0.990 4.028 -5.556 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.034 1.679 -4.752 1.00 0.00 C ATOM 0 H LEU A 85 5.126 3.187 -7.109 1.00 0.00 H new ATOM 0 HA LEU A 85 4.098 4.086 -4.525 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.956 3.136 -6.777 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.190 1.598 -5.971 1.00 0.00 H new ATOM 0 HG LEU A 85 2.223 3.286 -3.944 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.126 4.217 -4.920 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.566 4.946 -5.667 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.652 3.690 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.170 1.891 -4.122 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.695 1.336 -5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.641 0.903 -4.285 1.00 0.00 H new ATOM 1323 N ASN A 86 4.990 2.284 -2.969 1.00 0.00 N ATOM 1324 CA ASN A 86 5.624 1.233 -2.122 1.00 0.00 C ATOM 1325 C ASN A 86 4.680 0.788 -1.008 1.00 0.00 C ATOM 1326 O ASN A 86 4.150 1.586 -0.262 1.00 0.00 O ATOM 1327 CB ASN A 86 6.922 1.788 -1.535 1.00 0.00 C ATOM 1328 CG ASN A 86 7.863 2.125 -2.690 1.00 0.00 C ATOM 1329 OD1 ASN A 86 8.931 2.666 -2.491 1.00 0.00 O ATOM 1330 ND2 ASN A 86 7.499 1.811 -3.903 1.00 0.00 N ATOM 0 H ASN A 86 4.599 3.081 -2.467 1.00 0.00 H new ATOM 0 HA ASN A 86 5.843 0.359 -2.736 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.719 2.677 -0.938 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.382 1.056 -0.871 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.113 2.020 -4.690 1.00 0.00 H new ATOM 0 HD22 ASN A 86 6.600 1.356 -4.064 1.00 0.00 H new ATOM 1480 N THR A 95 9.180 -2.035 -3.897 1.00 0.00 N ATOM 1481 CA THR A 95 8.876 -0.777 -4.629 1.00 0.00 C ATOM 1482 C THR A 95 7.910 -1.070 -5.776 1.00 0.00 C ATOM 1483 O THR A 95 8.062 -2.029 -6.505 1.00 0.00 O ATOM 1484 CB THR A 95 10.153 -0.149 -5.190 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.770 0.638 -4.183 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.787 0.737 -6.384 1.00 0.00 C ATOM 0 HA THR A 95 8.421 -0.075 -3.930 1.00 0.00 H new ATOM 0 HB THR A 95 10.843 -0.929 -5.510 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.133 1.305 -3.853 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.691 1.190 -6.792 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.306 0.132 -7.152 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.103 1.521 -6.059 1.00 0.00 H new ATOM 1494 N VAL A 96 6.915 -0.245 -5.930 1.00 0.00 N ATOM 1495 CA VAL A 96 5.923 -0.458 -7.016 1.00 0.00 C ATOM 1496 C VAL A 96 5.663 0.863 -7.733 1.00 0.00 C ATOM 1497 O VAL A 96 5.392 1.862 -7.109 1.00 0.00 O ATOM 1498 CB VAL A 96 4.622 -0.959 -6.400 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.532 -0.993 -7.467 1.00 0.00 C ATOM 1500 CG2 VAL A 96 4.833 -2.364 -5.832 1.00 0.00 C ATOM 0 H VAL A 96 6.746 0.574 -5.346 1.00 0.00 H new ATOM 0 HA VAL A 96 6.306 -1.188 -7.729 1.00 0.00 H new ATOM 0 HB VAL A 96 4.318 -0.288 -5.597 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.602 -1.351 -7.026 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.382 0.010 -7.866 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.833 -1.662 -8.273 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.902 -2.722 -5.392 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.138 -3.038 -6.632 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.609 -2.334 -5.067 1.00 0.00 H new ATOM 1510 N ILE A 97 5.721 0.880 -9.032 1.00 0.00 N ATOM 1511 CA ILE A 97 5.459 2.153 -9.761 1.00 0.00 C ATOM 1512 C ILE A 97 4.070 2.073 -10.382 1.00 0.00 C ATOM 1513 O ILE A 97 3.682 1.060 -10.927 1.00 0.00 O ATOM 1514 CB ILE A 97 6.513 2.358 -10.845 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.839 1.759 -10.370 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.695 3.856 -11.098 1.00 0.00 C ATOM 1517 CD1 ILE A 97 8.990 2.379 -11.160 1.00 0.00 C ATOM 0 H ILE A 97 5.937 0.075 -9.620 1.00 0.00 H new ATOM 0 HA ILE A 97 5.508 2.997 -9.074 1.00 0.00 H new ATOM 0 HB ILE A 97 6.196 1.870 -11.766 1.00 0.00 H new ATOM 0 HG12 ILE A 97 7.973 1.945 -9.304 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.831 0.678 -10.506 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.448 4.005 -11.872 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.749 4.288 -11.424 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.019 4.344 -10.178 1.00 0.00 H new ATOM 0 HD11 ILE A 97 9.935 1.953 -10.822 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.857 2.170 -12.221 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.001 3.457 -11.001 1.00 0.00 H new ATOM 1529 N TYR A 98 3.309 3.120 -10.273 1.00 0.00 N ATOM 1530 CA TYR A 98 1.923 3.097 -10.818 1.00 0.00 C ATOM 1531 C TYR A 98 1.741 4.177 -11.892 1.00 0.00 C ATOM 1532 O TYR A 98 1.999 5.342 -11.668 1.00 0.00 O ATOM 1533 CB TYR A 98 0.963 3.379 -9.661 1.00 0.00 C ATOM 1534 CG TYR A 98 0.608 2.115 -8.888 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.167 0.861 -9.211 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.305 2.208 -7.834 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.807 -0.278 -8.476 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.659 1.069 -7.104 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.105 -0.171 -7.424 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.455 -1.290 -6.696 1.00 0.00 O ATOM 0 H TYR A 98 3.585 3.996 -9.829 1.00 0.00 H new ATOM 0 HA TYR A 98 1.725 2.126 -11.272 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.416 4.102 -8.983 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.052 3.833 -10.050 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.872 0.778 -10.025 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.739 3.164 -7.582 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.235 -1.238 -8.724 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.364 1.149 -6.290 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.074 -1.034 -5.981 1.00 0.00 H new ATOM 1550 N TRP A 99 1.272 3.794 -13.055 1.00 0.00 N ATOM 1551 CA TRP A 99 1.041 4.787 -14.149 1.00 0.00 C ATOM 1552 C TRP A 99 -0.453 4.902 -14.432 1.00 0.00 C ATOM 1553 O TRP A 99 -1.234 4.051 -14.059 1.00 0.00 O ATOM 1554 CB TRP A 99 1.731 4.335 -15.435 1.00 0.00 C ATOM 1555 CG TRP A 99 3.154 4.764 -15.431 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.592 5.991 -15.780 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.328 3.990 -15.078 1.00 0.00 C ATOM 1558 NE1 TRP A 99 4.967 6.019 -15.663 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.467 4.807 -15.228 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.510 2.668 -14.642 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.748 4.330 -14.956 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.794 2.185 -14.369 1.00 0.00 C ATOM 1563 CH2 TRP A 99 6.913 3.013 -14.523 1.00 0.00 C ATOM 0 H TRP A 99 1.038 2.830 -13.294 1.00 0.00 H new ATOM 0 HA TRP A 99 1.446 5.747 -13.828 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.671 3.251 -15.527 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.218 4.757 -16.299 1.00 0.00 H new ATOM 0 HD1 TRP A 99 2.970 6.815 -16.098 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.543 6.834 -15.872 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.654 2.021 -14.517 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.606 4.974 -15.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 5.924 1.166 -14.037 1.00 0.00 H new ATOM 0 HH2 TRP A 99 7.901 2.634 -14.307 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.855 5.936 -15.115 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.294 6.090 -15.448 1.00 0.00 C ATOM 1576 C LEU A 100 -2.567 5.404 -16.788 1.00 0.00 C ATOM 1577 O LEU A 100 -1.844 5.584 -17.748 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.637 7.584 -15.547 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.771 8.187 -14.148 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -3.009 9.696 -14.262 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.965 7.548 -13.437 1.00 0.00 C ATOM 0 H LEU A 100 -0.248 6.681 -15.457 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.909 5.634 -14.672 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.860 8.107 -16.104 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.568 7.715 -16.099 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.857 8.001 -13.583 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.105 10.126 -13.265 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.168 10.159 -14.778 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.924 9.878 -14.825 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.065 7.974 -12.439 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.874 7.741 -14.007 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.808 6.472 -13.358 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.605 4.611 -16.863 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.908 3.914 -18.144 1.00 0.00 C ATOM 1595 C ALA A 101 -5.420 3.882 -18.379 1.00 0.00 C ATOM 1596 O ALA A 101 -6.200 3.735 -17.459 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.383 2.478 -18.075 1.00 0.00 C ATOM 0 H ALA A 101 -4.251 4.418 -16.097 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.427 4.449 -18.963 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.603 1.965 -19.011 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.305 2.492 -17.914 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.866 1.953 -17.251 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.839 4.009 -19.610 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.298 3.978 -19.915 1.00 0.00 C ATOM 1605 C GLU A 102 -7.574 2.892 -20.950 1.00 0.00 C ATOM 1606 O GLU A 102 -6.869 2.768 -21.931 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.727 5.333 -20.478 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.228 5.319 -20.778 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.627 6.642 -21.438 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.734 6.717 -21.944 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.821 7.557 -21.422 1.00 0.00 O ATOM 0 H GLU A 102 -5.231 4.133 -20.420 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.857 3.767 -19.004 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.497 6.123 -19.763 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.167 5.553 -21.387 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.471 4.484 -21.435 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.793 5.174 -19.857 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.600 2.111 -20.756 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.911 1.051 -21.752 1.00 0.00 C ATOM 1621 C VAL A 103 -9.835 1.622 -22.816 1.00 0.00 C ATOM 1622 O VAL A 103 -10.938 2.048 -22.534 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.615 -0.134 -21.074 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.683 -0.798 -20.063 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.864 0.361 -20.353 1.00 0.00 C ATOM 0 H VAL A 103 -9.232 2.161 -19.957 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.979 0.706 -22.199 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.890 -0.862 -21.837 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.196 -1.636 -19.591 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.791 -1.160 -20.574 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.396 -0.073 -19.302 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.364 -0.480 -19.872 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.582 1.095 -19.599 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.541 0.822 -21.072 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.407 1.613 -24.042 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.274 2.129 -25.126 1.00 0.00 C ATOM 1637 C LYS A 104 -11.405 1.125 -25.327 1.00 0.00 C ATOM 1638 O LYS A 104 -12.352 1.362 -26.050 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.451 2.282 -26.408 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.797 0.947 -26.759 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.663 1.185 -27.757 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.532 1.955 -27.068 1.00 0.00 C ATOM 1643 NZ LYS A 104 -5.221 1.378 -27.474 1.00 0.00 N ATOM 0 H LYS A 104 -8.494 1.270 -24.340 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.685 3.106 -24.871 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.091 2.611 -27.226 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.688 3.048 -26.273 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.410 0.471 -25.858 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.536 0.268 -27.186 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.291 0.233 -28.136 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.031 1.748 -28.615 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.577 3.010 -27.340 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.646 1.900 -25.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.501 1.619 -26.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.304 0.344 -27.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -4.941 1.767 -28.397 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.311 0.005 -24.655 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.374 -1.035 -24.756 1.00 0.00 C ATOM 1659 C ASP A 105 -13.192 -1.026 -23.466 1.00 0.00 C ATOM 1660 O ASP A 105 -12.797 -1.580 -22.458 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.736 -2.413 -24.936 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.334 -2.611 -26.397 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -10.795 -3.661 -26.705 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -11.571 -1.710 -27.186 1.00 0.00 O ATOM 0 H ASP A 105 -10.536 -0.233 -24.036 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.015 -0.822 -25.612 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.861 -2.505 -24.293 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.437 -3.191 -24.634 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.330 -0.400 -23.495 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.188 -0.341 -22.281 1.00 0.00 C ATOM 1672 C TYR A 106 -15.493 -1.766 -21.825 1.00 0.00 C ATOM 1673 O TYR A 106 -15.696 -2.029 -20.656 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.492 0.380 -22.632 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.226 0.781 -21.376 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -17.893 -0.182 -20.610 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.252 2.126 -20.988 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -18.582 0.201 -19.455 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -17.941 2.508 -19.833 1.00 0.00 C ATOM 1680 CZ TYR A 106 -18.607 1.545 -19.068 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.288 1.918 -17.929 1.00 0.00 O ATOM 0 H TYR A 106 -14.707 0.078 -24.313 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.679 0.197 -21.481 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.276 1.264 -23.232 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.123 -0.271 -23.238 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -17.876 -1.219 -20.910 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.740 2.869 -21.581 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.095 -0.541 -18.861 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -17.959 3.545 -19.532 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.027 2.828 -17.675 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.530 -2.686 -22.749 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.825 -4.102 -22.394 1.00 0.00 C ATOM 1693 C ASP A 107 -14.538 -4.927 -22.426 1.00 0.00 C ATOM 1694 O ASP A 107 -14.571 -6.133 -22.581 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.818 -4.685 -23.397 1.00 0.00 C ATOM 1696 CG ASP A 107 -18.168 -3.984 -23.243 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -18.361 -3.333 -22.228 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -18.986 -4.113 -24.138 1.00 0.00 O ATOM 0 H ASP A 107 -15.367 -2.516 -23.741 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.251 -4.134 -21.391 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.443 -4.557 -24.413 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -16.931 -5.756 -23.232 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.402 -4.293 -22.292 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.122 -5.058 -22.327 1.00 0.00 C ATOM 1706 C VAL A 108 -12.285 -6.340 -21.521 1.00 0.00 C ATOM 1707 O VAL A 108 -13.010 -6.389 -20.548 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.983 -4.222 -21.733 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.324 -3.796 -20.303 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.702 -5.058 -21.720 1.00 0.00 C ATOM 0 H VAL A 108 -13.306 -3.286 -22.161 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.878 -5.296 -23.362 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.842 -3.329 -22.342 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.505 -3.203 -19.895 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.236 -3.200 -20.309 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.474 -4.682 -19.685 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.887 -4.469 -21.299 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.856 -5.950 -21.113 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.448 -5.351 -22.739 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.618 -7.378 -21.918 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.737 -8.653 -21.176 1.00 0.00 C ATOM 1722 C GLU A 109 -10.625 -8.729 -20.142 1.00 0.00 C ATOM 1723 O GLU A 109 -9.476 -8.961 -20.459 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.617 -9.830 -22.143 1.00 0.00 C ATOM 1725 CG GLU A 109 -11.869 -11.134 -21.382 1.00 0.00 C ATOM 1726 CD GLU A 109 -13.347 -11.224 -20.996 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -13.653 -11.949 -20.064 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -14.148 -10.565 -21.638 1.00 0.00 O ATOM 0 H GLU A 109 -10.995 -7.399 -22.725 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.707 -8.698 -20.681 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.336 -9.724 -22.955 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.625 -9.845 -22.596 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.591 -11.988 -22.000 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.246 -11.172 -20.488 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.955 -8.545 -18.906 1.00 0.00 N ATOM 1737 CA ILE A 110 -9.917 -8.617 -17.851 1.00 0.00 C ATOM 1738 C ILE A 110 -9.562 -10.077 -17.626 1.00 0.00 C ATOM 1739 O ILE A 110 -10.197 -10.767 -16.854 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.458 -8.038 -16.554 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.129 -6.696 -16.848 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.303 -7.836 -15.575 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.150 -5.779 -17.567 1.00 0.00 C ATOM 0 H ILE A 110 -11.900 -8.347 -18.576 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.039 -8.050 -18.160 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.187 -8.719 -16.116 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -12.017 -6.849 -17.462 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.460 -6.233 -15.919 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.685 -7.421 -14.642 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -8.823 -8.794 -15.376 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.576 -7.149 -16.007 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.632 -4.824 -17.775 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.276 -5.615 -16.937 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.840 -6.241 -18.505 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.555 -10.560 -18.289 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.174 -11.981 -18.091 1.00 0.00 C ATOM 1757 C ARG A 111 -7.166 -12.059 -16.958 1.00 0.00 C ATOM 1758 O ARG A 111 -6.123 -11.443 -16.995 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.576 -12.548 -19.378 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.689 -13.222 -20.176 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.239 -13.425 -21.619 1.00 0.00 C ATOM 1762 NE ARG A 111 -8.101 -12.101 -22.289 1.00 0.00 N ATOM 1763 CZ ARG A 111 -7.610 -12.031 -23.495 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -7.208 -13.114 -24.102 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -7.511 -10.878 -24.092 1.00 0.00 N ATOM 0 H ARG A 111 -7.983 -10.039 -18.954 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.055 -12.571 -17.838 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.118 -11.752 -19.965 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.789 -13.266 -19.146 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -8.942 -14.182 -19.726 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.590 -12.610 -20.149 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -7.288 -13.957 -21.643 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.962 -14.041 -22.153 1.00 0.00 H new ATOM 0 HE ARG A 111 -8.390 -11.251 -21.805 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.278 -14.017 -23.633 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -6.824 -13.057 -25.045 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -7.818 -10.029 -23.616 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -7.127 -10.823 -25.035 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.477 -12.800 -15.939 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.539 -12.897 -14.795 1.00 0.00 C ATOM 1781 C LEU A 112 -5.729 -14.183 -14.919 1.00 0.00 C ATOM 1782 O LEU A 112 -6.215 -15.263 -14.649 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.334 -12.926 -13.487 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.530 -11.978 -13.576 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.275 -11.991 -12.241 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.049 -10.554 -13.876 1.00 0.00 C ATOM 0 H LEU A 112 -8.337 -13.341 -15.848 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.869 -12.037 -14.797 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.679 -13.940 -13.285 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.691 -12.636 -12.656 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.193 -12.305 -14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.130 -11.317 -12.295 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.622 -13.002 -12.028 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.604 -11.663 -11.447 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.908 -9.885 -13.938 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.385 -10.219 -13.079 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.512 -10.544 -14.825 1.00 0.00 H new ATOM 1798 N SER A 113 -4.492 -14.078 -15.316 1.00 0.00 N ATOM 1799 CA SER A 113 -3.649 -15.298 -15.447 1.00 0.00 C ATOM 1800 C SER A 113 -3.307 -15.814 -14.050 1.00 0.00 C ATOM 1801 O SER A 113 -3.564 -15.157 -13.061 1.00 0.00 O ATOM 1802 CB SER A 113 -2.359 -14.950 -16.186 1.00 0.00 C ATOM 1803 OG SER A 113 -2.677 -14.434 -17.471 1.00 0.00 O ATOM 0 H SER A 113 -4.029 -13.201 -15.555 1.00 0.00 H new ATOM 0 HA SER A 113 -4.190 -16.062 -16.005 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.788 -14.216 -15.618 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.732 -15.836 -16.283 1.00 0.00 H new ATOM 0 HG SER A 113 -1.850 -14.208 -17.947 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.726 -16.980 -13.953 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.369 -17.516 -12.611 1.00 0.00 C ATOM 1811 C HIS A 114 -1.856 -16.376 -11.729 1.00 0.00 C ATOM 1812 O HIS A 114 -0.703 -15.998 -11.788 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.275 -18.571 -12.765 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.232 -18.368 -11.698 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -0.428 -18.774 -10.387 1.00 0.00 N ATOM 1816 CD2 HIS A 114 1.013 -17.789 -11.731 1.00 0.00 C ATOM 1817 CE1 HIS A 114 0.672 -18.436 -9.689 1.00 0.00 C ATOM 1818 NE2 HIS A 114 1.577 -17.833 -10.461 1.00 0.00 N ATOM 0 H HIS A 114 -2.485 -17.580 -14.741 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.248 -17.965 -12.150 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.704 -19.570 -12.685 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -0.820 -18.498 -13.753 1.00 0.00 H new ATOM 0 HD2 HIS A 114 1.481 -17.365 -12.607 1.00 0.00 H new ATOM 0 HE1 HIS A 114 0.805 -18.629 -8.635 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.491 -17.479 -10.179 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.703 -15.811 -10.916 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.253 -14.692 -10.043 1.00 0.00 C ATOM 1829 C GLU A 115 -3.459 -14.061 -9.354 1.00 0.00 C ATOM 1830 O GLU A 115 -3.550 -14.029 -8.143 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.546 -13.634 -10.898 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.095 -13.503 -10.440 1.00 0.00 C ATOM 1833 CD GLU A 115 0.671 -12.604 -11.413 1.00 0.00 C ATOM 1834 OE1 GLU A 115 0.090 -12.225 -12.415 1.00 0.00 O ATOM 1835 OE2 GLU A 115 1.823 -12.311 -11.138 1.00 0.00 O ATOM 0 H GLU A 115 -3.684 -16.074 -10.818 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.565 -15.075 -9.289 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.583 -13.916 -11.950 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.056 -12.675 -10.806 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.057 -13.084 -9.435 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.372 -14.487 -10.393 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.383 -13.551 -10.116 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.582 -12.910 -9.509 1.00 0.00 C ATOM 1845 C HIS A 116 -6.846 -13.642 -9.958 1.00 0.00 C ATOM 1846 O HIS A 116 -6.950 -14.093 -11.082 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.666 -11.454 -9.968 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.510 -10.674 -9.405 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.224 -10.780 -9.919 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.428 -9.763 -8.380 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.433 -9.956 -9.208 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.118 -9.313 -8.261 1.00 0.00 N ATOM 0 H HIS A 116 -4.360 -13.550 -11.136 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.499 -12.956 -8.423 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.653 -11.405 -11.057 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.608 -11.014 -9.640 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.254 -9.445 -7.762 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.375 -9.831 -9.382 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.757 -8.634 -7.591 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.816 -13.752 -9.094 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.080 -14.438 -9.478 1.00 0.00 C ATOM 1863 C GLN A 117 -10.241 -13.466 -9.278 1.00 0.00 C ATOM 1864 O GLN A 117 -11.396 -13.845 -9.276 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.286 -15.671 -8.599 1.00 0.00 C ATOM 1866 CG GLN A 117 -8.081 -16.608 -8.742 1.00 0.00 C ATOM 1867 CD GLN A 117 -8.321 -17.880 -7.927 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.447 -18.214 -7.619 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -7.301 -18.604 -7.560 1.00 0.00 N ATOM 0 H GLN A 117 -7.788 -13.396 -8.138 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.030 -14.752 -10.521 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -9.406 -15.372 -7.558 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.200 -16.189 -8.890 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -7.926 -16.860 -9.791 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -7.176 -16.108 -8.397 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -6.356 -18.322 -7.820 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -7.448 -19.452 -7.013 1.00 0.00 H new ATOM 1878 N ALA A 118 -9.940 -12.209 -9.093 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.024 -11.215 -8.874 1.00 0.00 C ATOM 1880 C ALA A 118 -10.646 -9.875 -9.501 1.00 0.00 C ATOM 1881 O ALA A 118 -9.546 -9.394 -9.339 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.212 -11.007 -7.376 1.00 0.00 C ATOM 0 H ALA A 118 -8.993 -11.830 -9.084 1.00 0.00 H new ATOM 0 HA ALA A 118 -11.941 -11.586 -9.331 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.005 -10.279 -7.206 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.482 -11.954 -6.908 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.283 -10.639 -6.940 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.566 -9.261 -10.188 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.284 -7.935 -10.795 1.00 0.00 C ATOM 1890 C TYR A 119 -12.605 -7.176 -10.934 1.00 0.00 C ATOM 1891 O TYR A 119 -13.611 -7.740 -11.319 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.617 -8.129 -12.152 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.633 -8.550 -13.172 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.081 -9.871 -13.206 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.117 -7.619 -14.090 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -13.018 -10.264 -14.167 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.051 -8.007 -15.053 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.503 -9.331 -15.093 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.418 -9.717 -16.048 1.00 0.00 O ATOM 0 H TYR A 119 -12.505 -9.623 -10.355 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.606 -7.359 -10.165 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.138 -7.202 -12.466 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.833 -8.883 -12.076 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.705 -10.588 -12.492 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.769 -6.597 -14.056 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.367 -11.286 -14.195 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.424 -7.286 -15.766 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.650 -8.947 -16.609 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.623 -5.909 -10.609 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.905 -5.144 -10.706 1.00 0.00 C ATOM 1911 C ARG A 120 -13.656 -3.726 -11.212 1.00 0.00 C ATOM 1912 O ARG A 120 -12.608 -3.154 -11.002 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.529 -5.010 -9.321 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.619 -6.370 -8.637 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.102 -6.175 -7.195 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.590 -6.217 -7.159 1.00 0.00 N ATOM 1917 CZ ARG A 120 -17.207 -6.588 -6.070 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.524 -6.908 -5.004 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.511 -6.634 -6.048 1.00 0.00 N ATOM 0 H ARG A 120 -11.817 -5.375 -10.284 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.558 -5.684 -11.391 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.933 -4.330 -8.712 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.524 -4.573 -9.406 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.307 -7.019 -9.179 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.645 -6.860 -8.644 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.690 -6.954 -6.554 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.745 -5.221 -6.807 1.00 0.00 H new ATOM 0 HE ARG A 120 -17.127 -5.956 -7.986 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.505 -6.869 -5.020 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -17.010 -7.197 -4.155 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -19.044 -6.381 -6.880 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -18.997 -6.923 -5.199 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.642 -3.140 -11.823 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.510 -1.736 -12.294 1.00 0.00 C ATOM 1935 C TRP A 121 -15.315 -0.856 -11.326 1.00 0.00 C ATOM 1936 O TRP A 121 -16.530 -0.886 -11.322 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.083 -1.622 -13.709 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.116 -2.192 -14.700 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.135 -3.459 -15.180 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.995 -1.528 -15.348 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.091 -3.613 -16.077 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.361 -2.449 -16.216 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.471 -0.229 -15.264 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.246 -2.085 -16.975 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.354 0.136 -16.025 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.744 -0.789 -16.878 1.00 0.00 C ATOM 0 H TRP A 121 -15.543 -3.577 -12.019 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.466 -1.422 -12.318 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.033 -2.152 -13.769 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.285 -0.577 -13.945 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.848 -4.224 -14.908 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.886 -4.480 -16.574 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.933 0.494 -14.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.777 -2.803 -17.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.961 1.139 -15.953 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.883 -0.499 -17.462 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.658 -0.106 -10.471 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.418 0.717 -9.481 1.00 0.00 C ATOM 1959 C LEU A 122 -14.975 2.183 -9.504 1.00 0.00 C ATOM 1960 O LEU A 122 -14.031 2.555 -10.167 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.181 0.179 -8.069 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.672 -1.264 -8.104 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.309 -1.324 -7.420 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.653 -2.183 -7.364 1.00 0.00 C ATOM 0 H LEU A 122 -13.642 -0.030 -10.417 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.472 0.656 -9.753 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.457 0.810 -7.553 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -16.109 0.226 -7.499 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.586 -1.595 -9.139 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.937 -2.348 -7.439 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.609 -0.674 -7.945 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.406 -0.993 -6.386 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.284 -3.208 -7.393 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.743 -1.859 -6.327 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.630 -2.135 -7.845 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.661 3.015 -8.757 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.303 4.464 -8.704 1.00 0.00 C ATOM 1978 C GLY A 123 -14.160 4.678 -7.706 1.00 0.00 C ATOM 1979 O GLY A 123 -13.713 3.758 -7.047 1.00 0.00 O ATOM 0 H GLY A 123 -16.458 2.749 -8.179 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -15.005 4.811 -9.693 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.172 5.052 -8.408 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.685 5.892 -7.599 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.567 6.193 -6.654 1.00 0.00 C ATOM 1985 C LEU A 124 -12.917 5.732 -5.240 1.00 0.00 C ATOM 1986 O LEU A 124 -12.145 5.060 -4.585 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.316 7.706 -6.641 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.396 8.085 -5.475 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.148 7.196 -5.458 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.961 9.543 -5.636 1.00 0.00 C ATOM 0 H LEU A 124 -14.026 6.694 -8.129 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.674 5.663 -6.985 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.864 8.014 -7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.264 8.238 -6.553 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.941 7.948 -4.541 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.509 7.482 -4.623 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.446 6.153 -5.347 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.601 7.319 -6.392 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.306 9.821 -4.810 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.427 9.661 -6.579 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.840 10.187 -5.634 1.00 0.00 H new ATOM 2002 N GLU A 125 -14.065 6.094 -4.756 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.443 5.688 -3.377 1.00 0.00 C ATOM 2004 C GLU A 125 -14.421 4.160 -3.245 1.00 0.00 C ATOM 2005 O GLU A 125 -13.766 3.620 -2.377 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.835 6.234 -3.056 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.906 5.408 -3.771 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.251 6.129 -3.667 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -19.188 5.695 -4.316 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.319 7.105 -2.938 1.00 0.00 O ATOM 0 H GLU A 125 -14.759 6.653 -5.253 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.724 6.098 -2.668 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -16.004 6.208 -1.980 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.904 7.277 -3.364 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.635 5.267 -4.817 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.976 4.416 -3.324 1.00 0.00 H new ATOM 2018 N GLU A 126 -15.109 3.450 -4.097 1.00 0.00 N ATOM 2019 CA GLU A 126 -15.087 1.962 -3.985 1.00 0.00 C ATOM 2020 C GLU A 126 -13.657 1.467 -4.172 1.00 0.00 C ATOM 2021 O GLU A 126 -13.223 0.520 -3.552 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.973 1.346 -5.056 1.00 0.00 C ATOM 2023 CG GLU A 126 -16.008 -0.164 -4.856 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.270 -0.743 -5.495 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.537 -1.913 -5.271 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.947 -0.011 -6.195 1.00 0.00 O ATOM 0 H GLU A 126 -15.678 3.827 -4.855 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.458 1.671 -3.002 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.980 1.758 -4.995 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.589 1.587 -6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -15.123 -0.619 -5.300 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.987 -0.399 -3.792 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.918 2.110 -5.022 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.512 1.691 -5.241 1.00 0.00 C ATOM 2036 C ALA A 127 -10.707 2.013 -3.981 1.00 0.00 C ATOM 2037 O ALA A 127 -9.729 1.365 -3.667 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.941 2.465 -6.427 1.00 0.00 C ATOM 0 H ALA A 127 -13.226 2.909 -5.576 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.461 0.622 -5.449 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.907 2.163 -6.595 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.531 2.252 -7.319 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.977 3.534 -6.215 1.00 0.00 H new ATOM 2044 N CYS A 128 -11.117 3.022 -3.263 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.390 3.414 -2.022 1.00 0.00 C ATOM 2046 C CYS A 128 -10.560 2.344 -0.939 1.00 0.00 C ATOM 2047 O CYS A 128 -9.626 2.019 -0.233 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.955 4.738 -1.511 1.00 0.00 C ATOM 2049 SG CYS A 128 -11.287 4.600 0.261 1.00 0.00 S ATOM 0 H CYS A 128 -11.931 3.596 -3.484 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.329 3.518 -2.251 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.247 5.545 -1.698 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.871 4.987 -2.046 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.427 4.003 0.444 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.739 1.799 -0.788 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.935 0.758 0.267 1.00 0.00 C ATOM 2057 C GLN A 129 -11.133 -0.484 -0.096 1.00 0.00 C ATOM 2058 O GLN A 129 -10.455 -1.067 0.724 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.413 0.363 0.385 1.00 0.00 C ATOM 2060 CG GLN A 129 -14.190 0.821 -0.849 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.802 2.197 -0.586 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -14.133 3.088 -0.105 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -16.055 2.410 -0.884 1.00 0.00 N ATOM 0 H GLN A 129 -12.566 2.025 -1.341 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.600 1.172 1.218 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.499 -0.718 0.495 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.845 0.810 1.280 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.527 0.865 -1.713 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.974 0.102 -1.085 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.617 1.661 -1.288 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.472 3.325 -0.713 1.00 0.00 H new ATOM 2072 N LEU A 130 -11.222 -0.903 -1.321 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.484 -2.119 -1.742 1.00 0.00 C ATOM 2074 C LEU A 130 -8.980 -1.886 -1.604 1.00 0.00 C ATOM 2075 O LEU A 130 -8.262 -2.713 -1.081 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.827 -2.413 -3.193 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.346 -2.485 -3.354 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.674 -2.670 -4.825 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.917 -3.670 -2.567 1.00 0.00 C ATOM 0 H LEU A 130 -11.775 -0.455 -2.052 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.767 -2.963 -1.113 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.419 -1.636 -3.839 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.373 -3.355 -3.501 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.786 -1.563 -2.973 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.755 -2.723 -4.953 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.282 -1.827 -5.394 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.220 -3.593 -5.186 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.999 -3.704 -2.694 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.479 -4.597 -2.937 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.680 -3.553 -1.510 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.493 -0.765 -2.057 1.00 0.00 N ATOM 2092 CA ALA A 131 -7.035 -0.505 -1.932 1.00 0.00 C ATOM 2093 C ALA A 131 -6.655 -0.488 -0.453 1.00 0.00 C ATOM 2094 O ALA A 131 -5.846 -1.269 -0.001 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.702 0.845 -2.560 1.00 0.00 C ATOM 0 H ALA A 131 -9.036 -0.026 -2.504 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.477 -1.288 -2.445 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.633 1.035 -2.468 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.979 0.834 -3.614 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.256 1.631 -2.047 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.251 0.382 0.309 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.937 0.436 1.764 1.00 0.00 C ATOM 2103 C GLN A 132 -5.498 0.922 1.978 1.00 0.00 C ATOM 2104 O GLN A 132 -5.061 1.111 3.095 1.00 0.00 O ATOM 2105 CB GLN A 132 -7.114 -0.968 2.365 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.764 -1.518 2.842 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.925 -2.988 3.233 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -5.928 -3.857 2.383 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -6.064 -3.309 4.491 1.00 0.00 N ATOM 0 H GLN A 132 -7.943 1.059 -0.011 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.613 1.135 2.257 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.813 -0.928 3.200 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.545 -1.638 1.621 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -5.019 -1.420 2.052 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.404 -0.941 3.694 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -6.062 -2.582 5.206 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -6.175 -4.287 4.759 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.756 1.130 0.923 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.352 1.602 1.093 1.00 0.00 C ATOM 2120 C PHE A 133 -3.291 3.115 0.851 1.00 0.00 C ATOM 2121 O PHE A 133 -3.899 3.630 -0.068 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.440 0.894 0.091 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.831 -0.561 -0.028 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.389 -1.484 0.927 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.634 -0.989 -1.095 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.749 -2.833 0.815 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.992 -2.339 -1.204 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.550 -3.259 -0.250 1.00 0.00 C ATOM 0 H PHE A 133 -5.059 0.995 -0.042 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.019 1.376 2.106 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.511 1.379 -0.883 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.402 0.975 0.412 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.771 -1.156 1.750 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.976 -0.278 -1.832 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.408 -3.545 1.552 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.610 -2.669 -2.026 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.827 -4.299 -0.335 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.572 3.832 1.674 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.482 5.310 1.495 1.00 0.00 C ATOM 2140 C LYS A 134 -1.909 5.635 0.116 1.00 0.00 C ATOM 2141 O LYS A 134 -2.374 6.527 -0.566 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.569 5.899 2.575 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.632 7.427 2.522 1.00 0.00 C ATOM 2144 CD LYS A 134 -0.678 8.020 3.562 1.00 0.00 C ATOM 2145 CE LYS A 134 -0.894 9.534 3.652 1.00 0.00 C ATOM 2146 NZ LYS A 134 0.052 10.115 4.647 1.00 0.00 N ATOM 0 H LYS A 134 -2.044 3.458 2.462 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.479 5.741 1.580 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.878 5.546 3.559 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.544 5.562 2.423 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.362 7.777 1.526 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.650 7.765 2.714 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -0.852 7.559 4.534 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.355 7.805 3.287 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -0.738 9.993 2.676 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -1.922 9.748 3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -0.096 11.143 4.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -0.117 9.686 5.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 1.030 9.922 4.350 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.898 4.925 -0.303 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.302 5.210 -1.635 1.00 0.00 C ATOM 2162 C GLU A 135 -1.304 4.845 -2.728 1.00 0.00 C ATOM 2163 O GLU A 135 -1.539 5.611 -3.639 1.00 0.00 O ATOM 2164 CB GLU A 135 0.968 4.384 -1.811 1.00 0.00 C ATOM 2165 CG GLU A 135 1.951 4.720 -0.691 1.00 0.00 C ATOM 2166 CD GLU A 135 3.248 3.942 -0.908 1.00 0.00 C ATOM 2167 OE1 GLU A 135 3.253 3.069 -1.759 1.00 0.00 O ATOM 2168 OE2 GLU A 135 4.214 4.229 -0.221 1.00 0.00 O ATOM 0 H GLU A 135 -0.462 4.164 0.217 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.057 6.270 -1.706 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.729 3.321 -1.793 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.419 4.593 -2.781 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.154 5.791 -0.678 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.518 4.466 0.277 1.00 0.00 H new ATOM 2176 N MET A 136 -1.914 3.694 -2.638 1.00 0.00 N ATOM 2177 CA MET A 136 -2.914 3.308 -3.672 1.00 0.00 C ATOM 2178 C MET A 136 -4.041 4.320 -3.662 1.00 0.00 C ATOM 2179 O MET A 136 -4.453 4.832 -4.683 1.00 0.00 O ATOM 2180 CB MET A 136 -3.522 1.955 -3.331 1.00 0.00 C ATOM 2181 CG MET A 136 -2.550 0.832 -3.674 1.00 0.00 C ATOM 2182 SD MET A 136 -3.369 -0.343 -4.775 1.00 0.00 S ATOM 2183 CE MET A 136 -4.028 0.853 -5.973 1.00 0.00 C ATOM 0 H MET A 136 -1.764 3.009 -1.898 1.00 0.00 H new ATOM 0 HA MET A 136 -2.419 3.268 -4.642 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.770 1.918 -2.270 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.453 1.819 -3.881 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.660 1.239 -4.153 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.221 0.329 -2.765 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.108 0.381 -6.952 1.00 0.00 H new ATOM 0 HE2 MET A 136 -5.014 1.187 -5.649 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.358 1.710 -6.038 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.544 4.610 -2.503 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.646 5.584 -2.413 1.00 0.00 C ATOM 2195 C LYS A 137 -5.182 6.888 -3.048 1.00 0.00 C ATOM 2196 O LYS A 137 -5.839 7.444 -3.904 1.00 0.00 O ATOM 2197 CB LYS A 137 -5.987 5.810 -0.940 1.00 0.00 C ATOM 2198 CG LYS A 137 -7.209 6.715 -0.828 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.528 6.954 0.648 1.00 0.00 C ATOM 2200 CE LYS A 137 -8.872 7.664 0.758 1.00 0.00 C ATOM 2201 NZ LYS A 137 -9.103 8.071 2.173 1.00 0.00 N ATOM 0 H LYS A 137 -4.237 4.213 -1.615 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.532 5.218 -2.931 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -6.184 4.855 -0.452 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -5.139 6.262 -0.426 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.020 7.664 -1.329 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -8.063 6.256 -1.327 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -7.558 6.006 1.185 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -6.745 7.556 1.109 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -8.887 8.540 0.109 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -9.672 7.005 0.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -10.020 8.556 2.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -9.106 7.227 2.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -8.345 8.715 2.477 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.035 7.368 -2.649 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.507 8.627 -3.237 1.00 0.00 C ATOM 2217 C ALA A 138 -3.119 8.380 -4.693 1.00 0.00 C ATOM 2218 O ALA A 138 -3.427 9.169 -5.564 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.285 9.094 -2.450 1.00 0.00 C ATOM 0 H ALA A 138 -3.441 6.939 -1.939 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.275 9.399 -3.190 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.903 10.017 -2.886 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.567 9.272 -1.412 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.512 8.327 -2.489 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.462 7.284 -4.979 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.091 7.017 -6.396 1.00 0.00 C ATOM 2227 C ALA A 139 -3.371 7.018 -7.221 1.00 0.00 C ATOM 2228 O ALA A 139 -3.435 7.584 -8.292 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.408 5.657 -6.521 1.00 0.00 C ATOM 0 H ALA A 139 -2.172 6.576 -4.304 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.399 7.782 -6.749 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.143 5.477 -7.563 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.505 5.646 -5.910 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.087 4.876 -6.179 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.404 6.404 -6.708 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.700 6.389 -7.434 1.00 0.00 C ATOM 2237 C LEU A 140 -6.296 7.797 -7.393 1.00 0.00 C ATOM 2238 O LEU A 140 -6.790 8.307 -8.382 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.659 5.416 -6.739 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.437 3.996 -7.258 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.825 2.995 -6.168 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.324 3.761 -8.481 1.00 0.00 C ATOM 0 H LEU A 140 -4.402 5.912 -5.815 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.548 6.074 -8.466 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.501 5.446 -5.661 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.690 5.720 -6.919 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.389 3.866 -7.528 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.668 1.980 -6.534 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.208 3.162 -5.285 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.875 3.129 -5.908 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.168 2.749 -8.854 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.370 3.888 -8.202 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.067 4.479 -9.260 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.250 8.431 -6.247 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.814 9.808 -6.130 1.00 0.00 C ATOM 2256 C GLN A 141 -5.980 10.776 -6.967 1.00 0.00 C ATOM 2257 O GLN A 141 -6.507 11.568 -7.723 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.812 10.241 -4.656 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.195 11.635 -4.513 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.304 12.093 -3.058 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -5.818 13.148 -2.703 1.00 0.00 O ATOM 2262 NE2 GLN A 141 -6.928 11.338 -2.195 1.00 0.00 N ATOM 0 H GLN A 141 -5.846 8.054 -5.390 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.840 9.816 -6.499 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.831 10.246 -4.270 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.248 9.523 -4.060 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.150 11.615 -4.822 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.708 12.340 -5.167 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -7.336 10.452 -2.494 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -7.008 11.634 -1.222 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.684 10.716 -6.854 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.837 11.626 -7.664 1.00 0.00 C ATOM 2273 C GLU A 142 -4.064 11.302 -9.138 1.00 0.00 C ATOM 2274 O GLU A 142 -4.048 12.168 -9.990 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.365 11.421 -7.299 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.121 11.884 -5.857 1.00 0.00 C ATOM 2277 CD GLU A 142 -2.397 13.385 -5.750 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -2.598 13.856 -4.644 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -2.400 14.040 -6.781 1.00 0.00 O ATOM 0 H GLU A 142 -4.178 10.079 -6.238 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.099 12.666 -7.467 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.097 10.370 -7.404 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.729 11.982 -7.984 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.768 11.335 -5.173 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.093 11.671 -5.564 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.296 10.052 -9.439 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.550 9.660 -10.852 1.00 0.00 C ATOM 2289 C GLY A 143 -5.831 10.344 -11.329 1.00 0.00 C ATOM 2290 O GLY A 143 -5.904 10.859 -12.427 1.00 0.00 O ATOM 0 H GLY A 143 -4.320 9.286 -8.765 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.709 9.951 -11.482 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.648 8.577 -10.932 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.841 10.363 -10.502 1.00 0.00 N ATOM 2295 CA HIS A 144 -8.118 11.024 -10.890 1.00 0.00 C ATOM 2296 C HIS A 144 -7.879 12.530 -11.039 1.00 0.00 C ATOM 2297 O HIS A 144 -8.463 13.185 -11.880 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.165 10.784 -9.798 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.168 9.763 -10.266 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.654 8.769 -9.428 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.790 9.573 -11.476 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.527 8.032 -10.138 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.645 8.480 -11.389 1.00 0.00 N ATOM 0 H HIS A 144 -6.836 9.947 -9.571 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.474 10.612 -11.834 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.679 10.438 -8.886 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.671 11.719 -9.555 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.396 8.624 -8.452 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.638 10.178 -12.358 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -12.066 7.183 -9.744 1.00 0.00 H new ATOM 2312 N GLN A 145 -7.028 13.083 -10.221 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.747 14.544 -10.300 1.00 0.00 C ATOM 2314 C GLN A 145 -6.233 14.913 -11.690 1.00 0.00 C ATOM 2315 O GLN A 145 -6.706 15.843 -12.313 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.673 14.892 -9.271 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.305 16.369 -9.391 1.00 0.00 C ATOM 2318 CD GLN A 145 -4.402 16.770 -8.224 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -4.185 15.995 -7.313 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -3.862 17.957 -8.215 1.00 0.00 N ATOM 0 H GLN A 145 -6.512 12.583 -9.497 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.666 15.096 -10.102 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -6.036 14.678 -8.266 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.790 14.273 -9.429 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.796 16.551 -10.337 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -6.208 16.980 -9.392 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -4.045 18.606 -8.980 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -3.257 18.236 -7.443 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.261 14.198 -12.177 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.706 14.514 -13.521 1.00 0.00 C ATOM 2331 C PHE A 146 -5.795 14.403 -14.587 1.00 0.00 C ATOM 2332 O PHE A 146 -5.927 15.257 -15.440 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.585 13.529 -13.846 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.969 13.901 -15.172 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.603 13.528 -16.363 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.766 14.614 -15.212 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.031 13.870 -17.594 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.196 14.955 -16.444 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.830 14.583 -17.634 1.00 0.00 C ATOM 0 H PHE A 146 -4.826 13.407 -11.702 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.320 15.533 -13.513 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.829 13.548 -13.061 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.977 12.513 -13.886 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.532 12.977 -16.332 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.277 14.901 -14.293 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.519 13.582 -18.514 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.267 15.505 -16.476 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.391 14.847 -18.585 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.570 13.357 -14.560 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.627 13.209 -15.595 1.00 0.00 C ATOM 2351 C LEU A 147 -8.499 14.465 -15.599 1.00 0.00 C ATOM 2352 O LEU A 147 -8.889 14.954 -16.640 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.491 11.985 -15.291 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.610 10.732 -15.228 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.457 9.541 -14.776 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -7.027 10.434 -16.613 1.00 0.00 C ATOM 0 H LEU A 147 -6.518 12.605 -13.873 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.162 13.077 -16.572 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.012 12.122 -14.344 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.254 11.866 -16.060 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.797 10.901 -14.522 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.834 8.648 -14.730 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.873 9.744 -13.789 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.268 9.381 -15.486 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.402 9.542 -16.561 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.839 10.267 -17.321 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.425 11.280 -16.944 1.00 0.00 H new ATOM 2368 N CYS A 148 -8.794 15.012 -14.448 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.624 16.248 -14.417 1.00 0.00 C ATOM 2370 C CYS A 148 -9.028 17.246 -15.411 1.00 0.00 C ATOM 2371 O CYS A 148 -9.723 18.035 -16.019 1.00 0.00 O ATOM 2372 CB CYS A 148 -9.594 16.859 -13.015 1.00 0.00 C ATOM 2373 SG CYS A 148 -10.023 15.596 -11.790 1.00 0.00 S ATOM 0 H CYS A 148 -8.498 14.659 -13.538 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.655 16.011 -14.679 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -8.603 17.262 -12.805 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.296 17.691 -12.955 1.00 0.00 H new ATOM 0 HG CYS A 148 -9.051 14.738 -11.692 1.00 0.00 H new ATOM 2379 N SER A 149 -7.734 17.200 -15.573 1.00 0.00 N ATOM 2380 CA SER A 149 -7.043 18.119 -16.521 1.00 0.00 C ATOM 2381 C SER A 149 -7.045 17.490 -17.908 1.00 0.00 C ATOM 2382 O SER A 149 -6.341 17.920 -18.799 1.00 0.00 O ATOM 2383 CB SER A 149 -5.592 18.288 -16.075 1.00 0.00 C ATOM 2384 OG SER A 149 -5.564 18.796 -14.751 1.00 0.00 O ATOM 0 H SER A 149 -7.117 16.554 -15.081 1.00 0.00 H new ATOM 0 HA SER A 149 -7.552 19.083 -16.539 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.072 17.331 -16.121 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.069 18.967 -16.748 1.00 0.00 H new ATOM 0 HG SER A 149 -4.634 18.904 -14.462 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.793 16.443 -18.075 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.810 15.735 -19.376 1.00 0.00 C ATOM 2392 C ILE A 150 -9.193 15.868 -20.018 1.00 0.00 C ATOM 2393 O ILE A 150 -9.879 16.856 -19.846 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.453 14.271 -19.076 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.599 13.679 -20.195 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -8.709 13.411 -18.890 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.640 12.652 -19.587 1.00 0.00 C ATOM 0 H ILE A 150 -8.399 16.044 -17.358 1.00 0.00 H new ATOM 0 HA ILE A 150 -7.096 16.155 -20.084 1.00 0.00 H new ATOM 0 HB ILE A 150 -6.885 14.266 -18.145 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -7.233 13.207 -20.945 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.039 14.466 -20.701 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -8.418 12.382 -18.679 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -9.296 13.799 -18.058 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -9.308 13.439 -19.801 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.023 12.220 -20.375 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -5.001 13.141 -18.852 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -6.213 11.862 -19.101 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.609 14.889 -20.755 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.946 14.964 -21.397 1.00 0.00 C ATOM 2411 C GLU A 151 -12.018 14.766 -20.326 1.00 0.00 C ATOM 2412 O GLU A 151 -13.173 14.523 -20.601 1.00 0.00 O ATOM 2413 CB GLU A 151 -11.055 13.886 -22.476 1.00 0.00 C ATOM 2414 CG GLU A 151 -12.415 13.994 -23.149 1.00 0.00 C ATOM 2415 CD GLU A 151 -12.403 13.199 -24.454 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -13.405 13.218 -25.147 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -11.386 12.587 -24.742 1.00 0.00 O ATOM 0 H GLU A 151 -9.082 14.036 -20.944 1.00 0.00 H new ATOM 0 HA GLU A 151 -11.086 15.937 -21.867 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.260 14.008 -23.212 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -10.931 12.897 -22.034 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -13.192 13.613 -22.486 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -12.651 15.039 -23.350 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.625 14.880 -19.095 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.587 14.711 -17.969 1.00 0.00 C ATOM 2427 C ALA A 152 -13.660 15.801 -18.038 1.00 0.00 C ATOM 2428 O ALA A 152 -14.823 15.562 -17.776 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.827 14.840 -16.654 1.00 0.00 C ATOM 0 H ALA A 152 -10.667 15.086 -18.813 1.00 0.00 H new ATOM 0 HA ALA A 152 -13.063 13.733 -18.036 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.519 14.718 -15.820 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -11.057 14.070 -16.602 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.361 15.824 -16.598 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.279 17.001 -18.384 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.278 18.105 -18.463 1.00 0.00 C ATOM 2437 C LEU A 153 -14.777 18.245 -19.900 1.00 0.00 C ATOM 2438 O LEU A 153 -14.361 17.499 -20.783 1.00 0.00 O ATOM 2439 CB LEU A 153 -13.630 19.418 -18.014 1.00 0.00 C ATOM 2440 CG LEU A 153 -12.321 19.636 -18.778 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -12.113 21.135 -19.011 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -11.154 19.084 -17.955 1.00 0.00 C ATOM 0 H LEU A 153 -12.321 17.264 -18.615 1.00 0.00 H new ATOM 0 HA LEU A 153 -15.120 17.876 -17.810 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -14.310 20.250 -18.194 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -13.436 19.391 -16.942 1.00 0.00 H new ATOM 0 HG LEU A 153 -12.368 19.120 -19.737 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -11.182 21.293 -19.555 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -12.945 21.532 -19.593 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -12.064 21.649 -18.051 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -10.221 19.238 -18.497 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -11.107 19.602 -16.997 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -11.302 18.018 -17.784 1.00 0.00 H new