USER MOD reduce.3.24.130724 H: found=0, std=0, add=827, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 831 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 Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 158:sc= -0.029 (180deg=-0.239) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 MET CE :methyl -151:sc= -1.35 (180deg=-1.94) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 CYS SG : rot -52:sc= -0.706 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 62 N LEU A 4 -12.418 6.917 -1.515 1.00 30.31 N ATOM 63 CA LEU A 4 -12.657 7.990 -0.556 1.00 42.13 C ATOM 64 C LEU A 4 -11.761 7.835 0.669 1.00 53.33 C ATOM 65 O LEU A 4 -11.443 8.814 1.345 1.00 63.25 O ATOM 66 CB LEU A 4 -14.126 8.003 -0.130 1.00 62.51 C ATOM 67 CG LEU A 4 -14.570 6.857 0.780 1.00 12.23 C ATOM 68 CD1 LEU A 4 -14.645 7.323 2.226 1.00 14.01 C ATOM 69 CD2 LEU A 4 -15.913 6.305 0.326 1.00 72.24 C ATOM 0 HA LEU A 4 -12.418 8.937 -1.041 1.00 42.13 H new ATOM 0 HB2 LEU A 4 -14.327 8.945 0.380 1.00 62.51 H new ATOM 0 HB3 LEU A 4 -14.744 7.988 -1.028 1.00 62.51 H new ATOM 0 HG LEU A 4 -13.831 6.059 0.714 1.00 12.23 H new ATOM 0 HD11 LEU A 4 -14.963 6.495 2.859 1.00 14.01 H new ATOM 0 HD12 LEU A 4 -13.663 7.670 2.548 1.00 14.01 H new ATOM 0 HD13 LEU A 4 -15.363 8.139 2.309 1.00 14.01 H new ATOM 0 HD21 LEU A 4 -16.213 5.490 0.985 1.00 72.24 H new ATOM 0 HD22 LEU A 4 -16.662 7.096 0.362 1.00 72.24 H new ATOM 0 HD23 LEU A 4 -15.827 5.933 -0.695 1.00 72.24 H new ATOM 81 N ARG A 5 -11.357 6.600 0.948 1.00 51.44 N ATOM 82 CA ARG A 5 -10.497 6.318 2.091 1.00 73.35 C ATOM 83 C ARG A 5 -9.094 6.875 1.866 1.00 35.44 C ATOM 84 O ARG A 5 -8.584 7.642 2.682 1.00 61.23 O ATOM 85 CB ARG A 5 -10.425 4.810 2.341 1.00 12.30 C ATOM 86 CG ARG A 5 -11.596 4.270 3.145 1.00 34.30 C ATOM 87 CD ARG A 5 -12.596 3.546 2.256 1.00 3.30 C ATOM 88 NE ARG A 5 -13.328 2.514 2.984 1.00 74.42 N ATOM 89 CZ ARG A 5 -14.423 1.922 2.518 1.00 64.04 C ATOM 90 NH1 ARG A 5 -14.908 2.259 1.331 1.00 62.14 N ATOM 91 NH2 ARG A 5 -15.033 0.991 3.239 1.00 34.20 N ATOM 0 H ARG A 5 -11.611 5.779 0.398 1.00 51.44 H new ATOM 0 HA ARG A 5 -10.926 6.805 2.967 1.00 73.35 H new ATOM 0 HB2 ARG A 5 -10.384 4.293 1.382 1.00 12.30 H new ATOM 0 HB3 ARG A 5 -9.498 4.581 2.867 1.00 12.30 H new ATOM 0 HG2 ARG A 5 -11.229 3.588 3.912 1.00 34.30 H new ATOM 0 HG3 ARG A 5 -12.094 5.091 3.661 1.00 34.30 H new ATOM 0 HD2 ARG A 5 -13.301 4.267 1.842 1.00 3.30 H new ATOM 0 HD3 ARG A 5 -12.072 3.093 1.414 1.00 3.30 H new ATOM 0 HE ARG A 5 -12.980 2.232 3.900 1.00 74.42 H new ATOM 0 HH11 ARG A 5 -14.441 2.974 0.773 1.00 62.14 H new ATOM 0 HH12 ARG A 5 -15.748 1.803 0.975 1.00 62.14 H new ATOM 0 HH21 ARG A 5 -14.662 0.729 4.152 1.00 34.20 H new ATOM 0 HH22 ARG A 5 -15.873 0.537 2.880 1.00 34.20 H new ATOM 105 N GLU A 6 -8.478 6.482 0.756 1.00 23.22 N ATOM 106 CA GLU A 6 -7.134 6.941 0.427 1.00 44.25 C ATOM 107 C GLU A 6 -7.063 8.465 0.432 1.00 1.52 C ATOM 108 O GLU A 6 -6.083 9.049 0.894 1.00 51.41 O ATOM 109 CB GLU A 6 -6.709 6.405 -0.942 1.00 42.02 C ATOM 110 CG GLU A 6 -5.204 6.267 -1.101 1.00 70.14 C ATOM 111 CD GLU A 6 -4.820 5.254 -2.163 1.00 13.12 C ATOM 112 OE1 GLU A 6 -3.625 4.899 -2.238 1.00 73.23 O ATOM 113 OE2 GLU A 6 -5.714 4.817 -2.918 1.00 1.25 O ATOM 0 H GLU A 6 -8.888 5.848 0.070 1.00 23.22 H new ATOM 0 HA GLU A 6 -6.452 6.560 1.187 1.00 44.25 H new ATOM 0 HB2 GLU A 6 -7.174 5.432 -1.102 1.00 42.02 H new ATOM 0 HB3 GLU A 6 -7.088 7.071 -1.717 1.00 42.02 H new ATOM 0 HG2 GLU A 6 -4.779 7.237 -1.359 1.00 70.14 H new ATOM 0 HG3 GLU A 6 -4.767 5.971 -0.147 1.00 70.14 H new ATOM 120 N GLU A 7 -8.109 9.103 -0.085 1.00 22.40 N ATOM 121 CA GLU A 7 -8.164 10.559 -0.141 1.00 34.43 C ATOM 122 C GLU A 7 -8.371 11.149 1.251 1.00 33.12 C ATOM 123 O GLU A 7 -7.899 12.246 1.548 1.00 24.54 O ATOM 124 CB GLU A 7 -9.291 11.013 -1.072 1.00 25.12 C ATOM 125 CG GLU A 7 -8.796 11.604 -2.381 1.00 53.13 C ATOM 126 CD GLU A 7 -8.210 12.992 -2.210 1.00 51.14 C ATOM 127 OE1 GLU A 7 -8.136 13.732 -3.214 1.00 34.11 O ATOM 128 OE2 GLU A 7 -7.825 13.338 -1.074 1.00 51.32 O ATOM 0 H GLU A 7 -8.929 8.635 -0.471 1.00 22.40 H new ATOM 0 HA GLU A 7 -7.212 10.919 -0.532 1.00 34.43 H new ATOM 0 HB2 GLU A 7 -9.937 10.162 -1.288 1.00 25.12 H new ATOM 0 HB3 GLU A 7 -9.901 11.754 -0.556 1.00 25.12 H new ATOM 0 HG2 GLU A 7 -8.041 10.945 -2.810 1.00 53.13 H new ATOM 0 HG3 GLU A 7 -9.622 11.647 -3.091 1.00 53.13 H new ATOM 135 N ALA A 8 -9.081 10.413 2.100 1.00 55.00 N ATOM 136 CA ALA A 8 -9.350 10.862 3.460 1.00 32.14 C ATOM 137 C ALA A 8 -8.053 11.140 4.213 1.00 53.01 C ATOM 138 O ALA A 8 -7.895 12.195 4.826 1.00 4.12 O ATOM 139 CB ALA A 8 -10.182 9.827 4.203 1.00 20.21 C ATOM 0 H ALA A 8 -9.480 9.503 1.870 1.00 55.00 H new ATOM 0 HA ALA A 8 -9.914 11.793 3.404 1.00 32.14 H new ATOM 0 HB1 ALA A 8 -10.375 10.176 5.217 1.00 20.21 H new ATOM 0 HB2 ALA A 8 -11.129 9.680 3.683 1.00 20.21 H new ATOM 0 HB3 ALA A 8 -9.639 8.883 4.241 1.00 20.21 H new ATOM 145 N ALA A 9 -7.129 10.186 4.162 1.00 10.52 N ATOM 146 CA ALA A 9 -5.846 10.330 4.838 1.00 24.11 C ATOM 147 C ALA A 9 -5.091 11.553 4.329 1.00 44.11 C ATOM 148 O ALA A 9 -4.389 12.223 5.087 1.00 14.23 O ATOM 149 CB ALA A 9 -5.007 9.074 4.651 1.00 52.11 C ATOM 0 H ALA A 9 -7.245 9.306 3.660 1.00 10.52 H new ATOM 0 HA ALA A 9 -6.038 10.471 5.902 1.00 24.11 H new ATOM 0 HB1 ALA A 9 -4.051 9.195 5.161 1.00 52.11 H new ATOM 0 HB2 ALA A 9 -5.536 8.218 5.070 1.00 52.11 H new ATOM 0 HB3 ALA A 9 -4.832 8.908 3.588 1.00 52.11 H new ATOM 155 N LYS A 10 -5.238 11.839 3.040 1.00 63.13 N ATOM 156 CA LYS A 10 -4.570 12.982 2.428 1.00 75.01 C ATOM 157 C LYS A 10 -5.188 14.292 2.905 1.00 15.34 C ATOM 158 O LYS A 10 -4.492 15.294 3.072 1.00 10.45 O ATOM 159 CB LYS A 10 -4.655 12.892 0.903 1.00 72.24 C ATOM 160 CG LYS A 10 -3.309 13.020 0.210 1.00 35.21 C ATOM 161 CD LYS A 10 -3.089 11.899 -0.792 1.00 30.12 C ATOM 162 CE LYS A 10 -2.230 12.357 -1.961 1.00 34.03 C ATOM 163 NZ LYS A 10 -2.266 11.386 -3.089 1.00 61.11 N ATOM 0 H LYS A 10 -5.814 11.295 2.398 1.00 63.13 H new ATOM 0 HA LYS A 10 -3.523 12.963 2.729 1.00 75.01 H new ATOM 0 HB2 LYS A 10 -5.106 11.939 0.628 1.00 72.24 H new ATOM 0 HB3 LYS A 10 -5.318 13.676 0.538 1.00 72.24 H new ATOM 0 HG2 LYS A 10 -3.251 13.982 -0.300 1.00 35.21 H new ATOM 0 HG3 LYS A 10 -2.513 13.006 0.954 1.00 35.21 H new ATOM 0 HD2 LYS A 10 -2.610 11.055 -0.296 1.00 30.12 H new ATOM 0 HD3 LYS A 10 -4.052 11.547 -1.163 1.00 30.12 H new ATOM 0 HE2 LYS A 10 -2.578 13.330 -2.308 1.00 34.03 H new ATOM 0 HE3 LYS A 10 -1.201 12.487 -1.626 1.00 34.03 H new ATOM 0 HZ1 LYS A 10 -1.668 11.734 -3.866 1.00 61.11 H new ATOM 0 HZ2 LYS A 10 -1.910 10.464 -2.765 1.00 61.11 H new ATOM 0 HZ3 LYS A 10 -3.244 11.281 -3.425 1.00 61.11 H new ATOM 177 N LEU A 11 -6.499 14.278 3.125 1.00 64.33 N ATOM 178 CA LEU A 11 -7.210 15.465 3.585 1.00 75.01 C ATOM 179 C LEU A 11 -6.631 15.971 4.902 1.00 44.33 C ATOM 180 O LEU A 11 -6.647 17.171 5.179 1.00 61.20 O ATOM 181 CB LEU A 11 -8.699 15.157 3.755 1.00 52.21 C ATOM 182 CG LEU A 11 -9.654 15.943 2.855 1.00 20.32 C ATOM 183 CD1 LEU A 11 -11.079 15.436 3.018 1.00 63.05 C ATOM 184 CD2 LEU A 11 -9.577 17.430 3.166 1.00 45.55 C ATOM 0 H LEU A 11 -7.090 13.458 2.992 1.00 64.33 H new ATOM 0 HA LEU A 11 -7.089 16.245 2.833 1.00 75.01 H new ATOM 0 HB2 LEU A 11 -8.853 14.093 3.573 1.00 52.21 H new ATOM 0 HB3 LEU A 11 -8.972 15.345 4.793 1.00 52.21 H new ATOM 0 HG LEU A 11 -9.352 15.793 1.818 1.00 20.32 H new ATOM 0 HD11 LEU A 11 -11.745 16.007 2.370 1.00 63.05 H new ATOM 0 HD12 LEU A 11 -11.123 14.382 2.745 1.00 63.05 H new ATOM 0 HD13 LEU A 11 -11.391 15.556 4.055 1.00 63.05 H new ATOM 0 HD21 LEU A 11 -10.263 17.974 2.516 1.00 45.55 H new ATOM 0 HD22 LEU A 11 -9.853 17.599 4.207 1.00 45.55 H new ATOM 0 HD23 LEU A 11 -8.560 17.785 2.998 1.00 45.55 H new ATOM 196 N PHE A 12 -6.117 15.049 5.709 1.00 4.53 N ATOM 197 CA PHE A 12 -5.530 15.402 6.997 1.00 40.42 C ATOM 198 C PHE A 12 -4.354 16.358 6.815 1.00 33.12 C ATOM 199 O PHE A 12 -4.043 17.151 7.703 1.00 33.22 O ATOM 200 CB PHE A 12 -5.069 14.143 7.734 1.00 71.05 C ATOM 201 CG PHE A 12 -6.170 13.451 8.485 1.00 14.41 C ATOM 202 CD1 PHE A 12 -7.345 13.092 7.844 1.00 11.43 C ATOM 203 CD2 PHE A 12 -6.031 13.161 9.833 1.00 61.33 C ATOM 204 CE1 PHE A 12 -8.360 12.455 8.533 1.00 54.41 C ATOM 205 CE2 PHE A 12 -7.042 12.524 10.526 1.00 34.43 C ATOM 206 CZ PHE A 12 -8.209 12.172 9.876 1.00 71.30 C ATOM 0 H PHE A 12 -6.095 14.052 5.494 1.00 4.53 H new ATOM 0 HA PHE A 12 -6.294 15.903 7.591 1.00 40.42 H new ATOM 0 HB2 PHE A 12 -4.638 13.447 7.014 1.00 71.05 H new ATOM 0 HB3 PHE A 12 -4.276 14.410 8.432 1.00 71.05 H new ATOM 0 HD1 PHE A 12 -7.469 13.312 6.794 1.00 11.43 H new ATOM 0 HD2 PHE A 12 -5.122 13.436 10.347 1.00 61.33 H new ATOM 0 HE1 PHE A 12 -9.270 12.179 8.021 1.00 54.41 H new ATOM 0 HE2 PHE A 12 -6.920 12.301 11.576 1.00 34.43 H new ATOM 0 HZ PHE A 12 -9.002 11.677 10.417 1.00 71.30 H new ATOM 216 N GLU A 13 -3.705 16.275 5.658 1.00 30.31 N ATOM 217 CA GLU A 13 -2.563 17.131 5.361 1.00 62.14 C ATOM 218 C GLU A 13 -3.017 18.554 5.046 1.00 25.42 C ATOM 219 O GLU A 13 -2.311 19.519 5.337 1.00 70.13 O ATOM 220 CB GLU A 13 -1.767 16.566 4.183 1.00 64.35 C ATOM 221 CG GLU A 13 -0.275 16.460 4.451 1.00 21.51 C ATOM 222 CD GLU A 13 0.316 15.155 3.953 1.00 22.11 C ATOM 223 OE1 GLU A 13 0.019 14.771 2.802 1.00 5.12 O ATOM 224 OE2 GLU A 13 1.075 14.518 4.713 1.00 34.04 O ATOM 0 H GLU A 13 -3.950 15.624 4.912 1.00 30.31 H new ATOM 0 HA GLU A 13 -1.923 17.159 6.243 1.00 62.14 H new ATOM 0 HB2 GLU A 13 -2.154 15.578 3.935 1.00 64.35 H new ATOM 0 HB3 GLU A 13 -1.927 17.199 3.310 1.00 64.35 H new ATOM 0 HG2 GLU A 13 0.237 17.293 3.970 1.00 21.51 H new ATOM 0 HG3 GLU A 13 -0.095 16.551 5.522 1.00 21.51 H new ATOM 231 N GLU A 14 -4.199 18.673 4.450 1.00 3.31 N ATOM 232 CA GLU A 14 -4.746 19.978 4.095 1.00 63.51 C ATOM 233 C GLU A 14 -4.799 20.895 5.313 1.00 53.20 C ATOM 234 O GLU A 14 -4.553 22.097 5.209 1.00 21.21 O ATOM 235 CB GLU A 14 -6.146 19.823 3.498 1.00 61.55 C ATOM 236 CG GLU A 14 -6.339 20.581 2.195 1.00 14.13 C ATOM 237 CD GLU A 14 -5.571 19.966 1.042 1.00 24.01 C ATOM 238 OE1 GLU A 14 -6.114 19.050 0.389 1.00 42.40 O ATOM 239 OE2 GLU A 14 -4.426 20.399 0.793 1.00 54.42 O ATOM 0 H GLU A 14 -4.796 17.883 4.203 1.00 3.31 H new ATOM 0 HA GLU A 14 -4.089 20.429 3.351 1.00 63.51 H new ATOM 0 HB2 GLU A 14 -6.343 18.765 3.326 1.00 61.55 H new ATOM 0 HB3 GLU A 14 -6.882 20.171 4.223 1.00 61.55 H new ATOM 0 HG2 GLU A 14 -7.400 20.606 1.947 1.00 14.13 H new ATOM 0 HG3 GLU A 14 -6.019 21.614 2.330 1.00 14.13 H new ATOM 246 N TRP A 15 -5.123 20.320 6.465 1.00 11.03 N ATOM 247 CA TRP A 15 -5.210 21.086 7.704 1.00 61.23 C ATOM 248 C TRP A 15 -3.845 21.639 8.098 1.00 11.41 C ATOM 249 O TRP A 15 -3.698 22.836 8.348 1.00 43.04 O ATOM 250 CB TRP A 15 -5.764 20.212 8.830 1.00 74.10 C ATOM 251 CG TRP A 15 -6.975 19.425 8.430 1.00 73.33 C ATOM 252 CD1 TRP A 15 -7.931 19.794 7.526 1.00 22.52 C ATOM 253 CD2 TRP A 15 -7.361 18.136 8.921 1.00 1.40 C ATOM 254 NE1 TRP A 15 -8.887 18.812 7.426 1.00 32.14 N ATOM 255 CE2 TRP A 15 -8.560 17.784 8.271 1.00 11.51 C ATOM 256 CE3 TRP A 15 -6.809 17.245 9.845 1.00 41.01 C ATOM 257 CZ2 TRP A 15 -9.215 16.581 8.518 1.00 23.32 C ATOM 258 CZ3 TRP A 15 -7.460 16.051 10.089 1.00 30.12 C ATOM 259 CH2 TRP A 15 -8.652 15.727 9.428 1.00 60.04 C ATOM 0 H TRP A 15 -5.330 19.327 6.568 1.00 11.03 H new ATOM 0 HA TRP A 15 -5.887 21.924 7.538 1.00 61.23 H new ATOM 0 HB2 TRP A 15 -4.986 19.525 9.163 1.00 74.10 H new ATOM 0 HB3 TRP A 15 -6.016 20.845 9.681 1.00 74.10 H new ATOM 0 HD1 TRP A 15 -7.935 20.721 6.972 1.00 22.52 H new ATOM 0 HE1 TRP A 15 -9.707 18.843 6.821 1.00 32.14 H new ATOM 0 HE3 TRP A 15 -5.890 17.485 10.359 1.00 41.01 H new ATOM 0 HZ2 TRP A 15 -10.134 16.330 8.010 1.00 23.32 H new ATOM 0 HZ3 TRP A 15 -7.043 15.355 10.802 1.00 30.12 H new ATOM 0 HH2 TRP A 15 -9.136 14.785 9.640 1.00 60.04 H new ATOM 270 N LYS A 16 -2.849 20.762 8.152 1.00 3.15 N ATOM 271 CA LYS A 16 -1.495 21.163 8.515 1.00 4.11 C ATOM 272 C LYS A 16 -0.920 22.132 7.486 1.00 20.43 C ATOM 273 O LYS A 16 -0.146 23.027 7.825 1.00 24.44 O ATOM 274 CB LYS A 16 -0.591 19.934 8.634 1.00 32.50 C ATOM 275 CG LYS A 16 0.880 20.273 8.797 1.00 2.45 C ATOM 276 CD LYS A 16 1.634 20.133 7.486 1.00 60.13 C ATOM 277 CE LYS A 16 2.998 19.493 7.693 1.00 62.25 C ATOM 278 NZ LYS A 16 2.885 18.065 8.102 1.00 52.50 N ATOM 0 H LYS A 16 -2.954 19.768 7.949 1.00 3.15 H new ATOM 0 HA LYS A 16 -1.539 21.669 9.480 1.00 4.11 H new ATOM 0 HB2 LYS A 16 -0.914 19.337 9.487 1.00 32.50 H new ATOM 0 HB3 LYS A 16 -0.716 19.314 7.746 1.00 32.50 H new ATOM 0 HG2 LYS A 16 0.980 21.293 9.168 1.00 2.45 H new ATOM 0 HG3 LYS A 16 1.325 19.617 9.545 1.00 2.45 H new ATOM 0 HD2 LYS A 16 1.049 19.530 6.792 1.00 60.13 H new ATOM 0 HD3 LYS A 16 1.757 21.115 7.029 1.00 60.13 H new ATOM 0 HE2 LYS A 16 3.575 19.562 6.771 1.00 62.25 H new ATOM 0 HE3 LYS A 16 3.547 20.047 8.455 1.00 62.25 H new ATOM 0 HZ1 LYS A 16 3.771 17.568 7.878 1.00 52.50 H new ATOM 0 HZ2 LYS A 16 2.707 18.010 9.125 1.00 52.50 H new ATOM 0 HZ3 LYS A 16 2.098 17.618 7.589 1.00 52.50 H new ATOM 292 N LYS A 17 -1.305 21.948 6.228 1.00 71.11 N ATOM 293 CA LYS A 17 -0.831 22.807 5.149 1.00 20.41 C ATOM 294 C LYS A 17 -1.090 24.275 5.469 1.00 1.41 C ATOM 295 O LYS A 17 -0.184 25.106 5.395 1.00 3.54 O ATOM 296 CB LYS A 17 -1.516 22.432 3.833 1.00 61.01 C ATOM 297 CG LYS A 17 -0.571 22.393 2.645 1.00 44.53 C ATOM 298 CD LYS A 17 0.432 21.258 2.766 1.00 33.11 C ATOM 299 CE LYS A 17 0.582 20.504 1.453 1.00 0.44 C ATOM 300 NZ LYS A 17 1.628 21.109 0.583 1.00 4.15 N ATOM 0 H LYS A 17 -1.944 21.211 5.930 1.00 71.11 H new ATOM 0 HA LYS A 17 0.244 22.660 5.047 1.00 20.41 H new ATOM 0 HB2 LYS A 17 -1.987 21.455 3.944 1.00 61.01 H new ATOM 0 HB3 LYS A 17 -2.312 23.149 3.630 1.00 61.01 H new ATOM 0 HG2 LYS A 17 -1.145 22.276 1.726 1.00 44.53 H new ATOM 0 HG3 LYS A 17 -0.040 23.342 2.570 1.00 44.53 H new ATOM 0 HD2 LYS A 17 1.400 21.657 3.070 1.00 33.11 H new ATOM 0 HD3 LYS A 17 0.111 20.569 3.548 1.00 33.11 H new ATOM 0 HE2 LYS A 17 0.837 19.464 1.658 1.00 0.44 H new ATOM 0 HE3 LYS A 17 -0.372 20.500 0.925 1.00 0.44 H new ATOM 0 HZ1 LYS A 17 1.700 20.567 -0.302 1.00 4.15 H new ATOM 0 HZ2 LYS A 17 1.372 22.093 0.366 1.00 4.15 H new ATOM 0 HZ3 LYS A 17 2.543 21.090 1.076 1.00 4.15 H new ATOM 314 N LEU A 18 -2.331 24.589 5.826 1.00 64.44 N ATOM 315 CA LEU A 18 -2.708 25.958 6.159 1.00 74.32 C ATOM 316 C LEU A 18 -2.197 26.342 7.544 1.00 74.13 C ATOM 317 O LEU A 18 -1.973 27.518 7.829 1.00 32.31 O ATOM 318 CB LEU A 18 -4.229 26.116 6.102 1.00 42.45 C ATOM 319 CG LEU A 18 -4.797 26.669 4.794 1.00 12.10 C ATOM 320 CD1 LEU A 18 -4.332 28.100 4.572 1.00 30.14 C ATOM 321 CD2 LEU A 18 -4.393 25.787 3.622 1.00 43.23 C ATOM 0 H LEU A 18 -3.093 23.914 5.892 1.00 64.44 H new ATOM 0 HA LEU A 18 -2.251 26.624 5.426 1.00 74.32 H new ATOM 0 HB2 LEU A 18 -4.683 25.143 6.289 1.00 42.45 H new ATOM 0 HB3 LEU A 18 -4.537 26.773 6.915 1.00 42.45 H new ATOM 0 HG LEU A 18 -5.885 26.669 4.865 1.00 12.10 H new ATOM 0 HD11 LEU A 18 -4.746 28.476 3.637 1.00 30.14 H new ATOM 0 HD12 LEU A 18 -4.673 28.725 5.397 1.00 30.14 H new ATOM 0 HD13 LEU A 18 -3.243 28.125 4.523 1.00 30.14 H new ATOM 0 HD21 LEU A 18 -4.806 26.196 2.700 1.00 43.23 H new ATOM 0 HD22 LEU A 18 -3.306 25.754 3.549 1.00 43.23 H new ATOM 0 HD23 LEU A 18 -4.777 24.779 3.776 1.00 43.23 H new ATOM 333 N ALA A 19 -2.014 25.342 8.399 1.00 25.24 N ATOM 334 CA ALA A 19 -1.525 25.575 9.753 1.00 63.53 C ATOM 335 C ALA A 19 -0.109 26.140 9.735 1.00 24.13 C ATOM 336 O ALA A 19 0.200 27.085 10.460 1.00 43.43 O ATOM 337 CB ALA A 19 -1.570 24.285 10.559 1.00 14.23 C ATOM 0 H ALA A 19 -2.197 24.363 8.179 1.00 25.24 H new ATOM 0 HA ALA A 19 -2.176 26.310 10.227 1.00 63.53 H new ATOM 0 HB1 ALA A 19 -1.202 24.473 11.568 1.00 14.23 H new ATOM 0 HB2 ALA A 19 -2.597 23.923 10.609 1.00 14.23 H new ATOM 0 HB3 ALA A 19 -0.943 23.534 10.079 1.00 14.23 H new ATOM 343 N GLU A 20 0.747 25.554 8.904 1.00 45.10 N ATOM 344 CA GLU A 20 2.132 26.000 8.795 1.00 75.13 C ATOM 345 C GLU A 20 2.201 27.447 8.314 1.00 32.51 C ATOM 346 O GLU A 20 2.926 28.264 8.879 1.00 43.32 O ATOM 347 CB GLU A 20 2.908 25.095 7.836 1.00 20.30 C ATOM 348 CG GLU A 20 4.406 25.347 7.840 1.00 24.43 C ATOM 349 CD GLU A 20 5.048 25.027 9.177 1.00 70.34 C ATOM 350 OE1 GLU A 20 5.172 25.948 10.010 1.00 2.41 O ATOM 351 OE2 GLU A 20 5.426 23.856 9.389 1.00 72.33 O ATOM 0 H GLU A 20 0.507 24.770 8.297 1.00 45.10 H new ATOM 0 HA GLU A 20 2.585 25.942 9.785 1.00 75.13 H new ATOM 0 HB2 GLU A 20 2.722 24.054 8.102 1.00 20.30 H new ATOM 0 HB3 GLU A 20 2.527 25.239 6.825 1.00 20.30 H new ATOM 0 HG2 GLU A 20 4.874 24.743 7.063 1.00 24.43 H new ATOM 0 HG3 GLU A 20 4.596 26.391 7.591 1.00 24.43 H new ATOM 358 N GLU A 21 1.441 27.753 7.267 1.00 10.22 N ATOM 359 CA GLU A 21 1.417 29.100 6.710 1.00 45.52 C ATOM 360 C GLU A 21 0.885 30.102 7.730 1.00 3.35 C ATOM 361 O GLU A 21 1.275 31.270 7.732 1.00 61.53 O ATOM 362 CB GLU A 21 0.557 29.138 5.445 1.00 11.22 C ATOM 363 CG GLU A 21 1.352 28.960 4.163 1.00 73.04 C ATOM 364 CD GLU A 21 0.489 29.074 2.921 1.00 73.41 C ATOM 365 OE1 GLU A 21 -0.087 30.159 2.697 1.00 75.20 O ATOM 366 OE2 GLU A 21 0.389 28.078 2.174 1.00 42.13 O ATOM 0 H GLU A 21 0.835 27.087 6.788 1.00 10.22 H new ATOM 0 HA GLU A 21 2.440 29.377 6.454 1.00 45.52 H new ATOM 0 HB2 GLU A 21 -0.198 28.355 5.506 1.00 11.22 H new ATOM 0 HB3 GLU A 21 0.027 30.090 5.405 1.00 11.22 H new ATOM 0 HG2 GLU A 21 2.142 29.710 4.122 1.00 73.04 H new ATOM 0 HG3 GLU A 21 1.839 27.985 4.174 1.00 73.04 H new ATOM 373 N ALA A 22 -0.008 29.637 8.597 1.00 33.02 N ATOM 374 CA ALA A 22 -0.593 30.491 9.624 1.00 73.43 C ATOM 375 C ALA A 22 0.454 30.913 10.649 1.00 73.22 C ATOM 376 O ALA A 22 0.382 32.006 11.208 1.00 4.54 O ATOM 377 CB ALA A 22 -1.748 29.776 10.310 1.00 70.44 C ATOM 0 H ALA A 22 -0.342 28.673 8.609 1.00 33.02 H new ATOM 0 HA ALA A 22 -0.973 31.391 9.140 1.00 73.43 H new ATOM 0 HB1 ALA A 22 -2.175 30.425 11.074 1.00 70.44 H new ATOM 0 HB2 ALA A 22 -2.513 29.531 9.573 1.00 70.44 H new ATOM 0 HB3 ALA A 22 -1.384 28.859 10.774 1.00 70.44 H new ATOM 383 N ALA A 23 1.425 30.038 10.891 1.00 52.25 N ATOM 384 CA ALA A 23 2.487 30.321 11.848 1.00 41.55 C ATOM 385 C ALA A 23 3.310 31.529 11.412 1.00 4.14 C ATOM 386 O ALA A 23 3.853 32.256 12.245 1.00 44.04 O ATOM 387 CB ALA A 23 3.383 29.103 12.018 1.00 52.33 C ATOM 0 H ALA A 23 1.498 29.127 10.437 1.00 52.25 H new ATOM 0 HA ALA A 23 2.025 30.555 12.807 1.00 41.55 H new ATOM 0 HB1 ALA A 23 4.172 29.329 12.736 1.00 52.33 H new ATOM 0 HB2 ALA A 23 2.791 28.264 12.382 1.00 52.33 H new ATOM 0 HB3 ALA A 23 3.829 28.843 11.058 1.00 52.33 H new ATOM 393 N LYS A 24 3.400 31.738 10.103 1.00 32.42 N ATOM 394 CA LYS A 24 4.156 32.858 9.556 1.00 25.43 C ATOM 395 C LYS A 24 3.445 34.179 9.828 1.00 40.21 C ATOM 396 O LYS A 24 4.080 35.182 10.158 1.00 63.40 O ATOM 397 CB LYS A 24 4.360 32.676 8.050 1.00 34.44 C ATOM 398 CG LYS A 24 5.763 33.015 7.581 1.00 44.54 C ATOM 399 CD LYS A 24 5.884 32.920 6.069 1.00 51.21 C ATOM 400 CE LYS A 24 7.277 33.305 5.595 1.00 22.05 C ATOM 401 NZ LYS A 24 7.871 32.262 4.714 1.00 41.12 N ATOM 0 H LYS A 24 2.958 31.145 9.400 1.00 32.42 H new ATOM 0 HA LYS A 24 5.129 32.882 10.047 1.00 25.43 H new ATOM 0 HB2 LYS A 24 4.137 31.643 7.784 1.00 34.44 H new ATOM 0 HB3 LYS A 24 3.646 33.304 7.517 1.00 34.44 H new ATOM 0 HG2 LYS A 24 6.022 34.023 7.905 1.00 44.54 H new ATOM 0 HG3 LYS A 24 6.477 32.337 8.047 1.00 44.54 H new ATOM 0 HD2 LYS A 24 5.658 31.903 5.748 1.00 51.21 H new ATOM 0 HD3 LYS A 24 5.147 33.573 5.602 1.00 51.21 H new ATOM 0 HE2 LYS A 24 7.229 34.251 5.056 1.00 22.05 H new ATOM 0 HE3 LYS A 24 7.924 33.463 6.458 1.00 22.05 H new ATOM 0 HZ1 LYS A 24 8.820 32.562 4.412 1.00 41.12 H new ATOM 0 HZ2 LYS A 24 7.941 31.365 5.236 1.00 41.12 H new ATOM 0 HZ3 LYS A 24 7.268 32.129 3.877 1.00 41.12 H new ATOM 415 N LEU A 25 2.124 34.174 9.689 1.00 50.24 N ATOM 416 CA LEU A 25 1.326 35.373 9.921 1.00 75.23 C ATOM 417 C LEU A 25 1.392 35.796 11.385 1.00 54.14 C ATOM 418 O LEU A 25 1.392 36.987 11.698 1.00 12.33 O ATOM 419 CB LEU A 25 -0.129 35.128 9.514 1.00 64.40 C ATOM 420 CG LEU A 25 -0.681 36.037 8.416 1.00 62.03 C ATOM 421 CD1 LEU A 25 -0.510 37.499 8.797 1.00 13.25 C ATOM 422 CD2 LEU A 25 0.005 35.747 7.088 1.00 35.04 C ATOM 0 H LEU A 25 1.583 33.353 9.417 1.00 50.24 H new ATOM 0 HA LEU A 25 1.737 36.177 9.311 1.00 75.23 H new ATOM 0 HB2 LEU A 25 -0.223 34.094 9.183 1.00 64.40 H new ATOM 0 HB3 LEU A 25 -0.756 35.238 10.399 1.00 64.40 H new ATOM 0 HG LEU A 25 -1.746 35.834 8.305 1.00 62.03 H new ATOM 0 HD11 LEU A 25 -0.909 38.131 8.003 1.00 13.25 H new ATOM 0 HD12 LEU A 25 -1.047 37.699 9.724 1.00 13.25 H new ATOM 0 HD13 LEU A 25 0.549 37.717 8.937 1.00 13.25 H new ATOM 0 HD21 LEU A 25 -0.401 36.403 6.318 1.00 35.04 H new ATOM 0 HD22 LEU A 25 1.076 35.922 7.186 1.00 35.04 H new ATOM 0 HD23 LEU A 25 -0.169 34.708 6.808 1.00 35.04 H new ATOM 434 N LEU A 26 1.450 34.814 12.277 1.00 74.31 N ATOM 435 CA LEU A 26 1.519 35.084 13.709 1.00 74.11 C ATOM 436 C LEU A 26 2.853 35.723 14.079 1.00 41.44 C ATOM 437 O LEU A 26 2.916 36.590 14.950 1.00 41.12 O ATOM 438 CB LEU A 26 1.323 33.791 14.502 1.00 72.51 C ATOM 439 CG LEU A 26 -0.102 33.505 14.979 1.00 64.34 C ATOM 440 CD1 LEU A 26 -0.181 32.134 15.632 1.00 62.42 C ATOM 441 CD2 LEU A 26 -0.568 34.585 15.944 1.00 60.14 C ATOM 0 H LEU A 26 1.451 33.823 12.034 1.00 74.31 H new ATOM 0 HA LEU A 26 0.720 35.782 13.961 1.00 74.11 H new ATOM 0 HB2 LEU A 26 1.652 32.956 13.884 1.00 72.51 H new ATOM 0 HB3 LEU A 26 1.977 33.820 15.373 1.00 72.51 H new ATOM 0 HG LEU A 26 -0.763 33.511 14.112 1.00 64.34 H new ATOM 0 HD11 LEU A 26 -1.202 31.948 15.965 1.00 62.42 H new ATOM 0 HD12 LEU A 26 0.110 31.370 14.911 1.00 62.42 H new ATOM 0 HD13 LEU A 26 0.492 32.100 16.489 1.00 62.42 H new ATOM 0 HD21 LEU A 26 -1.584 34.365 16.273 1.00 60.14 H new ATOM 0 HD22 LEU A 26 0.096 34.612 16.808 1.00 60.14 H new ATOM 0 HD23 LEU A 26 -0.550 35.553 15.443 1.00 60.14 H new ATOM 453 N GLU A 27 3.917 35.291 13.409 1.00 73.24 N ATOM 454 CA GLU A 27 5.250 35.823 13.667 1.00 74.13 C ATOM 455 C GLU A 27 5.619 36.888 12.638 1.00 13.22 C ATOM 456 O GLU A 27 6.785 37.253 12.498 1.00 41.41 O ATOM 457 CB GLU A 27 6.285 34.697 13.645 1.00 25.01 C ATOM 458 CG GLU A 27 6.430 34.029 12.288 1.00 22.00 C ATOM 459 CD GLU A 27 7.475 34.699 11.417 1.00 60.44 C ATOM 460 OE1 GLU A 27 7.094 35.533 10.569 1.00 14.25 O ATOM 461 OE2 GLU A 27 8.673 34.388 11.581 1.00 2.23 O ATOM 0 H GLU A 27 3.882 34.574 12.684 1.00 73.24 H new ATOM 0 HA GLU A 27 5.245 36.283 14.655 1.00 74.13 H new ATOM 0 HB2 GLU A 27 7.252 35.098 13.948 1.00 25.01 H new ATOM 0 HB3 GLU A 27 6.006 33.945 14.383 1.00 25.01 H new ATOM 0 HG2 GLU A 27 6.697 32.982 12.429 1.00 22.00 H new ATOM 0 HG3 GLU A 27 5.469 34.046 11.774 1.00 22.00 H new ATOM 468 N GLY A 28 4.615 37.382 11.920 1.00 14.52 N ATOM 469 CA GLY A 28 4.853 38.400 10.913 1.00 22.03 C ATOM 470 C GLY A 28 5.161 39.755 11.520 1.00 73.23 C ATOM 471 O GLY A 28 6.284 40.246 11.422 1.00 64.13 O ATOM 0 H GLY A 28 3.641 37.095 12.018 1.00 14.52 H new ATOM 0 HA2 GLY A 28 5.684 38.092 10.279 1.00 22.03 H new ATOM 0 HA3 GLY A 28 3.976 38.484 10.271 1.00 22.03 H new ATOM 524 N GLU A 36 5.057 32.571 21.812 1.00 5.32 N ATOM 525 CA GLU A 36 4.115 31.505 22.130 1.00 60.12 C ATOM 526 C GLU A 36 3.133 31.287 20.982 1.00 22.11 C ATOM 527 O GLU A 36 2.673 30.169 20.748 1.00 72.34 O ATOM 528 CB GLU A 36 3.351 31.835 23.414 1.00 53.15 C ATOM 529 CG GLU A 36 2.199 30.885 23.698 1.00 43.33 C ATOM 530 CD GLU A 36 1.578 31.113 25.062 1.00 1.22 C ATOM 531 OE1 GLU A 36 0.881 30.202 25.556 1.00 65.31 O ATOM 532 OE2 GLU A 36 1.788 32.202 25.636 1.00 42.11 O ATOM 0 HA GLU A 36 4.682 30.586 22.280 1.00 60.12 H new ATOM 0 HB2 GLU A 36 4.044 31.814 24.255 1.00 53.15 H new ATOM 0 HB3 GLU A 36 2.964 32.852 23.345 1.00 53.15 H new ATOM 0 HG2 GLU A 36 1.435 31.007 22.930 1.00 43.33 H new ATOM 0 HG3 GLU A 36 2.556 29.857 23.633 1.00 43.33 H new ATOM 539 N LEU A 37 2.816 32.363 20.270 1.00 25.21 N ATOM 540 CA LEU A 37 1.889 32.291 19.147 1.00 72.25 C ATOM 541 C LEU A 37 2.368 31.281 18.109 1.00 72.22 C ATOM 542 O LEU A 37 1.563 30.657 17.418 1.00 52.23 O ATOM 543 CB LEU A 37 1.732 33.668 18.500 1.00 43.30 C ATOM 544 CG LEU A 37 0.746 34.620 19.178 1.00 72.21 C ATOM 545 CD1 LEU A 37 -0.655 34.026 19.177 1.00 5.40 C ATOM 546 CD2 LEU A 37 1.195 34.930 20.598 1.00 14.14 C ATOM 0 H LEU A 37 3.188 33.296 20.451 1.00 25.21 H new ATOM 0 HA LEU A 37 0.922 31.963 19.527 1.00 72.25 H new ATOM 0 HB2 LEU A 37 2.710 34.148 18.474 1.00 43.30 H new ATOM 0 HB3 LEU A 37 1.418 33.528 17.466 1.00 43.30 H new ATOM 0 HG LEU A 37 0.724 35.552 18.614 1.00 72.21 H new ATOM 0 HD11 LEU A 37 -1.344 34.717 19.663 1.00 5.40 H new ATOM 0 HD12 LEU A 37 -0.977 33.856 18.150 1.00 5.40 H new ATOM 0 HD13 LEU A 37 -0.649 33.079 19.717 1.00 5.40 H new ATOM 0 HD21 LEU A 37 0.482 35.609 21.065 1.00 14.14 H new ATOM 0 HD22 LEU A 37 1.247 34.006 21.173 1.00 14.14 H new ATOM 0 HD23 LEU A 37 2.179 35.398 20.574 1.00 14.14 H new ATOM 558 N MET A 38 3.684 31.124 18.007 1.00 75.51 N ATOM 559 CA MET A 38 4.269 30.186 17.056 1.00 44.13 C ATOM 560 C MET A 38 4.085 28.747 17.527 1.00 55.14 C ATOM 561 O MET A 38 3.954 27.830 16.716 1.00 32.40 O ATOM 562 CB MET A 38 5.757 30.485 16.863 1.00 24.02 C ATOM 563 CG MET A 38 6.062 31.963 16.679 1.00 75.24 C ATOM 564 SD MET A 38 7.647 32.250 15.869 1.00 73.22 S ATOM 565 CE MET A 38 8.435 33.345 17.047 1.00 64.52 C ATOM 0 H MET A 38 4.365 31.634 18.571 1.00 75.51 H new ATOM 0 HA MET A 38 3.754 30.306 16.103 1.00 44.13 H new ATOM 0 HB2 MET A 38 6.309 30.114 17.727 1.00 24.02 H new ATOM 0 HB3 MET A 38 6.119 29.937 15.993 1.00 24.02 H new ATOM 0 HG2 MET A 38 5.269 32.423 16.090 1.00 75.24 H new ATOM 0 HG3 MET A 38 6.062 32.454 17.652 1.00 75.24 H new ATOM 0 HE1 MET A 38 9.428 33.613 16.686 1.00 64.52 H new ATOM 0 HE2 MET A 38 7.835 34.247 17.163 1.00 64.52 H new ATOM 0 HE3 MET A 38 8.522 32.841 18.010 1.00 64.52 H new ATOM 575 N LYS A 39 4.075 28.556 18.841 1.00 11.14 N ATOM 576 CA LYS A 39 3.905 27.229 19.421 1.00 2.01 C ATOM 577 C LYS A 39 2.446 26.791 19.359 1.00 74.44 C ATOM 578 O LYS A 39 2.149 25.604 19.214 1.00 71.21 O ATOM 579 CB LYS A 39 4.390 27.218 20.873 1.00 43.15 C ATOM 580 CG LYS A 39 5.753 27.862 21.063 1.00 31.43 C ATOM 581 CD LYS A 39 6.529 27.201 22.191 1.00 54.04 C ATOM 582 CE LYS A 39 7.349 26.023 21.687 1.00 35.13 C ATOM 583 NZ LYS A 39 8.673 25.941 22.362 1.00 24.43 N ATOM 0 H LYS A 39 4.183 29.304 19.526 1.00 11.14 H new ATOM 0 HA LYS A 39 4.502 26.527 18.839 1.00 2.01 H new ATOM 0 HB2 LYS A 39 3.662 27.738 21.495 1.00 43.15 H new ATOM 0 HB3 LYS A 39 4.432 26.187 21.226 1.00 43.15 H new ATOM 0 HG2 LYS A 39 6.323 27.790 20.137 1.00 31.43 H new ATOM 0 HG3 LYS A 39 5.628 28.923 21.279 1.00 31.43 H new ATOM 0 HD2 LYS A 39 7.189 27.932 22.657 1.00 54.04 H new ATOM 0 HD3 LYS A 39 5.836 26.861 22.960 1.00 54.04 H new ATOM 0 HE2 LYS A 39 6.798 25.098 21.855 1.00 35.13 H new ATOM 0 HE3 LYS A 39 7.495 26.116 20.611 1.00 35.13 H new ATOM 0 HZ1 LYS A 39 9.202 25.126 21.991 1.00 24.43 H new ATOM 0 HZ2 LYS A 39 9.210 26.813 22.181 1.00 24.43 H new ATOM 0 HZ3 LYS A 39 8.534 25.827 23.386 1.00 24.43 H new ATOM 597 N LEU A 40 1.538 27.755 19.467 1.00 60.51 N ATOM 598 CA LEU A 40 0.108 27.468 19.421 1.00 63.00 C ATOM 599 C LEU A 40 -0.263 26.758 18.123 1.00 54.41 C ATOM 600 O LEU A 40 -0.956 25.740 18.137 1.00 64.21 O ATOM 601 CB LEU A 40 -0.696 28.762 19.557 1.00 42.15 C ATOM 602 CG LEU A 40 -1.788 28.765 20.627 1.00 24.01 C ATOM 603 CD1 LEU A 40 -1.278 29.410 21.907 1.00 75.40 C ATOM 604 CD2 LEU A 40 -3.028 29.486 20.121 1.00 15.25 C ATOM 0 H LEU A 40 1.766 28.742 19.587 1.00 60.51 H new ATOM 0 HA LEU A 40 -0.133 26.809 20.255 1.00 63.00 H new ATOM 0 HB2 LEU A 40 -0.003 29.576 19.771 1.00 42.15 H new ATOM 0 HB3 LEU A 40 -1.158 28.982 18.595 1.00 42.15 H new ATOM 0 HG LEU A 40 -2.058 27.732 20.847 1.00 24.01 H new ATOM 0 HD11 LEU A 40 -2.068 29.404 22.658 1.00 75.40 H new ATOM 0 HD12 LEU A 40 -0.420 28.851 22.279 1.00 75.40 H new ATOM 0 HD13 LEU A 40 -0.980 30.438 21.703 1.00 75.40 H new ATOM 0 HD21 LEU A 40 -3.795 29.478 20.896 1.00 15.25 H new ATOM 0 HD22 LEU A 40 -2.774 30.516 19.872 1.00 15.25 H new ATOM 0 HD23 LEU A 40 -3.405 28.981 19.232 1.00 15.25 H new ATOM 616 N CYS A 41 0.202 27.302 17.004 1.00 62.33 N ATOM 617 CA CYS A 41 -0.080 26.720 15.696 1.00 32.33 C ATOM 618 C CYS A 41 0.633 25.382 15.531 1.00 20.43 C ATOM 619 O CYS A 41 0.036 24.400 15.089 1.00 5.43 O ATOM 620 CB CYS A 41 0.347 27.679 14.585 1.00 52.52 C ATOM 621 SG CYS A 41 -0.986 28.733 13.967 1.00 53.03 S ATOM 0 H CYS A 41 0.776 28.145 16.976 1.00 62.33 H new ATOM 0 HA CYS A 41 -1.154 26.550 15.626 1.00 32.33 H new ATOM 0 HB2 CYS A 41 1.154 28.311 14.956 1.00 52.52 H new ATOM 0 HB3 CYS A 41 0.752 27.100 13.755 1.00 52.52 H new ATOM 0 HG CYS A 41 -0.526 29.510 13.032 1.00 53.03 H new ATOM 627 N GLU A 42 1.913 25.351 15.888 1.00 2.23 N ATOM 628 CA GLU A 42 2.708 24.134 15.777 1.00 71.30 C ATOM 629 C GLU A 42 2.065 22.991 16.558 1.00 51.03 C ATOM 630 O GLU A 42 1.968 21.868 16.065 1.00 34.44 O ATOM 631 CB GLU A 42 4.130 24.378 16.287 1.00 73.31 C ATOM 632 CG GLU A 42 5.039 23.168 16.156 1.00 23.42 C ATOM 633 CD GLU A 42 5.883 22.935 17.395 1.00 52.33 C ATOM 634 OE1 GLU A 42 5.640 21.932 18.097 1.00 30.43 O ATOM 635 OE2 GLU A 42 6.785 23.756 17.662 1.00 52.44 O ATOM 0 H GLU A 42 2.421 26.155 16.257 1.00 2.23 H new ATOM 0 HA GLU A 42 2.751 23.854 14.725 1.00 71.30 H new ATOM 0 HB2 GLU A 42 4.567 25.211 15.736 1.00 73.31 H new ATOM 0 HB3 GLU A 42 4.085 24.677 17.334 1.00 73.31 H new ATOM 0 HG2 GLU A 42 4.433 22.283 15.962 1.00 23.42 H new ATOM 0 HG3 GLU A 42 5.694 23.302 15.295 1.00 23.42 H new ATOM 642 N GLU A 43 1.628 23.288 17.778 1.00 65.31 N ATOM 643 CA GLU A 43 0.996 22.285 18.627 1.00 3.01 C ATOM 644 C GLU A 43 -0.231 21.689 17.944 1.00 61.33 C ATOM 645 O GLU A 43 -0.392 20.470 17.886 1.00 5.03 O ATOM 646 CB GLU A 43 0.597 22.900 19.970 1.00 2.21 C ATOM 647 CG GLU A 43 1.765 23.092 20.923 1.00 62.02 C ATOM 648 CD GLU A 43 1.976 21.899 21.835 1.00 62.13 C ATOM 649 OE1 GLU A 43 1.636 20.770 21.422 1.00 15.33 O ATOM 650 OE2 GLU A 43 2.481 22.093 22.960 1.00 42.40 O ATOM 0 H GLU A 43 1.700 24.214 18.200 1.00 65.31 H new ATOM 0 HA GLU A 43 1.717 21.487 18.801 1.00 3.01 H new ATOM 0 HB2 GLU A 43 0.122 23.865 19.791 1.00 2.21 H new ATOM 0 HB3 GLU A 43 -0.148 22.262 20.445 1.00 2.21 H new ATOM 0 HG2 GLU A 43 2.673 23.270 20.347 1.00 62.02 H new ATOM 0 HG3 GLU A 43 1.592 23.982 21.529 1.00 62.02 H new ATOM 657 N ALA A 44 -1.094 22.557 17.428 1.00 51.54 N ATOM 658 CA ALA A 44 -2.306 22.118 16.747 1.00 22.21 C ATOM 659 C ALA A 44 -1.980 21.139 15.624 1.00 32.11 C ATOM 660 O ALA A 44 -2.702 20.166 15.408 1.00 63.32 O ATOM 661 CB ALA A 44 -3.069 23.316 16.201 1.00 24.30 C ATOM 0 H ALA A 44 -0.977 23.569 17.468 1.00 51.54 H new ATOM 0 HA ALA A 44 -2.934 21.602 17.473 1.00 22.21 H new ATOM 0 HB1 ALA A 44 -3.971 22.973 15.695 1.00 24.30 H new ATOM 0 HB2 ALA A 44 -3.343 23.978 17.022 1.00 24.30 H new ATOM 0 HB3 ALA A 44 -2.440 23.856 15.494 1.00 24.30 H new ATOM 667 N ALA A 45 -0.890 21.404 14.912 1.00 61.11 N ATOM 668 CA ALA A 45 -0.469 20.545 13.812 1.00 44.31 C ATOM 669 C ALA A 45 0.096 19.227 14.330 1.00 61.12 C ATOM 670 O ALA A 45 0.019 18.199 13.656 1.00 5.23 O ATOM 671 CB ALA A 45 0.561 21.260 12.949 1.00 32.00 C ATOM 0 H ALA A 45 -0.282 22.207 15.077 1.00 61.11 H new ATOM 0 HA ALA A 45 -1.345 20.320 13.203 1.00 44.31 H new ATOM 0 HB1 ALA A 45 0.867 20.607 12.131 1.00 32.00 H new ATOM 0 HB2 ALA A 45 0.124 22.172 12.542 1.00 32.00 H new ATOM 0 HB3 ALA A 45 1.431 21.514 13.555 1.00 32.00 H new ATOM 677 N LYS A 46 0.664 19.263 15.530 1.00 4.14 N ATOM 678 CA LYS A 46 1.242 18.071 16.140 1.00 2.30 C ATOM 679 C LYS A 46 0.164 17.032 16.432 1.00 3.41 C ATOM 680 O LYS A 46 0.388 15.831 16.281 1.00 53.13 O ATOM 681 CB LYS A 46 1.975 18.439 17.432 1.00 30.44 C ATOM 682 CG LYS A 46 3.226 17.613 17.678 1.00 42.32 C ATOM 683 CD LYS A 46 4.474 18.480 17.682 1.00 1.32 C ATOM 684 CE LYS A 46 5.576 17.867 18.533 1.00 13.22 C ATOM 685 NZ LYS A 46 5.593 18.434 19.910 1.00 3.02 N ATOM 0 H LYS A 46 0.737 20.105 16.100 1.00 4.14 H new ATOM 0 HA LYS A 46 1.954 17.641 15.435 1.00 2.30 H new ATOM 0 HB2 LYS A 46 2.247 19.494 17.398 1.00 30.44 H new ATOM 0 HB3 LYS A 46 1.295 18.313 18.274 1.00 30.44 H new ATOM 0 HG2 LYS A 46 3.139 17.094 18.633 1.00 42.32 H new ATOM 0 HG3 LYS A 46 3.316 16.848 16.907 1.00 42.32 H new ATOM 0 HD2 LYS A 46 4.831 18.610 16.660 1.00 1.32 H new ATOM 0 HD3 LYS A 46 4.228 19.472 18.062 1.00 1.32 H new ATOM 0 HE2 LYS A 46 5.436 16.787 18.586 1.00 13.22 H new ATOM 0 HE3 LYS A 46 6.541 18.040 18.057 1.00 13.22 H new ATOM 0 HZ1 LYS A 46 6.358 17.991 20.458 1.00 3.02 H new ATOM 0 HZ2 LYS A 46 5.752 19.461 19.861 1.00 3.02 H new ATOM 0 HZ3 LYS A 46 4.681 18.247 20.374 1.00 3.02 H new ATOM 699 N LYS A 47 -1.006 17.502 16.850 1.00 11.33 N ATOM 700 CA LYS A 47 -2.121 16.615 17.161 1.00 25.01 C ATOM 701 C LYS A 47 -2.495 15.767 15.950 1.00 60.03 C ATOM 702 O LYS A 47 -2.921 14.621 16.090 1.00 11.14 O ATOM 703 CB LYS A 47 -3.333 17.427 17.623 1.00 44.24 C ATOM 704 CG LYS A 47 -3.754 17.132 19.052 1.00 75.25 C ATOM 705 CD LYS A 47 -3.364 18.259 19.993 1.00 52.14 C ATOM 706 CE LYS A 47 -2.940 17.728 21.353 1.00 25.30 C ATOM 707 NZ LYS A 47 -2.325 18.790 22.196 1.00 13.25 N ATOM 0 H LYS A 47 -1.207 18.493 16.981 1.00 11.33 H new ATOM 0 HA LYS A 47 -1.810 15.950 17.966 1.00 25.01 H new ATOM 0 HB2 LYS A 47 -3.104 18.489 17.532 1.00 44.24 H new ATOM 0 HB3 LYS A 47 -4.171 17.224 16.957 1.00 44.24 H new ATOM 0 HG2 LYS A 47 -4.833 16.982 19.091 1.00 75.25 H new ATOM 0 HG3 LYS A 47 -3.291 16.203 19.384 1.00 75.25 H new ATOM 0 HD2 LYS A 47 -2.548 18.834 19.555 1.00 52.14 H new ATOM 0 HD3 LYS A 47 -4.206 18.941 20.114 1.00 52.14 H new ATOM 0 HE2 LYS A 47 -3.807 17.313 21.867 1.00 25.30 H new ATOM 0 HE3 LYS A 47 -2.228 16.913 21.219 1.00 25.30 H new ATOM 0 HZ1 LYS A 47 -2.050 18.388 23.115 1.00 13.25 H new ATOM 0 HZ2 LYS A 47 -1.483 19.169 21.717 1.00 13.25 H new ATOM 0 HZ3 LYS A 47 -3.012 19.556 22.345 1.00 13.25 H new ATOM 721 N ALA A 48 -2.332 16.337 14.760 1.00 4.35 N ATOM 722 CA ALA A 48 -2.649 15.632 13.525 1.00 52.20 C ATOM 723 C ALA A 48 -1.793 14.380 13.372 1.00 65.02 C ATOM 724 O ALA A 48 -2.214 13.400 12.758 1.00 50.52 O ATOM 725 CB ALA A 48 -2.460 16.553 12.328 1.00 34.24 C ATOM 0 H ALA A 48 -1.982 17.286 14.626 1.00 4.35 H new ATOM 0 HA ALA A 48 -3.693 15.323 13.570 1.00 52.20 H new ATOM 0 HB1 ALA A 48 -2.700 16.013 11.412 1.00 34.24 H new ATOM 0 HB2 ALA A 48 -3.120 17.415 12.425 1.00 34.24 H new ATOM 0 HB3 ALA A 48 -1.424 16.891 12.289 1.00 34.24 H new ATOM 731 N GLU A 49 -0.588 14.420 13.933 1.00 32.15 N ATOM 732 CA GLU A 49 0.328 13.288 13.857 1.00 75.21 C ATOM 733 C GLU A 49 -0.195 12.109 14.673 1.00 0.23 C ATOM 734 O GLU A 49 0.016 10.951 14.315 1.00 52.23 O ATOM 735 CB GLU A 49 1.716 13.692 14.356 1.00 44.12 C ATOM 736 CG GLU A 49 2.793 13.615 13.287 1.00 44.12 C ATOM 737 CD GLU A 49 3.596 14.897 13.173 1.00 34.15 C ATOM 738 OE1 GLU A 49 2.997 15.944 12.849 1.00 31.01 O ATOM 739 OE2 GLU A 49 4.821 14.853 13.409 1.00 41.43 O ATOM 0 H GLU A 49 -0.224 15.224 14.445 1.00 32.15 H new ATOM 0 HA GLU A 49 0.400 12.982 12.813 1.00 75.21 H new ATOM 0 HB2 GLU A 49 1.672 14.710 14.743 1.00 44.12 H new ATOM 0 HB3 GLU A 49 1.996 13.047 15.189 1.00 44.12 H new ATOM 0 HG2 GLU A 49 3.466 12.788 13.514 1.00 44.12 H new ATOM 0 HG3 GLU A 49 2.330 13.394 12.325 1.00 44.12 H new ATOM 746 N GLU A 50 -0.877 12.414 15.773 1.00 41.51 N ATOM 747 CA GLU A 50 -1.428 11.381 16.641 1.00 71.51 C ATOM 748 C GLU A 50 -2.701 10.789 16.042 1.00 11.21 C ATOM 749 O GLU A 50 -3.004 9.611 16.238 1.00 41.44 O ATOM 750 CB GLU A 50 -1.722 11.952 18.029 1.00 13.43 C ATOM 751 CG GLU A 50 -1.817 10.894 19.116 1.00 54.43 C ATOM 752 CD GLU A 50 -2.248 11.467 20.452 1.00 40.40 C ATOM 753 OE1 GLU A 50 -1.664 11.071 21.482 1.00 1.45 O ATOM 754 OE2 GLU A 50 -3.168 12.311 20.468 1.00 74.04 O ATOM 0 H GLU A 50 -1.061 13.368 16.083 1.00 41.51 H new ATOM 0 HA GLU A 50 -0.687 10.587 16.733 1.00 71.51 H new ATOM 0 HB2 GLU A 50 -0.939 12.663 18.293 1.00 13.43 H new ATOM 0 HB3 GLU A 50 -2.659 12.508 17.993 1.00 13.43 H new ATOM 0 HG2 GLU A 50 -2.526 10.126 18.809 1.00 54.43 H new ATOM 0 HG3 GLU A 50 -0.848 10.407 19.229 1.00 54.43 H new ATOM 761 N LEU A 51 -3.443 11.615 15.312 1.00 32.25 N ATOM 762 CA LEU A 51 -4.685 11.175 14.685 1.00 45.13 C ATOM 763 C LEU A 51 -4.400 10.257 13.500 1.00 33.13 C ATOM 764 O LEU A 51 -5.140 9.306 13.247 1.00 23.54 O ATOM 765 CB LEU A 51 -5.502 12.383 14.223 1.00 4.34 C ATOM 766 CG LEU A 51 -6.833 12.607 14.941 1.00 32.42 C ATOM 767 CD1 LEU A 51 -7.753 11.412 14.743 1.00 32.12 C ATOM 768 CD2 LEU A 51 -6.603 12.865 16.423 1.00 15.40 C ATOM 0 H LEU A 51 -3.207 12.592 15.140 1.00 32.25 H new ATOM 0 HA LEU A 51 -5.259 10.617 15.425 1.00 45.13 H new ATOM 0 HB2 LEU A 51 -4.891 13.278 14.345 1.00 4.34 H new ATOM 0 HB3 LEU A 51 -5.701 12.276 13.157 1.00 4.34 H new ATOM 0 HG LEU A 51 -7.313 13.486 14.510 1.00 32.42 H new ATOM 0 HD11 LEU A 51 -8.696 11.589 15.261 1.00 32.12 H new ATOM 0 HD12 LEU A 51 -7.944 11.272 13.679 1.00 32.12 H new ATOM 0 HD13 LEU A 51 -7.279 10.517 15.147 1.00 32.12 H new ATOM 0 HD21 LEU A 51 -7.561 13.022 16.918 1.00 15.40 H new ATOM 0 HD22 LEU A 51 -6.101 12.006 16.868 1.00 15.40 H new ATOM 0 HD23 LEU A 51 -5.981 13.752 16.546 1.00 15.40 H new ATOM 780 N PHE A 52 -3.323 10.547 12.778 1.00 0.24 N ATOM 781 CA PHE A 52 -2.940 9.747 11.621 1.00 22.01 C ATOM 782 C PHE A 52 -2.705 8.293 12.019 1.00 34.31 C ATOM 783 O PHE A 52 -2.970 7.374 11.243 1.00 22.02 O ATOM 784 CB PHE A 52 -1.678 10.320 10.974 1.00 45.15 C ATOM 785 CG PHE A 52 -1.851 10.663 9.522 1.00 75.25 C ATOM 786 CD1 PHE A 52 -2.415 9.751 8.643 1.00 23.05 C ATOM 787 CD2 PHE A 52 -1.451 11.897 9.035 1.00 72.24 C ATOM 788 CE1 PHE A 52 -2.577 10.063 7.307 1.00 45.33 C ATOM 789 CE2 PHE A 52 -1.611 12.215 7.699 1.00 21.22 C ATOM 790 CZ PHE A 52 -2.173 11.297 6.834 1.00 71.41 C ATOM 0 H PHE A 52 -2.700 11.330 12.974 1.00 0.24 H new ATOM 0 HA PHE A 52 -3.757 9.781 10.901 1.00 22.01 H new ATOM 0 HB2 PHE A 52 -1.376 11.215 11.517 1.00 45.15 H new ATOM 0 HB3 PHE A 52 -0.868 9.598 11.074 1.00 45.15 H new ATOM 0 HD1 PHE A 52 -2.732 8.785 9.007 1.00 23.05 H new ATOM 0 HD2 PHE A 52 -1.009 12.618 9.706 1.00 72.24 H new ATOM 0 HE1 PHE A 52 -3.019 9.344 6.633 1.00 45.33 H new ATOM 0 HE2 PHE A 52 -1.297 13.181 7.332 1.00 21.22 H new ATOM 0 HZ PHE A 52 -2.297 11.543 5.790 1.00 71.41 H new ATOM 800 N LYS A 53 -2.207 8.091 13.234 1.00 44.10 N ATOM 801 CA LYS A 53 -1.936 6.750 13.738 1.00 72.33 C ATOM 802 C LYS A 53 -3.227 5.946 13.866 1.00 5.53 C ATOM 803 O LYS A 53 -3.264 4.758 13.546 1.00 74.32 O ATOM 804 CB LYS A 53 -1.232 6.824 15.094 1.00 11.54 C ATOM 805 CG LYS A 53 0.283 6.826 14.994 1.00 65.32 C ATOM 806 CD LYS A 53 0.846 5.415 15.037 1.00 43.02 C ATOM 807 CE LYS A 53 2.093 5.286 14.175 1.00 73.34 C ATOM 808 NZ LYS A 53 1.976 4.170 13.195 1.00 23.13 N ATOM 0 H LYS A 53 -1.983 8.840 13.889 1.00 44.10 H new ATOM 0 HA LYS A 53 -1.284 6.246 13.025 1.00 72.33 H new ATOM 0 HB2 LYS A 53 -1.555 7.727 15.612 1.00 11.54 H new ATOM 0 HB3 LYS A 53 -1.546 5.977 15.704 1.00 11.54 H new ATOM 0 HG2 LYS A 53 0.587 7.312 14.067 1.00 65.32 H new ATOM 0 HG3 LYS A 53 0.702 7.411 15.813 1.00 65.32 H new ATOM 0 HD2 LYS A 53 1.085 5.149 16.067 1.00 43.02 H new ATOM 0 HD3 LYS A 53 0.090 4.710 14.693 1.00 43.02 H new ATOM 0 HE2 LYS A 53 2.265 6.221 13.642 1.00 73.34 H new ATOM 0 HE3 LYS A 53 2.960 5.119 14.814 1.00 73.34 H new ATOM 0 HZ1 LYS A 53 2.845 4.115 12.627 1.00 23.13 H new ATOM 0 HZ2 LYS A 53 1.838 3.274 13.704 1.00 23.13 H new ATOM 0 HZ3 LYS A 53 1.163 4.341 12.569 1.00 23.13 H new ATOM 822 N LEU A 54 -4.282 6.603 14.335 1.00 30.55 N ATOM 823 CA LEU A 54 -5.576 5.950 14.505 1.00 65.42 C ATOM 824 C LEU A 54 -6.287 5.794 13.164 1.00 2.45 C ATOM 825 O LEU A 54 -6.787 4.719 12.837 1.00 63.32 O ATOM 826 CB LEU A 54 -6.451 6.751 15.470 1.00 60.21 C ATOM 827 CG LEU A 54 -6.230 6.480 16.959 1.00 52.34 C ATOM 828 CD1 LEU A 54 -4.888 7.036 17.409 1.00 61.43 C ATOM 829 CD2 LEU A 54 -7.361 7.079 17.783 1.00 44.12 C ATOM 0 H LEU A 54 -4.267 7.587 14.604 1.00 30.55 H new ATOM 0 HA LEU A 54 -5.403 4.958 14.921 1.00 65.42 H new ATOM 0 HB2 LEU A 54 -6.283 7.812 15.285 1.00 60.21 H new ATOM 0 HB3 LEU A 54 -7.496 6.548 15.235 1.00 60.21 H new ATOM 0 HG LEU A 54 -6.224 5.401 17.116 1.00 52.34 H new ATOM 0 HD11 LEU A 54 -4.748 6.834 18.471 1.00 61.43 H new ATOM 0 HD12 LEU A 54 -4.088 6.561 16.841 1.00 61.43 H new ATOM 0 HD13 LEU A 54 -4.864 8.112 17.238 1.00 61.43 H new ATOM 0 HD21 LEU A 54 -7.188 6.877 18.840 1.00 44.12 H new ATOM 0 HD22 LEU A 54 -7.398 8.156 17.621 1.00 44.12 H new ATOM 0 HD23 LEU A 54 -8.308 6.633 17.479 1.00 44.12 H new ATOM 841 N ALA A 55 -6.326 6.876 12.393 1.00 72.43 N ATOM 842 CA ALA A 55 -6.972 6.858 11.086 1.00 12.41 C ATOM 843 C ALA A 55 -6.392 5.760 10.201 1.00 33.15 C ATOM 844 O ALA A 55 -7.070 5.243 9.314 1.00 13.21 O ATOM 845 CB ALA A 55 -6.830 8.214 10.409 1.00 33.33 C ATOM 0 H ALA A 55 -5.918 7.775 12.650 1.00 72.43 H new ATOM 0 HA ALA A 55 -8.031 6.647 11.235 1.00 12.41 H new ATOM 0 HB1 ALA A 55 -7.317 8.187 9.434 1.00 33.33 H new ATOM 0 HB2 ALA A 55 -7.298 8.980 11.027 1.00 33.33 H new ATOM 0 HB3 ALA A 55 -5.773 8.448 10.280 1.00 33.33 H new ATOM 851 N GLU A 56 -5.134 5.409 10.449 1.00 33.05 N ATOM 852 CA GLU A 56 -4.464 4.373 9.673 1.00 21.52 C ATOM 853 C GLU A 56 -4.941 2.985 10.092 1.00 20.21 C ATOM 854 O GLU A 56 -5.039 2.077 9.268 1.00 71.43 O ATOM 855 CB GLU A 56 -2.947 4.476 9.846 1.00 70.14 C ATOM 856 CG GLU A 56 -2.170 3.461 9.024 1.00 75.22 C ATOM 857 CD GLU A 56 -0.775 3.940 8.672 1.00 33.42 C ATOM 858 OE1 GLU A 56 0.089 3.959 9.573 1.00 23.33 O ATOM 859 OE2 GLU A 56 -0.548 4.295 7.497 1.00 10.21 O ATOM 0 H GLU A 56 -4.559 5.827 11.181 1.00 33.05 H new ATOM 0 HA GLU A 56 -4.714 4.523 8.623 1.00 21.52 H new ATOM 0 HB2 GLU A 56 -2.625 5.479 9.567 1.00 70.14 H new ATOM 0 HB3 GLU A 56 -2.700 4.343 10.899 1.00 70.14 H new ATOM 0 HG2 GLU A 56 -2.099 2.526 9.580 1.00 75.22 H new ATOM 0 HG3 GLU A 56 -2.718 3.246 8.107 1.00 75.22 H new ATOM 866 N GLU A 57 -5.235 2.830 11.379 1.00 13.12 N ATOM 867 CA GLU A 57 -5.701 1.553 11.908 1.00 44.14 C ATOM 868 C GLU A 57 -7.171 1.327 11.569 1.00 53.53 C ATOM 869 O GLU A 57 -7.630 0.189 11.477 1.00 35.12 O ATOM 870 CB GLU A 57 -5.501 1.500 13.424 1.00 52.23 C ATOM 871 CG GLU A 57 -4.050 1.333 13.841 1.00 21.23 C ATOM 872 CD GLU A 57 -3.814 1.704 15.292 1.00 1.24 C ATOM 873 OE1 GLU A 57 -3.116 0.941 15.993 1.00 12.44 O ATOM 874 OE2 GLU A 57 -4.327 2.756 15.727 1.00 4.41 O ATOM 0 H GLU A 57 -5.159 3.572 12.074 1.00 13.12 H new ATOM 0 HA GLU A 57 -5.114 0.761 11.444 1.00 44.14 H new ATOM 0 HB2 GLU A 57 -5.894 2.415 13.866 1.00 52.23 H new ATOM 0 HB3 GLU A 57 -6.084 0.674 13.830 1.00 52.23 H new ATOM 0 HG2 GLU A 57 -3.746 0.299 13.680 1.00 21.23 H new ATOM 0 HG3 GLU A 57 -3.419 1.953 13.204 1.00 21.23 H new ATOM 881 N ARG A 58 -7.904 2.421 11.384 1.00 33.43 N ATOM 882 CA ARG A 58 -9.323 2.343 11.058 1.00 70.14 C ATOM 883 C ARG A 58 -9.528 2.214 9.551 1.00 23.50 C ATOM 884 O ARG A 58 -10.424 1.502 9.094 1.00 4.21 O ATOM 885 CB ARG A 58 -10.057 3.580 11.578 1.00 4.32 C ATOM 886 CG ARG A 58 -9.798 3.868 13.048 1.00 35.23 C ATOM 887 CD ARG A 58 -11.070 4.295 13.764 1.00 53.31 C ATOM 888 NE ARG A 58 -12.024 3.196 13.889 1.00 41.32 N ATOM 889 CZ ARG A 58 -11.949 2.261 14.829 1.00 3.33 C ATOM 890 NH1 ARG A 58 -10.969 2.292 15.723 1.00 54.14 N ATOM 891 NH2 ARG A 58 -12.855 1.293 14.878 1.00 65.13 N ATOM 0 H ARG A 58 -7.539 3.371 11.454 1.00 33.43 H new ATOM 0 HA ARG A 58 -9.732 1.456 11.541 1.00 70.14 H new ATOM 0 HB2 ARG A 58 -9.756 4.446 10.988 1.00 4.32 H new ATOM 0 HB3 ARG A 58 -11.128 3.448 11.426 1.00 4.32 H new ATOM 0 HG2 ARG A 58 -9.390 2.978 13.528 1.00 35.23 H new ATOM 0 HG3 ARG A 58 -9.047 4.652 13.139 1.00 35.23 H new ATOM 0 HD2 ARG A 58 -10.819 4.671 14.756 1.00 53.31 H new ATOM 0 HD3 ARG A 58 -11.534 5.117 13.219 1.00 53.31 H new ATOM 0 HE ARG A 58 -12.790 3.144 13.217 1.00 41.32 H new ATOM 0 HH11 ARG A 58 -10.271 3.035 15.689 1.00 54.14 H new ATOM 0 HH12 ARG A 58 -10.914 1.573 16.444 1.00 54.14 H new ATOM 0 HH21 ARG A 58 -13.610 1.266 14.193 1.00 65.13 H new ATOM 0 HH22 ARG A 58 -12.796 0.575 15.601 1.00 65.13 H new ATOM 905 N LEU A 59 -8.692 2.906 8.784 1.00 33.53 N ATOM 906 CA LEU A 59 -8.781 2.869 7.329 1.00 73.24 C ATOM 907 C LEU A 59 -7.720 1.944 6.741 1.00 2.24 C ATOM 908 O LEU A 59 -7.322 2.093 5.586 1.00 62.32 O ATOM 909 CB LEU A 59 -8.623 4.277 6.753 1.00 64.14 C ATOM 910 CG LEU A 59 -9.502 5.361 7.378 1.00 63.25 C ATOM 911 CD1 LEU A 59 -9.299 6.689 6.665 1.00 1.03 C ATOM 912 CD2 LEU A 59 -10.966 4.949 7.336 1.00 52.32 C ATOM 0 H LEU A 59 -7.945 3.499 9.146 1.00 33.53 H new ATOM 0 HA LEU A 59 -9.763 2.481 7.060 1.00 73.24 H new ATOM 0 HB2 LEU A 59 -7.580 4.577 6.860 1.00 64.14 H new ATOM 0 HB3 LEU A 59 -8.835 4.237 5.685 1.00 64.14 H new ATOM 0 HG LEU A 59 -9.209 5.484 8.421 1.00 63.25 H new ATOM 0 HD11 LEU A 59 -9.932 7.449 7.123 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -8.255 6.990 6.747 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -9.564 6.582 5.613 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -11.577 5.732 7.785 1.00 52.32 H new ATOM 0 HD22 LEU A 59 -11.272 4.798 6.301 1.00 52.32 H new ATOM 0 HD23 LEU A 59 -11.099 4.021 7.892 1.00 52.32 H new ATOM 1049 N LEU B 4 -2.815 43.686 14.072 1.00 0.33 N ATOM 1050 CA LEU B 4 -2.428 42.324 13.723 1.00 71.14 C ATOM 1051 C LEU B 4 -3.230 41.306 14.528 1.00 4.42 C ATOM 1052 O LEU B 4 -3.442 40.178 14.085 1.00 30.41 O ATOM 1053 CB LEU B 4 -0.932 42.119 13.966 1.00 42.31 C ATOM 1054 CG LEU B 4 -0.423 42.483 15.361 1.00 22.32 C ATOM 1055 CD1 LEU B 4 0.421 41.354 15.933 1.00 71.35 C ATOM 1056 CD2 LEU B 4 0.375 43.778 15.317 1.00 23.32 C ATOM 0 HA LEU B 4 -2.642 42.172 12.665 1.00 71.14 H new ATOM 0 HB2 LEU B 4 -0.693 41.073 13.776 1.00 42.31 H new ATOM 0 HB3 LEU B 4 -0.381 42.710 13.234 1.00 42.31 H new ATOM 0 HG LEU B 4 -1.284 42.632 16.013 1.00 22.32 H new ATOM 0 HD11 LEU B 4 0.774 41.631 16.926 1.00 71.35 H new ATOM 0 HD12 LEU B 4 -0.181 40.448 16.002 1.00 71.35 H new ATOM 0 HD13 LEU B 4 1.276 41.172 15.281 1.00 71.35 H new ATOM 0 HD21 LEU B 4 0.729 44.021 16.319 1.00 23.32 H new ATOM 0 HD22 LEU B 4 1.228 43.657 14.650 1.00 23.32 H new ATOM 0 HD23 LEU B 4 -0.260 44.585 14.951 1.00 23.32 H new ATOM 1068 N ARG B 5 -3.674 41.715 15.712 1.00 22.54 N ATOM 1069 CA ARG B 5 -4.453 40.839 16.579 1.00 30.13 C ATOM 1070 C ARG B 5 -5.742 40.400 15.891 1.00 32.32 C ATOM 1071 O ARG B 5 -6.200 39.272 16.073 1.00 14.30 O ATOM 1072 CB ARG B 5 -4.780 41.548 17.895 1.00 55.13 C ATOM 1073 CG ARG B 5 -4.014 41.002 19.088 1.00 1.22 C ATOM 1074 CD ARG B 5 -3.543 42.119 20.006 1.00 12.42 C ATOM 1075 NE ARG B 5 -2.089 42.253 20.005 1.00 41.14 N ATOM 1076 CZ ARG B 5 -1.274 41.428 20.653 1.00 13.42 C ATOM 1077 NH1 ARG B 5 -1.769 40.416 21.352 1.00 72.25 N ATOM 1078 NH2 ARG B 5 0.038 41.615 20.604 1.00 44.43 N ATOM 0 H ARG B 5 -3.508 42.647 16.093 1.00 22.54 H new ATOM 0 HA ARG B 5 -3.855 39.953 16.791 1.00 30.13 H new ATOM 0 HB2 ARG B 5 -4.562 42.611 17.789 1.00 55.13 H new ATOM 0 HB3 ARG B 5 -5.849 41.460 18.089 1.00 55.13 H new ATOM 0 HG2 ARG B 5 -4.650 40.314 19.646 1.00 1.22 H new ATOM 0 HG3 ARG B 5 -3.155 40.430 18.739 1.00 1.22 H new ATOM 0 HD2 ARG B 5 -3.994 43.060 19.692 1.00 12.42 H new ATOM 0 HD3 ARG B 5 -3.888 41.923 21.021 1.00 12.42 H new ATOM 0 HE ARG B 5 -1.676 43.022 19.478 1.00 41.14 H new ATOM 0 HH11 ARG B 5 -2.778 40.270 21.393 1.00 72.25 H new ATOM 0 HH12 ARG B 5 -1.141 39.784 21.849 1.00 72.25 H new ATOM 0 HH21 ARG B 5 0.423 42.393 20.068 1.00 44.43 H new ATOM 0 HH22 ARG B 5 0.663 40.981 21.102 1.00 44.43 H new ATOM 1092 N GLU B 6 -6.321 41.299 15.101 1.00 34.45 N ATOM 1093 CA GLU B 6 -7.558 41.003 14.388 1.00 52.42 C ATOM 1094 C GLU B 6 -7.331 39.931 13.326 1.00 11.02 C ATOM 1095 O GLU B 6 -8.221 39.132 13.037 1.00 60.02 O ATOM 1096 CB GLU B 6 -8.113 42.272 13.736 1.00 4.15 C ATOM 1097 CG GLU B 6 -8.545 43.331 14.737 1.00 61.11 C ATOM 1098 CD GLU B 6 -8.844 44.665 14.081 1.00 11.25 C ATOM 1099 OE1 GLU B 6 -9.738 44.710 13.210 1.00 10.34 O ATOM 1100 OE2 GLU B 6 -8.185 45.664 14.439 1.00 20.40 O ATOM 0 H GLU B 6 -5.954 42.237 14.939 1.00 34.45 H new ATOM 0 HA GLU B 6 -8.282 40.627 15.110 1.00 52.42 H new ATOM 0 HB2 GLU B 6 -7.354 42.694 13.078 1.00 4.15 H new ATOM 0 HB3 GLU B 6 -8.965 42.006 13.110 1.00 4.15 H new ATOM 0 HG2 GLU B 6 -9.432 42.984 15.267 1.00 61.11 H new ATOM 0 HG3 GLU B 6 -7.760 43.464 15.481 1.00 61.11 H new ATOM 1107 N GLU B 7 -6.133 39.922 12.750 1.00 73.34 N ATOM 1108 CA GLU B 7 -5.790 38.949 11.719 1.00 21.21 C ATOM 1109 C GLU B 7 -5.562 37.568 12.328 1.00 0.44 C ATOM 1110 O GLU B 7 -5.890 36.549 11.722 1.00 30.03 O ATOM 1111 CB GLU B 7 -4.539 39.396 10.961 1.00 43.45 C ATOM 1112 CG GLU B 7 -4.757 39.552 9.465 1.00 63.21 C ATOM 1113 CD GLU B 7 -4.550 40.977 8.990 1.00 15.12 C ATOM 1114 OE1 GLU B 7 -3.638 41.202 8.168 1.00 61.44 O ATOM 1115 OE2 GLU B 7 -5.301 41.868 9.441 1.00 23.41 O ATOM 0 H GLU B 7 -5.385 40.576 12.979 1.00 73.34 H new ATOM 0 HA GLU B 7 -6.626 38.887 11.022 1.00 21.21 H new ATOM 0 HB2 GLU B 7 -4.196 40.346 11.371 1.00 43.45 H new ATOM 0 HB3 GLU B 7 -3.743 38.670 11.130 1.00 43.45 H new ATOM 0 HG2 GLU B 7 -4.073 38.892 8.931 1.00 63.21 H new ATOM 0 HG3 GLU B 7 -5.769 39.233 9.214 1.00 63.21 H new ATOM 1122 N ALA B 8 -4.997 37.545 13.531 1.00 31.01 N ATOM 1123 CA ALA B 8 -4.726 36.291 14.224 1.00 53.34 C ATOM 1124 C ALA B 8 -6.016 35.524 14.494 1.00 61.44 C ATOM 1125 O ALA B 8 -6.086 34.314 14.277 1.00 13.25 O ATOM 1126 CB ALA B 8 -3.985 36.557 15.526 1.00 74.13 C ATOM 0 H ALA B 8 -4.718 38.380 14.046 1.00 31.01 H new ATOM 0 HA ALA B 8 -4.097 35.677 13.580 1.00 53.34 H new ATOM 0 HB1 ALA B 8 -3.789 35.612 16.033 1.00 74.13 H new ATOM 0 HB2 ALA B 8 -3.040 37.056 15.311 1.00 74.13 H new ATOM 0 HB3 ALA B 8 -4.594 37.194 16.168 1.00 74.13 H new ATOM 1132 N ALA B 9 -7.034 36.234 14.968 1.00 41.31 N ATOM 1133 CA ALA B 9 -8.321 35.620 15.266 1.00 34.51 C ATOM 1134 C ALA B 9 -8.931 34.989 14.019 1.00 41.14 C ATOM 1135 O ALA B 9 -9.480 33.888 14.071 1.00 12.53 O ATOM 1136 CB ALA B 9 -9.273 36.648 15.859 1.00 40.55 C ATOM 0 H ALA B 9 -6.992 37.236 15.154 1.00 41.31 H new ATOM 0 HA ALA B 9 -8.156 34.829 15.998 1.00 34.51 H new ATOM 0 HB1 ALA B 9 -10.230 36.174 16.076 1.00 40.55 H new ATOM 0 HB2 ALA B 9 -8.849 37.048 16.780 1.00 40.55 H new ATOM 0 HB3 ALA B 9 -9.423 37.459 15.146 1.00 40.55 H new ATOM 1142 N LYS B 10 -8.831 35.694 12.896 1.00 33.35 N ATOM 1143 CA LYS B 10 -9.372 35.204 11.634 1.00 31.52 C ATOM 1144 C LYS B 10 -8.525 34.059 11.087 1.00 1.12 C ATOM 1145 O LYS B 10 -9.043 33.134 10.460 1.00 52.31 O ATOM 1146 CB LYS B 10 -9.438 36.338 10.609 1.00 15.13 C ATOM 1147 CG LYS B 10 -10.314 36.023 9.409 1.00 65.45 C ATOM 1148 CD LYS B 10 -11.644 36.753 9.481 1.00 41.12 C ATOM 1149 CE LYS B 10 -12.795 35.858 9.050 1.00 75.15 C ATOM 1150 NZ LYS B 10 -14.108 36.371 9.531 1.00 3.43 N ATOM 0 H LYS B 10 -8.380 36.607 12.835 1.00 33.35 H new ATOM 0 HA LYS B 10 -10.379 34.831 11.820 1.00 31.52 H new ATOM 0 HB2 LYS B 10 -9.815 37.237 11.098 1.00 15.13 H new ATOM 0 HB3 LYS B 10 -8.429 36.563 10.263 1.00 15.13 H new ATOM 0 HG2 LYS B 10 -9.793 36.304 8.494 1.00 65.45 H new ATOM 0 HG3 LYS B 10 -10.490 34.949 9.358 1.00 65.45 H new ATOM 0 HD2 LYS B 10 -11.814 37.101 10.500 1.00 41.12 H new ATOM 0 HD3 LYS B 10 -11.610 37.636 8.843 1.00 41.12 H new ATOM 0 HE2 LYS B 10 -12.810 35.785 7.963 1.00 75.15 H new ATOM 0 HE3 LYS B 10 -12.636 34.851 9.435 1.00 75.15 H new ATOM 0 HZ1 LYS B 10 -14.866 35.733 9.216 1.00 3.43 H new ATOM 0 HZ2 LYS B 10 -14.103 36.417 10.570 1.00 3.43 H new ATOM 0 HZ3 LYS B 10 -14.272 37.322 9.143 1.00 3.43 H new ATOM 1164 N LEU B 11 -7.221 34.126 11.330 1.00 44.44 N ATOM 1165 CA LEU B 11 -6.301 33.095 10.862 1.00 33.54 C ATOM 1166 C LEU B 11 -6.779 31.709 11.284 1.00 62.51 C ATOM 1167 O LEU B 11 -6.654 30.742 10.531 1.00 11.05 O ATOM 1168 CB LEU B 11 -4.896 33.350 11.409 1.00 2.42 C ATOM 1169 CG LEU B 11 -3.831 32.319 11.033 1.00 12.21 C ATOM 1170 CD1 LEU B 11 -3.116 32.732 9.756 1.00 70.20 C ATOM 1171 CD2 LEU B 11 -2.836 32.141 12.170 1.00 2.13 C ATOM 0 H LEU B 11 -6.777 34.884 11.849 1.00 44.44 H new ATOM 0 HA LEU B 11 -6.272 33.135 9.773 1.00 33.54 H new ATOM 0 HB2 LEU B 11 -4.565 34.328 11.061 1.00 2.42 H new ATOM 0 HB3 LEU B 11 -4.955 33.402 12.496 1.00 2.42 H new ATOM 0 HG LEU B 11 -4.324 31.363 10.856 1.00 12.21 H new ATOM 0 HD11 LEU B 11 -2.362 31.987 9.504 1.00 70.20 H new ATOM 0 HD12 LEU B 11 -3.838 32.807 8.943 1.00 70.20 H new ATOM 0 HD13 LEU B 11 -2.635 33.699 9.905 1.00 70.20 H new ATOM 0 HD21 LEU B 11 -2.086 31.404 11.885 1.00 2.13 H new ATOM 0 HD22 LEU B 11 -2.348 33.093 12.379 1.00 2.13 H new ATOM 0 HD23 LEU B 11 -3.360 31.798 13.062 1.00 2.13 H new ATOM 1183 N PHE B 12 -7.328 31.619 12.491 1.00 42.22 N ATOM 1184 CA PHE B 12 -7.826 30.352 13.012 1.00 23.43 C ATOM 1185 C PHE B 12 -8.947 29.805 12.134 1.00 55.20 C ATOM 1186 O PHE B 12 -9.042 28.599 11.910 1.00 31.01 O ATOM 1187 CB PHE B 12 -8.326 30.528 14.447 1.00 30.45 C ATOM 1188 CG PHE B 12 -8.088 29.326 15.317 1.00 73.03 C ATOM 1189 CD1 PHE B 12 -8.644 28.099 14.993 1.00 54.13 C ATOM 1190 CD2 PHE B 12 -7.309 29.424 16.458 1.00 31.43 C ATOM 1191 CE1 PHE B 12 -8.427 26.991 15.790 1.00 14.22 C ATOM 1192 CE2 PHE B 12 -7.088 28.319 17.259 1.00 12.34 C ATOM 1193 CZ PHE B 12 -7.649 27.102 16.926 1.00 60.13 C ATOM 0 H PHE B 12 -7.439 32.409 13.127 1.00 42.22 H new ATOM 0 HA PHE B 12 -7.003 29.637 13.006 1.00 23.43 H new ATOM 0 HB2 PHE B 12 -7.832 31.392 14.892 1.00 30.45 H new ATOM 0 HB3 PHE B 12 -9.394 30.746 14.427 1.00 30.45 H new ATOM 0 HD1 PHE B 12 -9.254 28.007 14.107 1.00 54.13 H new ATOM 0 HD2 PHE B 12 -6.870 30.374 16.725 1.00 31.43 H new ATOM 0 HE1 PHE B 12 -8.865 26.040 15.525 1.00 14.22 H new ATOM 0 HE2 PHE B 12 -6.477 28.408 18.145 1.00 12.34 H new ATOM 0 HZ PHE B 12 -7.480 26.239 17.552 1.00 60.13 H new ATOM 1203 N GLU B 13 -9.795 30.703 11.640 1.00 30.43 N ATOM 1204 CA GLU B 13 -10.911 30.310 10.788 1.00 51.10 C ATOM 1205 C GLU B 13 -10.410 29.690 9.487 1.00 52.34 C ATOM 1206 O GLU B 13 -11.004 28.745 8.969 1.00 52.32 O ATOM 1207 CB GLU B 13 -11.798 31.519 10.482 1.00 44.13 C ATOM 1208 CG GLU B 13 -13.273 31.275 10.749 1.00 74.14 C ATOM 1209 CD GLU B 13 -13.891 32.342 11.632 1.00 62.40 C ATOM 1210 OE1 GLU B 13 -14.532 31.978 12.640 1.00 30.12 O ATOM 1211 OE2 GLU B 13 -13.733 33.539 11.316 1.00 53.15 O ATOM 0 H GLU B 13 -9.730 31.706 11.815 1.00 30.43 H new ATOM 0 HA GLU B 13 -11.498 29.564 11.323 1.00 51.10 H new ATOM 0 HB2 GLU B 13 -11.464 32.365 11.082 1.00 44.13 H new ATOM 0 HB3 GLU B 13 -11.668 31.799 9.437 1.00 44.13 H new ATOM 0 HG2 GLU B 13 -13.809 31.239 9.800 1.00 74.14 H new ATOM 0 HG3 GLU B 13 -13.396 30.301 11.222 1.00 74.14 H new ATOM 1218 N GLU B 14 -9.314 30.231 8.964 1.00 23.32 N ATOM 1219 CA GLU B 14 -8.734 29.732 7.723 1.00 62.32 C ATOM 1220 C GLU B 14 -8.527 28.221 7.788 1.00 41.24 C ATOM 1221 O GLU B 14 -8.982 27.484 6.913 1.00 30.22 O ATOM 1222 CB GLU B 14 -7.401 30.428 7.440 1.00 12.41 C ATOM 1223 CG GLU B 14 -7.104 30.596 5.959 1.00 21.45 C ATOM 1224 CD GLU B 14 -6.424 31.914 5.646 1.00 1.33 C ATOM 1225 OE1 GLU B 14 -7.078 32.789 5.039 1.00 25.44 O ATOM 1226 OE2 GLU B 14 -5.239 32.072 6.007 1.00 11.03 O ATOM 0 H GLU B 14 -8.810 31.014 9.380 1.00 23.32 H new ATOM 0 HA GLU B 14 -9.430 29.952 6.913 1.00 62.32 H new ATOM 0 HB2 GLU B 14 -7.405 31.409 7.915 1.00 12.41 H new ATOM 0 HB3 GLU B 14 -6.596 29.855 7.900 1.00 12.41 H new ATOM 0 HG2 GLU B 14 -6.469 29.776 5.624 1.00 21.45 H new ATOM 0 HG3 GLU B 14 -8.035 30.529 5.396 1.00 21.45 H new ATOM 1233 N TRP B 15 -7.837 27.769 8.828 1.00 33.15 N ATOM 1234 CA TRP B 15 -7.569 26.346 9.008 1.00 51.54 C ATOM 1235 C TRP B 15 -8.783 25.633 9.593 1.00 2.21 C ATOM 1236 O TRP B 15 -9.172 24.563 9.126 1.00 64.51 O ATOM 1237 CB TRP B 15 -6.356 26.146 9.918 1.00 71.15 C ATOM 1238 CG TRP B 15 -6.478 24.951 10.815 1.00 44.43 C ATOM 1239 CD1 TRP B 15 -6.759 23.669 10.438 1.00 2.15 C ATOM 1240 CD2 TRP B 15 -6.324 24.930 12.238 1.00 65.51 C ATOM 1241 NE1 TRP B 15 -6.789 22.851 11.542 1.00 1.23 N ATOM 1242 CE2 TRP B 15 -6.524 23.600 12.658 1.00 12.12 C ATOM 1243 CE3 TRP B 15 -6.034 25.903 13.198 1.00 63.21 C ATOM 1244 CZ2 TRP B 15 -6.445 23.223 13.996 1.00 20.31 C ATOM 1245 CZ3 TRP B 15 -5.956 25.527 14.525 1.00 23.33 C ATOM 1246 CH2 TRP B 15 -6.160 24.196 14.915 1.00 41.24 C ATOM 0 H TRP B 15 -7.453 28.366 9.560 1.00 33.15 H new ATOM 0 HA TRP B 15 -7.355 25.915 8.030 1.00 51.54 H new ATOM 0 HB2 TRP B 15 -5.463 26.040 9.303 1.00 71.15 H new ATOM 0 HB3 TRP B 15 -6.218 27.038 10.529 1.00 71.15 H new ATOM 0 HD1 TRP B 15 -6.932 23.346 9.422 1.00 2.15 H new ATOM 0 HE1 TRP B 15 -6.978 21.849 11.532 1.00 1.23 H new ATOM 0 HE3 TRP B 15 -5.874 26.931 12.908 1.00 63.21 H new ATOM 0 HZ2 TRP B 15 -6.603 22.198 14.298 1.00 20.31 H new ATOM 0 HZ3 TRP B 15 -5.734 26.272 15.275 1.00 23.33 H new ATOM 0 HH2 TRP B 15 -6.091 23.934 15.960 1.00 41.24 H new ATOM 1257 N LYS B 16 -9.378 26.233 10.618 1.00 34.34 N ATOM 1258 CA LYS B 16 -10.550 25.656 11.268 1.00 64.25 C ATOM 1259 C LYS B 16 -11.633 25.330 10.245 1.00 71.54 C ATOM 1260 O LYS B 16 -12.429 24.411 10.439 1.00 32.35 O ATOM 1261 CB LYS B 16 -11.101 26.620 12.321 1.00 71.54 C ATOM 1262 CG LYS B 16 -12.454 26.206 12.874 1.00 1.41 C ATOM 1263 CD LYS B 16 -13.593 26.851 12.102 1.00 2.43 C ATOM 1264 CE LYS B 16 -14.725 25.867 11.854 1.00 55.11 C ATOM 1265 NZ LYS B 16 -16.059 26.481 12.106 1.00 63.31 N ATOM 0 H LYS B 16 -9.068 27.119 11.017 1.00 34.34 H new ATOM 0 HA LYS B 16 -10.245 24.730 11.756 1.00 64.25 H new ATOM 0 HB2 LYS B 16 -10.389 26.693 13.143 1.00 71.54 H new ATOM 0 HB3 LYS B 16 -11.186 27.614 11.883 1.00 71.54 H new ATOM 0 HG2 LYS B 16 -12.550 25.121 12.828 1.00 1.41 H new ATOM 0 HG3 LYS B 16 -12.520 26.488 13.925 1.00 1.41 H new ATOM 0 HD2 LYS B 16 -13.971 27.709 12.658 1.00 2.43 H new ATOM 0 HD3 LYS B 16 -13.221 27.227 11.149 1.00 2.43 H new ATOM 0 HE2 LYS B 16 -14.678 25.511 10.825 1.00 55.11 H new ATOM 0 HE3 LYS B 16 -14.598 24.997 12.499 1.00 55.11 H new ATOM 0 HZ1 LYS B 16 -16.804 25.778 11.926 1.00 63.31 H new ATOM 0 HZ2 LYS B 16 -16.114 26.798 13.095 1.00 63.31 H new ATOM 0 HZ3 LYS B 16 -16.191 27.296 11.473 1.00 63.31 H new ATOM 1279 N LYS B 17 -11.657 26.087 9.153 1.00 33.12 N ATOM 1280 CA LYS B 17 -12.641 25.877 8.097 1.00 1.24 C ATOM 1281 C LYS B 17 -12.334 24.605 7.313 1.00 15.32 C ATOM 1282 O LYS B 17 -13.233 23.820 7.009 1.00 71.30 O ATOM 1283 CB LYS B 17 -12.667 27.079 7.150 1.00 10.15 C ATOM 1284 CG LYS B 17 -13.724 26.975 6.065 1.00 61.15 C ATOM 1285 CD LYS B 17 -14.023 28.330 5.446 1.00 52.11 C ATOM 1286 CE LYS B 17 -12.824 28.872 4.684 1.00 63.04 C ATOM 1287 NZ LYS B 17 -13.159 30.112 3.931 1.00 51.41 N ATOM 0 H LYS B 17 -11.006 26.852 8.976 1.00 33.12 H new ATOM 0 HA LYS B 17 -13.620 25.768 8.563 1.00 1.24 H new ATOM 0 HB2 LYS B 17 -12.842 27.985 7.731 1.00 10.15 H new ATOM 0 HB3 LYS B 17 -11.688 27.184 6.683 1.00 10.15 H new ATOM 0 HG2 LYS B 17 -13.385 26.287 5.290 1.00 61.15 H new ATOM 0 HG3 LYS B 17 -14.638 26.556 6.485 1.00 61.15 H new ATOM 0 HD2 LYS B 17 -14.875 28.243 4.772 1.00 52.11 H new ATOM 0 HD3 LYS B 17 -14.307 29.034 6.228 1.00 52.11 H new ATOM 0 HE2 LYS B 17 -12.013 29.079 5.383 1.00 63.04 H new ATOM 0 HE3 LYS B 17 -12.461 28.113 3.991 1.00 63.04 H new ATOM 0 HZ1 LYS B 17 -12.315 30.450 3.425 1.00 51.41 H new ATOM 0 HZ2 LYS B 17 -13.915 29.909 3.246 1.00 51.41 H new ATOM 0 HZ3 LYS B 17 -13.481 30.845 4.595 1.00 51.41 H new ATOM 1301 N LEU B 18 -11.061 24.407 6.990 1.00 53.42 N ATOM 1302 CA LEU B 18 -10.636 23.229 6.242 1.00 11.20 C ATOM 1303 C LEU B 18 -11.013 21.950 6.982 1.00 60.44 C ATOM 1304 O LEU B 18 -11.453 20.975 6.372 1.00 10.30 O ATOM 1305 CB LEU B 18 -9.125 23.269 6.005 1.00 33.14 C ATOM 1306 CG LEU B 18 -8.666 23.945 4.713 1.00 21.20 C ATOM 1307 CD1 LEU B 18 -9.027 23.092 3.507 1.00 62.40 C ATOM 1308 CD2 LEU B 18 -9.279 25.332 4.590 1.00 43.23 C ATOM 0 H LEU B 18 -10.305 25.047 7.234 1.00 53.42 H new ATOM 0 HA LEU B 18 -11.148 23.235 5.280 1.00 11.20 H new ATOM 0 HB2 LEU B 18 -8.659 23.783 6.846 1.00 33.14 H new ATOM 0 HB3 LEU B 18 -8.750 22.246 6.009 1.00 33.14 H new ATOM 0 HG LEU B 18 -7.582 24.050 4.746 1.00 21.20 H new ATOM 0 HD11 LEU B 18 -8.693 23.589 2.596 1.00 62.40 H new ATOM 0 HD12 LEU B 18 -8.540 22.120 3.590 1.00 62.40 H new ATOM 0 HD13 LEU B 18 -10.108 22.954 3.469 1.00 62.40 H new ATOM 0 HD21 LEU B 18 -8.941 25.798 3.664 1.00 43.23 H new ATOM 0 HD22 LEU B 18 -10.366 25.250 4.579 1.00 43.23 H new ATOM 0 HD23 LEU B 18 -8.970 25.943 5.438 1.00 43.23 H new ATOM 1320 N ALA B 19 -10.839 21.961 8.299 1.00 32.41 N ATOM 1321 CA ALA B 19 -11.165 20.803 9.122 1.00 31.24 C ATOM 1322 C ALA B 19 -12.645 20.452 9.015 1.00 32.11 C ATOM 1323 O ALA B 19 -13.010 19.279 8.935 1.00 44.45 O ATOM 1324 CB ALA B 19 -10.786 21.063 10.573 1.00 52.02 C ATOM 0 H ALA B 19 -10.474 22.759 8.819 1.00 32.41 H new ATOM 0 HA ALA B 19 -10.590 19.954 8.754 1.00 31.24 H new ATOM 0 HB1 ALA B 19 -11.035 20.190 11.176 1.00 52.02 H new ATOM 0 HB2 ALA B 19 -9.716 21.257 10.640 1.00 52.02 H new ATOM 0 HB3 ALA B 19 -11.336 21.928 10.943 1.00 52.02 H new ATOM 1330 N GLU B 20 -13.493 21.476 9.015 1.00 20.13 N ATOM 1331 CA GLU B 20 -14.934 21.274 8.919 1.00 21.35 C ATOM 1332 C GLU B 20 -15.324 20.795 7.524 1.00 35.12 C ATOM 1333 O GLU B 20 -16.306 20.072 7.358 1.00 52.03 O ATOM 1334 CB GLU B 20 -15.676 22.570 9.252 1.00 33.44 C ATOM 1335 CG GLU B 20 -17.177 22.487 9.027 1.00 63.40 C ATOM 1336 CD GLU B 20 -17.949 23.482 9.871 1.00 73.14 C ATOM 1337 OE1 GLU B 20 -18.576 23.056 10.864 1.00 51.44 O ATOM 1338 OE2 GLU B 20 -17.928 24.685 9.538 1.00 4.23 O ATOM 0 H GLU B 20 -13.207 22.453 9.080 1.00 20.13 H new ATOM 0 HA GLU B 20 -15.217 20.507 9.640 1.00 21.35 H new ATOM 0 HB2 GLU B 20 -15.487 22.830 10.294 1.00 33.44 H new ATOM 0 HB3 GLU B 20 -15.270 23.378 8.643 1.00 33.44 H new ATOM 0 HG2 GLU B 20 -17.393 22.665 7.974 1.00 63.40 H new ATOM 0 HG3 GLU B 20 -17.520 21.478 9.257 1.00 63.40 H new ATOM 1345 N GLU B 21 -14.549 21.205 6.526 1.00 65.45 N ATOM 1346 CA GLU B 21 -14.814 20.819 5.145 1.00 74.33 C ATOM 1347 C GLU B 21 -14.449 19.356 4.909 1.00 73.13 C ATOM 1348 O GLU B 21 -15.098 18.662 4.127 1.00 72.41 O ATOM 1349 CB GLU B 21 -14.031 21.713 4.182 1.00 44.11 C ATOM 1350 CG GLU B 21 -14.638 21.790 2.791 1.00 30.42 C ATOM 1351 CD GLU B 21 -15.788 22.775 2.710 1.00 21.32 C ATOM 1352 OE1 GLU B 21 -15.523 23.995 2.707 1.00 14.41 O ATOM 1353 OE2 GLU B 21 -16.951 22.326 2.650 1.00 35.23 O ATOM 0 H GLU B 21 -13.733 21.804 6.647 1.00 65.45 H new ATOM 0 HA GLU B 21 -15.881 20.944 4.959 1.00 74.33 H new ATOM 0 HB2 GLU B 21 -13.972 22.718 4.600 1.00 44.11 H new ATOM 0 HB3 GLU B 21 -13.010 21.340 4.103 1.00 44.11 H new ATOM 0 HG2 GLU B 21 -13.866 22.079 2.077 1.00 30.42 H new ATOM 0 HG3 GLU B 21 -14.990 20.801 2.497 1.00 30.42 H new ATOM 1360 N ALA B 22 -13.405 18.895 5.590 1.00 14.43 N ATOM 1361 CA ALA B 22 -12.954 17.516 5.457 1.00 73.24 C ATOM 1362 C ALA B 22 -13.973 16.546 6.045 1.00 22.44 C ATOM 1363 O ALA B 22 -14.122 15.421 5.567 1.00 4.53 O ATOM 1364 CB ALA B 22 -11.601 17.336 6.129 1.00 71.44 C ATOM 0 H ALA B 22 -12.856 19.457 6.240 1.00 14.43 H new ATOM 0 HA ALA B 22 -12.852 17.294 4.395 1.00 73.24 H new ATOM 0 HB1 ALA B 22 -11.276 16.301 6.022 1.00 71.44 H new ATOM 0 HB2 ALA B 22 -10.871 17.996 5.660 1.00 71.44 H new ATOM 0 HB3 ALA B 22 -11.685 17.582 7.188 1.00 71.44 H new ATOM 1370 N ALA B 23 -14.671 16.988 7.086 1.00 32.41 N ATOM 1371 CA ALA B 23 -15.677 16.158 7.739 1.00 4.50 C ATOM 1372 C ALA B 23 -16.769 15.745 6.758 1.00 4.12 C ATOM 1373 O ALA B 23 -17.330 14.654 6.862 1.00 54.44 O ATOM 1374 CB ALA B 23 -16.281 16.897 8.924 1.00 21.22 C ATOM 0 H ALA B 23 -14.559 17.916 7.495 1.00 32.41 H new ATOM 0 HA ALA B 23 -15.188 15.253 8.099 1.00 4.50 H new ATOM 0 HB1 ALA B 23 -17.030 16.266 9.402 1.00 21.22 H new ATOM 0 HB2 ALA B 23 -15.496 17.136 9.642 1.00 21.22 H new ATOM 0 HB3 ALA B 23 -16.750 17.818 8.578 1.00 21.22 H new ATOM 1380 N LYS B 24 -17.066 16.623 5.806 1.00 1.34 N ATOM 1381 CA LYS B 24 -18.091 16.350 4.806 1.00 44.23 C ATOM 1382 C LYS B 24 -17.595 15.334 3.782 1.00 25.44 C ATOM 1383 O LYS B 24 -18.374 14.542 3.250 1.00 11.22 O ATOM 1384 CB LYS B 24 -18.499 17.644 4.098 1.00 11.21 C ATOM 1385 CG LYS B 24 -19.120 18.675 5.025 1.00 22.34 C ATOM 1386 CD LYS B 24 -18.903 20.089 4.512 1.00 35.54 C ATOM 1387 CE LYS B 24 -19.954 21.045 5.055 1.00 53.12 C ATOM 1388 NZ LYS B 24 -19.800 21.266 6.519 1.00 33.45 N ATOM 0 H LYS B 24 -16.611 17.530 5.706 1.00 1.34 H new ATOM 0 HA LYS B 24 -18.959 15.932 5.316 1.00 44.23 H new ATOM 0 HB2 LYS B 24 -17.621 18.079 3.620 1.00 11.21 H new ATOM 0 HB3 LYS B 24 -19.208 17.406 3.305 1.00 11.21 H new ATOM 0 HG2 LYS B 24 -20.188 18.482 5.122 1.00 22.34 H new ATOM 0 HG3 LYS B 24 -18.687 18.578 6.021 1.00 22.34 H new ATOM 0 HD2 LYS B 24 -17.911 20.434 4.802 1.00 35.54 H new ATOM 0 HD3 LYS B 24 -18.936 20.091 3.422 1.00 35.54 H new ATOM 0 HE2 LYS B 24 -19.880 22.000 4.534 1.00 53.12 H new ATOM 0 HE3 LYS B 24 -20.948 20.646 4.851 1.00 53.12 H new ATOM 0 HZ1 LYS B 24 -20.535 21.923 6.850 1.00 33.45 H new ATOM 0 HZ2 LYS B 24 -19.896 20.359 7.019 1.00 33.45 H new ATOM 0 HZ3 LYS B 24 -18.862 21.670 6.712 1.00 33.45 H new ATOM 1402 N LEU B 25 -16.294 15.359 3.512 1.00 11.24 N ATOM 1403 CA LEU B 25 -15.694 14.438 2.554 1.00 45.24 C ATOM 1404 C LEU B 25 -15.562 13.040 3.150 1.00 54.41 C ATOM 1405 O LEU B 25 -15.661 12.039 2.439 1.00 22.05 O ATOM 1406 CB LEU B 25 -14.320 14.950 2.117 1.00 24.21 C ATOM 1407 CG LEU B 25 -14.280 15.726 0.800 1.00 3.25 C ATOM 1408 CD1 LEU B 25 -13.776 17.142 1.031 1.00 44.40 C ATOM 1409 CD2 LEU B 25 -13.407 15.006 -0.217 1.00 4.30 C ATOM 0 H LEU B 25 -15.635 16.007 3.943 1.00 11.24 H new ATOM 0 HA LEU B 25 -16.348 14.381 1.684 1.00 45.24 H new ATOM 0 HB2 LEU B 25 -13.926 15.591 2.905 1.00 24.21 H new ATOM 0 HB3 LEU B 25 -13.646 14.097 2.033 1.00 24.21 H new ATOM 0 HG LEU B 25 -15.293 15.783 0.403 1.00 3.25 H new ATOM 0 HD11 LEU B 25 -13.754 17.680 0.083 1.00 44.40 H new ATOM 0 HD12 LEU B 25 -14.441 17.656 1.725 1.00 44.40 H new ATOM 0 HD13 LEU B 25 -12.771 17.106 1.451 1.00 44.40 H new ATOM 0 HD21 LEU B 25 -13.390 15.573 -1.148 1.00 4.30 H new ATOM 0 HD22 LEU B 25 -12.393 14.917 0.172 1.00 4.30 H new ATOM 0 HD23 LEU B 25 -13.812 14.012 -0.405 1.00 4.30 H new ATOM 1421 N LEU B 26 -15.342 12.979 4.458 1.00 11.55 N ATOM 1422 CA LEU B 26 -15.200 11.704 5.152 1.00 60.22 C ATOM 1423 C LEU B 26 -16.553 11.019 5.314 1.00 30.42 C ATOM 1424 O LEU B 26 -16.649 9.793 5.259 1.00 3.04 O ATOM 1425 CB LEU B 26 -14.555 11.915 6.523 1.00 42.14 C ATOM 1426 CG LEU B 26 -13.110 11.435 6.666 1.00 72.33 C ATOM 1427 CD1 LEU B 26 -12.150 12.440 6.050 1.00 3.42 C ATOM 1428 CD2 LEU B 26 -12.770 11.196 8.130 1.00 41.44 C ATOM 0 H LEU B 26 -15.258 13.798 5.060 1.00 11.55 H new ATOM 0 HA LEU B 26 -14.557 11.061 4.551 1.00 60.22 H new ATOM 0 HB2 LEU B 26 -14.588 12.979 6.758 1.00 42.14 H new ATOM 0 HB3 LEU B 26 -15.162 11.404 7.270 1.00 42.14 H new ATOM 0 HG LEU B 26 -13.006 10.491 6.131 1.00 72.33 H new ATOM 0 HD11 LEU B 26 -11.127 12.081 6.161 1.00 3.42 H new ATOM 0 HD12 LEU B 26 -12.379 12.560 4.991 1.00 3.42 H new ATOM 0 HD13 LEU B 26 -12.255 13.400 6.555 1.00 3.42 H new ATOM 0 HD21 LEU B 26 -11.738 10.855 8.213 1.00 41.44 H new ATOM 0 HD22 LEU B 26 -12.891 12.125 8.688 1.00 41.44 H new ATOM 0 HD23 LEU B 26 -13.437 10.437 8.539 1.00 41.44 H new ATOM 1440 N GLU B 27 -17.596 11.819 5.512 1.00 70.30 N ATOM 1441 CA GLU B 27 -18.944 11.288 5.681 1.00 42.35 C ATOM 1442 C GLU B 27 -19.628 11.102 4.329 1.00 20.44 C ATOM 1443 O GLU B 27 -20.525 10.273 4.185 1.00 74.40 O ATOM 1444 CB GLU B 27 -19.777 12.222 6.562 1.00 63.43 C ATOM 1445 CG GLU B 27 -20.207 13.498 5.859 1.00 10.43 C ATOM 1446 CD GLU B 27 -21.653 13.455 5.405 1.00 11.52 C ATOM 1447 OE1 GLU B 27 -22.492 14.133 6.035 1.00 53.23 O ATOM 1448 OE2 GLU B 27 -21.946 12.745 4.421 1.00 22.53 O ATOM 0 H GLU B 27 -17.534 12.836 5.559 1.00 70.30 H new ATOM 0 HA GLU B 27 -18.866 10.315 6.167 1.00 42.35 H new ATOM 0 HB2 GLU B 27 -20.664 11.689 6.905 1.00 63.43 H new ATOM 0 HB3 GLU B 27 -19.199 12.483 7.449 1.00 63.43 H new ATOM 0 HG2 GLU B 27 -20.066 14.344 6.532 1.00 10.43 H new ATOM 0 HG3 GLU B 27 -19.564 13.667 4.995 1.00 10.43 H new ATOM 1455 N GLY B 28 -19.197 11.880 3.341 1.00 2.25 N ATOM 1456 CA GLY B 28 -19.778 11.786 2.015 1.00 14.52 C ATOM 1457 C GLY B 28 -19.788 10.366 1.486 1.00 53.34 C ATOM 1458 O GLY B 28 -20.641 10.004 0.676 1.00 44.34 O ATOM 0 H GLY B 28 -18.455 12.574 3.436 1.00 2.25 H new ATOM 0 HA2 GLY B 28 -20.799 12.168 2.041 1.00 14.52 H new ATOM 0 HA3 GLY B 28 -19.217 12.422 1.330 1.00 14.52 H new ATOM 1504 N GLY B 35 -22.790 9.052 10.679 1.00 41.41 N ATOM 1505 CA GLY B 35 -21.612 8.323 10.248 1.00 44.33 C ATOM 1506 C GLY B 35 -20.479 8.407 11.251 1.00 24.11 C ATOM 1507 O GLY B 35 -20.381 9.373 12.007 1.00 42.25 O ATOM 0 HA2 GLY B 35 -21.874 7.277 10.088 1.00 44.33 H new ATOM 0 HA3 GLY B 35 -21.275 8.718 9.290 1.00 44.33 H new ATOM 1511 N GLU B 36 -19.621 7.391 11.260 1.00 74.33 N ATOM 1512 CA GLU B 36 -18.491 7.353 12.180 1.00 13.34 C ATOM 1513 C GLU B 36 -17.317 8.161 11.634 1.00 74.31 C ATOM 1514 O GLU B 36 -16.558 8.766 12.392 1.00 34.44 O ATOM 1515 CB GLU B 36 -18.057 5.908 12.432 1.00 73.33 C ATOM 1516 CG GLU B 36 -16.755 5.789 13.205 1.00 44.03 C ATOM 1517 CD GLU B 36 -16.529 4.395 13.757 1.00 61.11 C ATOM 1518 OE1 GLU B 36 -16.665 3.423 12.985 1.00 33.51 O ATOM 1519 OE2 GLU B 36 -16.216 4.276 14.960 1.00 54.10 O ATOM 0 H GLU B 36 -19.688 6.584 10.640 1.00 74.33 H new ATOM 0 HA GLU B 36 -18.809 7.798 13.123 1.00 13.34 H new ATOM 0 HB2 GLU B 36 -18.844 5.392 12.981 1.00 73.33 H new ATOM 0 HB3 GLU B 36 -17.949 5.398 11.475 1.00 73.33 H new ATOM 0 HG2 GLU B 36 -15.924 6.056 12.552 1.00 44.03 H new ATOM 0 HG3 GLU B 36 -16.758 6.505 14.027 1.00 44.03 H new ATOM 1526 N LEU B 37 -17.174 8.165 10.313 1.00 10.12 N ATOM 1527 CA LEU B 37 -16.092 8.897 9.663 1.00 15.34 C ATOM 1528 C LEU B 37 -16.138 10.377 10.032 1.00 75.25 C ATOM 1529 O LEU B 37 -15.108 11.048 10.073 1.00 52.54 O ATOM 1530 CB LEU B 37 -16.180 8.735 8.145 1.00 74.20 C ATOM 1531 CG LEU B 37 -15.785 7.365 7.592 1.00 31.15 C ATOM 1532 CD1 LEU B 37 -16.768 6.918 6.521 1.00 25.31 C ATOM 1533 CD2 LEU B 37 -14.369 7.402 7.038 1.00 44.12 C ATOM 0 H LEU B 37 -17.793 7.670 9.671 1.00 10.12 H new ATOM 0 HA LEU B 37 -15.146 8.484 10.012 1.00 15.34 H new ATOM 0 HB2 LEU B 37 -17.203 8.948 7.836 1.00 74.20 H new ATOM 0 HB3 LEU B 37 -15.543 9.489 7.682 1.00 74.20 H new ATOM 0 HG LEU B 37 -15.815 6.642 8.408 1.00 31.15 H new ATOM 0 HD11 LEU B 37 -16.471 5.941 6.139 1.00 25.31 H new ATOM 0 HD12 LEU B 37 -17.768 6.851 6.950 1.00 25.31 H new ATOM 0 HD13 LEU B 37 -16.771 7.641 5.705 1.00 25.31 H new ATOM 0 HD21 LEU B 37 -14.105 6.419 6.649 1.00 44.12 H new ATOM 0 HD22 LEU B 37 -14.311 8.137 6.236 1.00 44.12 H new ATOM 0 HD23 LEU B 37 -13.675 7.676 7.832 1.00 44.12 H new ATOM 1545 N MET B 38 -17.340 10.877 10.300 1.00 0.34 N ATOM 1546 CA MET B 38 -17.519 12.277 10.669 1.00 74.23 C ATOM 1547 C MET B 38 -17.097 12.517 12.115 1.00 73.22 C ATOM 1548 O MET B 38 -16.662 13.612 12.472 1.00 73.11 O ATOM 1549 CB MET B 38 -18.978 12.694 10.475 1.00 15.32 C ATOM 1550 CG MET B 38 -19.279 14.099 10.971 1.00 54.41 C ATOM 1551 SD MET B 38 -21.014 14.549 10.772 1.00 12.25 S ATOM 1552 CE MET B 38 -21.253 14.216 9.029 1.00 41.42 C ATOM 0 H MET B 38 -18.203 10.335 10.269 1.00 0.34 H new ATOM 0 HA MET B 38 -16.886 12.882 10.020 1.00 74.23 H new ATOM 0 HB2 MET B 38 -19.228 12.630 9.416 1.00 15.32 H new ATOM 0 HB3 MET B 38 -19.622 11.987 10.998 1.00 15.32 H new ATOM 0 HG2 MET B 38 -19.006 14.175 12.024 1.00 54.41 H new ATOM 0 HG3 MET B 38 -18.658 14.812 10.429 1.00 54.41 H new ATOM 0 HE1 MET B 38 -22.025 14.877 8.635 1.00 41.42 H new ATOM 0 HE2 MET B 38 -20.319 14.390 8.494 1.00 41.42 H new ATOM 0 HE3 MET B 38 -21.560 13.179 8.896 1.00 41.42 H new ATOM 1562 N LYS B 39 -17.229 11.487 12.943 1.00 24.45 N ATOM 1563 CA LYS B 39 -16.860 11.584 14.351 1.00 51.32 C ATOM 1564 C LYS B 39 -15.344 11.599 14.517 1.00 42.15 C ATOM 1565 O LYS B 39 -14.814 12.249 15.419 1.00 20.30 O ATOM 1566 CB LYS B 39 -17.458 10.416 15.138 1.00 14.42 C ATOM 1567 CG LYS B 39 -17.001 10.360 16.585 1.00 4.54 C ATOM 1568 CD LYS B 39 -16.238 9.080 16.880 1.00 61.30 C ATOM 1569 CE LYS B 39 -15.531 9.149 18.225 1.00 33.41 C ATOM 1570 NZ LYS B 39 -14.169 9.738 18.106 1.00 23.32 N ATOM 0 H LYS B 39 -17.589 10.574 12.664 1.00 24.45 H new ATOM 0 HA LYS B 39 -17.260 12.520 14.741 1.00 51.32 H new ATOM 0 HB2 LYS B 39 -18.545 10.490 15.112 1.00 14.42 H new ATOM 0 HB3 LYS B 39 -17.190 9.482 14.645 1.00 14.42 H new ATOM 0 HG2 LYS B 39 -16.367 11.220 16.801 1.00 4.54 H new ATOM 0 HG3 LYS B 39 -17.867 10.429 17.244 1.00 4.54 H new ATOM 0 HD2 LYS B 39 -16.927 8.235 16.873 1.00 61.30 H new ATOM 0 HD3 LYS B 39 -15.506 8.902 16.092 1.00 61.30 H new ATOM 0 HE2 LYS B 39 -16.125 9.745 18.917 1.00 33.41 H new ATOM 0 HE3 LYS B 39 -15.458 8.147 18.649 1.00 33.41 H new ATOM 0 HZ1 LYS B 39 -13.720 9.768 19.044 1.00 23.32 H new ATOM 0 HZ2 LYS B 39 -13.594 9.155 17.465 1.00 23.32 H new ATOM 0 HZ3 LYS B 39 -14.240 10.703 17.726 1.00 23.32 H new ATOM 1584 N LEU B 40 -14.651 10.881 13.640 1.00 44.11 N ATOM 1585 CA LEU B 40 -13.194 10.813 13.688 1.00 31.01 C ATOM 1586 C LEU B 40 -12.573 12.152 13.302 1.00 73.43 C ATOM 1587 O LEU B 40 -11.587 12.585 13.899 1.00 51.13 O ATOM 1588 CB LEU B 40 -12.684 9.713 12.755 1.00 12.22 C ATOM 1589 CG LEU B 40 -12.162 8.446 13.434 1.00 55.14 C ATOM 1590 CD1 LEU B 40 -13.209 7.344 13.383 1.00 61.33 C ATOM 1591 CD2 LEU B 40 -10.868 7.986 12.780 1.00 62.52 C ATOM 0 H LEU B 40 -15.074 10.338 12.887 1.00 44.11 H new ATOM 0 HA LEU B 40 -12.899 10.579 14.711 1.00 31.01 H new ATOM 0 HB2 LEU B 40 -13.493 9.433 12.080 1.00 12.22 H new ATOM 0 HB3 LEU B 40 -11.885 10.127 12.140 1.00 12.22 H new ATOM 0 HG LEU B 40 -11.956 8.675 14.480 1.00 55.14 H new ATOM 0 HD11 LEU B 40 -12.820 6.450 13.871 1.00 61.33 H new ATOM 0 HD12 LEU B 40 -14.111 7.675 13.898 1.00 61.33 H new ATOM 0 HD13 LEU B 40 -13.447 7.116 12.344 1.00 61.33 H new ATOM 0 HD21 LEU B 40 -10.511 7.083 13.276 1.00 62.52 H new ATOM 0 HD22 LEU B 40 -11.048 7.774 11.726 1.00 62.52 H new ATOM 0 HD23 LEU B 40 -10.116 8.770 12.869 1.00 62.52 H new ATOM 1603 N CYS B 41 -13.158 12.802 12.302 1.00 1.21 N ATOM 1604 CA CYS B 41 -12.663 14.093 11.837 1.00 40.12 C ATOM 1605 C CYS B 41 -13.029 15.202 12.818 1.00 22.55 C ATOM 1606 O CYS B 41 -12.292 16.175 12.972 1.00 21.13 O ATOM 1607 CB CYS B 41 -13.232 14.412 10.453 1.00 3.24 C ATOM 1608 SG CYS B 41 -11.982 14.537 9.152 1.00 32.25 S ATOM 0 H CYS B 41 -13.975 12.457 11.798 1.00 1.21 H new ATOM 0 HA CYS B 41 -11.577 14.035 11.771 1.00 40.12 H new ATOM 0 HB2 CYS B 41 -13.949 13.638 10.180 1.00 3.24 H new ATOM 0 HB3 CYS B 41 -13.782 15.352 10.506 1.00 3.24 H new ATOM 0 HG CYS B 41 -11.047 15.359 9.526 1.00 32.25 H new ATOM 1614 N GLU B 42 -14.172 15.047 13.479 1.00 72.23 N ATOM 1615 CA GLU B 42 -14.636 16.037 14.444 1.00 74.35 C ATOM 1616 C GLU B 42 -13.622 16.217 15.569 1.00 21.32 C ATOM 1617 O GLU B 42 -13.492 17.303 16.133 1.00 61.32 O ATOM 1618 CB GLU B 42 -15.990 15.620 15.024 1.00 42.44 C ATOM 1619 CG GLU B 42 -16.631 16.685 15.898 1.00 4.10 C ATOM 1620 CD GLU B 42 -17.899 17.252 15.291 1.00 14.24 C ATOM 1621 OE1 GLU B 42 -17.831 18.342 14.685 1.00 24.01 O ATOM 1622 OE2 GLU B 42 -18.960 16.607 15.423 1.00 13.20 O ATOM 0 H GLU B 42 -14.793 14.246 13.364 1.00 72.23 H new ATOM 0 HA GLU B 42 -14.749 16.989 13.925 1.00 74.35 H new ATOM 0 HB2 GLU B 42 -16.667 15.378 14.205 1.00 42.44 H new ATOM 0 HB3 GLU B 42 -15.860 14.710 15.610 1.00 42.44 H new ATOM 0 HG2 GLU B 42 -16.859 16.259 16.875 1.00 4.10 H new ATOM 0 HG3 GLU B 42 -15.918 17.493 16.061 1.00 4.10 H new ATOM 1629 N GLU B 43 -12.906 15.143 15.890 1.00 14.33 N ATOM 1630 CA GLU B 43 -11.905 15.183 16.949 1.00 22.33 C ATOM 1631 C GLU B 43 -10.925 16.332 16.729 1.00 13.04 C ATOM 1632 O GLU B 43 -10.616 17.083 17.654 1.00 64.02 O ATOM 1633 CB GLU B 43 -11.145 13.856 17.013 1.00 72.10 C ATOM 1634 CG GLU B 43 -11.791 12.828 17.927 1.00 2.21 C ATOM 1635 CD GLU B 43 -11.166 12.802 19.309 1.00 60.05 C ATOM 1636 OE1 GLU B 43 -10.381 11.871 19.586 1.00 0.13 O ATOM 1637 OE2 GLU B 43 -11.462 13.711 20.112 1.00 43.25 O ATOM 0 H GLU B 43 -13.001 14.236 15.432 1.00 14.33 H new ATOM 0 HA GLU B 43 -12.421 15.345 17.895 1.00 22.33 H new ATOM 0 HB2 GLU B 43 -11.071 13.441 16.008 1.00 72.10 H new ATOM 0 HB3 GLU B 43 -10.128 14.046 17.355 1.00 72.10 H new ATOM 0 HG2 GLU B 43 -12.855 13.046 18.018 1.00 2.21 H new ATOM 0 HG3 GLU B 43 -11.705 11.840 17.475 1.00 2.21 H new ATOM 1644 N ALA B 44 -10.441 16.462 15.499 1.00 72.34 N ATOM 1645 CA ALA B 44 -9.498 17.519 15.156 1.00 14.30 C ATOM 1646 C ALA B 44 -10.125 18.896 15.348 1.00 4.41 C ATOM 1647 O ALA B 44 -9.445 19.850 15.727 1.00 15.00 O ATOM 1648 CB ALA B 44 -9.016 17.352 13.723 1.00 44.11 C ATOM 0 H ALA B 44 -10.687 15.848 14.722 1.00 72.34 H new ATOM 0 HA ALA B 44 -8.642 17.441 15.827 1.00 14.30 H new ATOM 0 HB1 ALA B 44 -8.312 18.148 13.481 1.00 44.11 H new ATOM 0 HB2 ALA B 44 -8.522 16.386 13.615 1.00 44.11 H new ATOM 0 HB3 ALA B 44 -9.868 17.401 13.045 1.00 44.11 H new ATOM 1654 N ALA B 45 -11.423 18.993 15.083 1.00 34.24 N ATOM 1655 CA ALA B 45 -12.141 20.253 15.229 1.00 51.14 C ATOM 1656 C ALA B 45 -12.420 20.560 16.696 1.00 42.40 C ATOM 1657 O ALA B 45 -12.565 21.721 17.082 1.00 75.54 O ATOM 1658 CB ALA B 45 -13.441 20.214 14.439 1.00 14.03 C ATOM 0 H ALA B 45 -11.999 18.214 14.766 1.00 34.24 H new ATOM 0 HA ALA B 45 -11.511 21.049 14.832 1.00 51.14 H new ATOM 0 HB1 ALA B 45 -13.967 21.161 14.557 1.00 14.03 H new ATOM 0 HB2 ALA B 45 -13.221 20.050 13.384 1.00 14.03 H new ATOM 0 HB3 ALA B 45 -14.068 19.403 14.809 1.00 14.03 H new ATOM 1664 N LYS B 46 -12.494 19.514 17.511 1.00 23.41 N ATOM 1665 CA LYS B 46 -12.754 19.671 18.937 1.00 35.40 C ATOM 1666 C LYS B 46 -11.661 20.501 19.602 1.00 71.40 C ATOM 1667 O LYS B 46 -11.945 21.425 20.364 1.00 35.22 O ATOM 1668 CB LYS B 46 -12.852 18.301 19.612 1.00 23.24 C ATOM 1669 CG LYS B 46 -13.832 18.262 20.772 1.00 53.43 C ATOM 1670 CD LYS B 46 -14.602 16.953 20.808 1.00 60.21 C ATOM 1671 CE LYS B 46 -14.860 16.498 22.236 1.00 34.50 C ATOM 1672 NZ LYS B 46 -13.909 15.433 22.659 1.00 34.34 N ATOM 0 H LYS B 46 -12.377 18.547 17.208 1.00 23.41 H new ATOM 0 HA LYS B 46 -13.703 20.195 19.052 1.00 35.40 H new ATOM 0 HB2 LYS B 46 -13.151 17.561 18.870 1.00 23.24 H new ATOM 0 HB3 LYS B 46 -11.865 18.011 19.972 1.00 23.24 H new ATOM 0 HG2 LYS B 46 -13.292 18.394 21.710 1.00 53.43 H new ATOM 0 HG3 LYS B 46 -14.531 19.094 20.687 1.00 53.43 H new ATOM 0 HD2 LYS B 46 -15.551 17.074 20.286 1.00 60.21 H new ATOM 0 HD3 LYS B 46 -14.041 16.185 20.276 1.00 60.21 H new ATOM 0 HE2 LYS B 46 -14.774 17.350 22.910 1.00 34.50 H new ATOM 0 HE3 LYS B 46 -15.881 16.127 22.320 1.00 34.50 H new ATOM 0 HZ1 LYS B 46 -14.118 15.150 23.638 1.00 34.34 H new ATOM 0 HZ2 LYS B 46 -14.009 14.609 22.032 1.00 34.34 H new ATOM 0 HZ3 LYS B 46 -12.936 15.795 22.603 1.00 34.34 H new ATOM 1686 N LYS B 47 -10.409 20.166 19.308 1.00 53.23 N ATOM 1687 CA LYS B 47 -9.272 20.882 19.874 1.00 33.14 C ATOM 1688 C LYS B 47 -9.320 22.360 19.503 1.00 40.54 C ATOM 1689 O LYS B 47 -8.898 23.219 20.277 1.00 31.32 O ATOM 1690 CB LYS B 47 -7.960 20.264 19.386 1.00 0.41 C ATOM 1691 CG LYS B 47 -7.850 18.774 19.659 1.00 11.32 C ATOM 1692 CD LYS B 47 -7.863 18.478 21.150 1.00 44.25 C ATOM 1693 CE LYS B 47 -6.911 17.345 21.501 1.00 43.13 C ATOM 1694 NZ LYS B 47 -7.023 16.949 22.932 1.00 55.32 N ATOM 0 H LYS B 47 -10.156 19.403 18.681 1.00 53.23 H new ATOM 0 HA LYS B 47 -9.325 20.797 20.959 1.00 33.14 H new ATOM 0 HB2 LYS B 47 -7.864 20.436 18.314 1.00 0.41 H new ATOM 0 HB3 LYS B 47 -7.126 20.775 19.867 1.00 0.41 H new ATOM 0 HG2 LYS B 47 -8.677 18.253 19.176 1.00 11.32 H new ATOM 0 HG3 LYS B 47 -6.930 18.389 19.219 1.00 11.32 H new ATOM 0 HD2 LYS B 47 -7.583 19.375 21.703 1.00 44.25 H new ATOM 0 HD3 LYS B 47 -8.874 18.215 21.461 1.00 44.25 H new ATOM 0 HE2 LYS B 47 -7.123 16.483 20.868 1.00 43.13 H new ATOM 0 HE3 LYS B 47 -5.887 17.652 21.288 1.00 43.13 H new ATOM 0 HZ1 LYS B 47 -6.358 16.174 23.131 1.00 55.32 H new ATOM 0 HZ2 LYS B 47 -6.796 17.764 23.537 1.00 55.32 H new ATOM 0 HZ3 LYS B 47 -7.993 16.631 23.129 1.00 55.32 H new ATOM 1708 N ALA B 48 -9.838 22.651 18.313 1.00 24.45 N ATOM 1709 CA ALA B 48 -9.944 24.026 17.841 1.00 24.53 C ATOM 1710 C ALA B 48 -10.908 24.830 18.706 1.00 2.22 C ATOM 1711 O ALA B 48 -10.723 26.030 18.905 1.00 1.40 O ATOM 1712 CB ALA B 48 -10.389 24.051 16.387 1.00 51.23 C ATOM 0 H ALA B 48 -10.191 21.952 17.659 1.00 24.45 H new ATOM 0 HA ALA B 48 -8.959 24.488 17.916 1.00 24.53 H new ATOM 0 HB1 ALA B 48 -10.464 25.084 16.047 1.00 51.23 H new ATOM 0 HB2 ALA B 48 -9.661 23.520 15.774 1.00 51.23 H new ATOM 0 HB3 ALA B 48 -11.362 23.567 16.296 1.00 51.23 H new ATOM 1718 N GLU B 49 -11.937 24.161 19.217 1.00 42.21 N ATOM 1719 CA GLU B 49 -12.931 24.816 20.059 1.00 4.23 C ATOM 1720 C GLU B 49 -12.352 25.136 21.435 1.00 73.02 C ATOM 1721 O GLU B 49 -12.710 26.139 22.051 1.00 3.21 O ATOM 1722 CB GLU B 49 -14.169 23.930 20.208 1.00 12.21 C ATOM 1723 CG GLU B 49 -15.199 24.482 21.179 1.00 12.13 C ATOM 1724 CD GLU B 49 -15.135 23.815 22.539 1.00 22.15 C ATOM 1725 OE1 GLU B 49 -15.120 22.567 22.587 1.00 22.12 O ATOM 1726 OE2 GLU B 49 -15.100 24.540 23.555 1.00 23.25 O ATOM 0 H GLU B 49 -12.104 23.167 19.063 1.00 42.21 H new ATOM 0 HA GLU B 49 -13.218 25.751 19.578 1.00 4.23 H new ATOM 0 HB2 GLU B 49 -14.635 23.803 19.231 1.00 12.21 H new ATOM 0 HB3 GLU B 49 -13.859 22.940 20.544 1.00 12.21 H new ATOM 0 HG2 GLU B 49 -15.044 25.554 21.297 1.00 12.13 H new ATOM 0 HG3 GLU B 49 -16.196 24.349 20.760 1.00 12.13 H new ATOM 1733 N GLU B 50 -11.457 24.275 21.909 1.00 73.22 N ATOM 1734 CA GLU B 50 -10.831 24.465 23.212 1.00 62.13 C ATOM 1735 C GLU B 50 -9.715 25.503 23.132 1.00 23.55 C ATOM 1736 O GLU B 50 -9.457 26.228 24.094 1.00 43.22 O ATOM 1737 CB GLU B 50 -10.273 23.139 23.733 1.00 71.34 C ATOM 1738 CG GLU B 50 -10.036 23.125 25.233 1.00 13.54 C ATOM 1739 CD GLU B 50 -8.759 22.403 25.616 1.00 33.22 C ATOM 1740 OE1 GLU B 50 -8.793 21.611 26.581 1.00 32.14 O ATOM 1741 OE2 GLU B 50 -7.727 22.629 24.951 1.00 21.24 O ATOM 0 H GLU B 50 -11.149 23.440 21.411 1.00 73.22 H new ATOM 0 HA GLU B 50 -11.592 24.827 23.903 1.00 62.13 H new ATOM 0 HB2 GLU B 50 -10.965 22.337 23.476 1.00 71.34 H new ATOM 0 HB3 GLU B 50 -9.334 22.925 23.223 1.00 71.34 H new ATOM 0 HG2 GLU B 50 -9.993 24.151 25.600 1.00 13.54 H new ATOM 0 HG3 GLU B 50 -10.882 22.646 25.726 1.00 13.54 H new ATOM 1748 N LEU B 51 -9.055 25.567 21.981 1.00 75.30 N ATOM 1749 CA LEU B 51 -7.966 26.515 21.775 1.00 70.31 C ATOM 1750 C LEU B 51 -8.490 27.947 21.742 1.00 5.01 C ATOM 1751 O LEU B 51 -7.795 28.882 22.140 1.00 43.41 O ATOM 1752 CB LEU B 51 -7.229 26.199 20.472 1.00 3.23 C ATOM 1753 CG LEU B 51 -5.850 25.555 20.621 1.00 70.24 C ATOM 1754 CD1 LEU B 51 -4.867 26.535 21.242 1.00 21.52 C ATOM 1755 CD2 LEU B 51 -5.941 24.286 21.456 1.00 74.03 C ATOM 0 H LEU B 51 -9.255 24.973 21.176 1.00 75.30 H new ATOM 0 HA LEU B 51 -7.272 26.421 22.610 1.00 70.31 H new ATOM 0 HB2 LEU B 51 -7.855 25.536 19.875 1.00 3.23 H new ATOM 0 HB3 LEU B 51 -7.117 27.125 19.908 1.00 3.23 H new ATOM 0 HG LEU B 51 -5.486 25.288 19.629 1.00 70.24 H new ATOM 0 HD11 LEU B 51 -3.891 26.059 21.340 1.00 21.52 H new ATOM 0 HD12 LEU B 51 -4.779 27.415 20.605 1.00 21.52 H new ATOM 0 HD13 LEU B 51 -5.225 26.835 22.227 1.00 21.52 H new ATOM 0 HD21 LEU B 51 -4.950 23.841 21.551 1.00 74.03 H new ATOM 0 HD22 LEU B 51 -6.327 24.529 22.446 1.00 74.03 H new ATOM 0 HD23 LEU B 51 -6.611 23.578 20.969 1.00 74.03 H new ATOM 1767 N PHE B 52 -9.720 28.111 21.267 1.00 1.14 N ATOM 1768 CA PHE B 52 -10.338 29.429 21.184 1.00 44.40 C ATOM 1769 C PHE B 52 -10.384 30.096 22.556 1.00 51.13 C ATOM 1770 O PHE B 52 -10.274 31.317 22.670 1.00 41.01 O ATOM 1771 CB PHE B 52 -11.752 29.318 20.610 1.00 3.04 C ATOM 1772 CG PHE B 52 -11.889 29.905 19.235 1.00 65.04 C ATOM 1773 CD1 PHE B 52 -11.550 31.227 18.994 1.00 21.30 C ATOM 1774 CD2 PHE B 52 -12.356 29.135 18.182 1.00 74.11 C ATOM 1775 CE1 PHE B 52 -11.674 31.770 17.729 1.00 32.11 C ATOM 1776 CE2 PHE B 52 -12.482 29.672 16.915 1.00 54.41 C ATOM 1777 CZ PHE B 52 -12.142 30.992 16.688 1.00 31.25 C ATOM 0 H PHE B 52 -10.309 27.348 20.934 1.00 1.14 H new ATOM 0 HA PHE B 52 -9.732 30.046 20.520 1.00 44.40 H new ATOM 0 HB2 PHE B 52 -12.041 28.267 20.578 1.00 3.04 H new ATOM 0 HB3 PHE B 52 -12.448 29.820 21.282 1.00 3.04 H new ATOM 0 HD1 PHE B 52 -11.185 31.840 19.804 1.00 21.30 H new ATOM 0 HD2 PHE B 52 -12.625 28.103 18.353 1.00 74.11 H new ATOM 0 HE1 PHE B 52 -11.405 32.801 17.555 1.00 32.11 H new ATOM 0 HE2 PHE B 52 -12.846 29.060 16.103 1.00 54.41 H new ATOM 0 HZ PHE B 52 -12.242 31.414 15.699 1.00 31.25 H new ATOM 1787 N LYS B 53 -10.549 29.285 23.595 1.00 2.45 N ATOM 1788 CA LYS B 53 -10.610 29.794 24.961 1.00 64.13 C ATOM 1789 C LYS B 53 -9.268 30.387 25.381 1.00 74.52 C ATOM 1790 O LYS B 53 -9.216 31.428 26.036 1.00 13.13 O ATOM 1791 CB LYS B 53 -11.010 28.676 25.926 1.00 61.21 C ATOM 1792 CG LYS B 53 -12.511 28.473 26.032 1.00 34.41 C ATOM 1793 CD LYS B 53 -13.080 29.150 27.268 1.00 63.31 C ATOM 1794 CE LYS B 53 -13.327 28.150 28.387 1.00 5.25 C ATOM 1795 NZ LYS B 53 -14.638 27.461 28.237 1.00 51.13 N ATOM 0 H LYS B 53 -10.643 28.272 23.518 1.00 2.45 H new ATOM 0 HA LYS B 53 -11.362 30.582 24.996 1.00 64.13 H new ATOM 0 HB2 LYS B 53 -10.548 27.744 25.601 1.00 61.21 H new ATOM 0 HB3 LYS B 53 -10.611 28.901 26.915 1.00 61.21 H new ATOM 0 HG2 LYS B 53 -12.997 28.872 25.142 1.00 34.41 H new ATOM 0 HG3 LYS B 53 -12.733 27.406 26.065 1.00 34.41 H new ATOM 0 HD2 LYS B 53 -12.390 29.920 27.613 1.00 63.31 H new ATOM 0 HD3 LYS B 53 -14.014 29.650 27.013 1.00 63.31 H new ATOM 0 HE2 LYS B 53 -12.527 27.410 28.395 1.00 5.25 H new ATOM 0 HE3 LYS B 53 -13.295 28.665 29.347 1.00 5.25 H new ATOM 0 HZ1 LYS B 53 -14.768 26.788 29.019 1.00 51.13 H new ATOM 0 HZ2 LYS B 53 -15.404 28.164 28.254 1.00 51.13 H new ATOM 0 HZ3 LYS B 53 -14.659 26.948 27.332 1.00 51.13 H new ATOM 1809 N LEU B 54 -8.186 29.718 24.999 1.00 42.24 N ATOM 1810 CA LEU B 54 -6.843 30.180 25.334 1.00 33.15 C ATOM 1811 C LEU B 54 -6.479 31.425 24.532 1.00 62.44 C ATOM 1812 O LEU B 54 -5.937 32.388 25.073 1.00 75.00 O ATOM 1813 CB LEU B 54 -5.821 29.072 25.072 1.00 13.42 C ATOM 1814 CG LEU B 54 -5.490 28.170 26.261 1.00 24.20 C ATOM 1815 CD1 LEU B 54 -4.897 28.984 27.401 1.00 51.25 C ATOM 1816 CD2 LEU B 54 -6.731 27.423 26.726 1.00 32.12 C ATOM 0 H LEU B 54 -8.212 28.854 24.457 1.00 42.24 H new ATOM 0 HA LEU B 54 -6.827 30.437 26.393 1.00 33.15 H new ATOM 0 HB2 LEU B 54 -6.193 28.447 24.260 1.00 13.42 H new ATOM 0 HB3 LEU B 54 -4.897 29.533 24.723 1.00 13.42 H new ATOM 0 HG LEU B 54 -4.748 27.438 25.941 1.00 24.20 H new ATOM 0 HD11 LEU B 54 -4.668 28.325 28.238 1.00 51.25 H new ATOM 0 HD12 LEU B 54 -3.983 29.472 27.063 1.00 51.25 H new ATOM 0 HD13 LEU B 54 -5.615 29.740 27.720 1.00 51.25 H new ATOM 0 HD21 LEU B 54 -6.476 26.786 27.573 1.00 32.12 H new ATOM 0 HD22 LEU B 54 -7.495 28.139 27.028 1.00 32.12 H new ATOM 0 HD23 LEU B 54 -7.112 26.808 25.911 1.00 32.12 H new ATOM 1828 N ALA B 55 -6.781 31.397 23.238 1.00 54.42 N ATOM 1829 CA ALA B 55 -6.490 32.525 22.361 1.00 24.22 C ATOM 1830 C ALA B 55 -7.083 33.817 22.912 1.00 31.25 C ATOM 1831 O ALA B 55 -6.572 34.905 22.652 1.00 1.42 O ATOM 1832 CB ALA B 55 -7.018 32.255 20.960 1.00 30.32 C ATOM 0 H ALA B 55 -7.227 30.606 22.774 1.00 54.42 H new ATOM 0 HA ALA B 55 -5.408 32.645 22.312 1.00 24.22 H new ATOM 0 HB1 ALA B 55 -6.794 33.106 20.316 1.00 30.32 H new ATOM 0 HB2 ALA B 55 -6.542 31.360 20.558 1.00 30.32 H new ATOM 0 HB3 ALA B 55 -8.097 32.105 21.000 1.00 30.32 H new ATOM 1838 N GLU B 56 -8.165 33.688 23.674 1.00 30.02 N ATOM 1839 CA GLU B 56 -8.828 34.847 24.260 1.00 32.23 C ATOM 1840 C GLU B 56 -7.922 35.536 25.276 1.00 42.40 C ATOM 1841 O GLU B 56 -7.754 36.755 25.246 1.00 41.02 O ATOM 1842 CB GLU B 56 -10.138 34.428 24.931 1.00 20.41 C ATOM 1843 CG GLU B 56 -11.367 35.095 24.337 1.00 61.11 C ATOM 1844 CD GLU B 56 -12.652 34.370 24.689 1.00 43.25 C ATOM 1845 OE1 GLU B 56 -12.777 33.180 24.333 1.00 61.43 O ATOM 1846 OE2 GLU B 56 -13.531 34.993 25.319 1.00 54.02 O ATOM 0 H GLU B 56 -8.600 32.794 23.900 1.00 30.02 H new ATOM 0 HA GLU B 56 -9.048 35.552 23.458 1.00 32.23 H new ATOM 0 HB2 GLU B 56 -10.248 33.346 24.851 1.00 20.41 H new ATOM 0 HB3 GLU B 56 -10.084 34.665 25.994 1.00 20.41 H new ATOM 0 HG2 GLU B 56 -11.425 36.124 24.693 1.00 61.11 H new ATOM 0 HG3 GLU B 56 -11.264 35.138 23.253 1.00 61.11 H new ATOM 1853 N GLU B 57 -7.341 34.747 26.174 1.00 31.02 N ATOM 1854 CA GLU B 57 -6.453 35.282 27.200 1.00 73.22 C ATOM 1855 C GLU B 57 -5.078 35.596 26.619 1.00 63.03 C ATOM 1856 O GLU B 57 -4.382 36.494 27.093 1.00 12.30 O ATOM 1857 CB GLU B 57 -6.316 34.288 28.356 1.00 50.54 C ATOM 1858 CG GLU B 57 -6.313 34.945 29.726 1.00 40.44 C ATOM 1859 CD GLU B 57 -6.054 33.957 30.846 1.00 2.00 C ATOM 1860 OE1 GLU B 57 -4.902 33.893 31.326 1.00 53.45 O ATOM 1861 OE2 GLU B 57 -7.001 33.247 31.243 1.00 54.41 O ATOM 0 H GLU B 57 -7.469 33.736 26.212 1.00 31.02 H new ATOM 0 HA GLU B 57 -6.889 36.207 27.576 1.00 73.22 H new ATOM 0 HB2 GLU B 57 -7.136 33.572 28.308 1.00 50.54 H new ATOM 0 HB3 GLU B 57 -5.392 33.723 28.231 1.00 50.54 H new ATOM 0 HG2 GLU B 57 -5.550 35.724 29.750 1.00 40.44 H new ATOM 0 HG3 GLU B 57 -7.273 35.434 29.893 1.00 40.44 H new ATOM 1868 N ARG B 58 -4.692 34.849 25.589 1.00 11.03 N ATOM 1869 CA ARG B 58 -3.400 35.046 24.944 1.00 25.13 C ATOM 1870 C ARG B 58 -3.336 36.408 24.259 1.00 61.44 C ATOM 1871 O ARG B 58 -2.303 37.079 24.282 1.00 73.23 O ATOM 1872 CB ARG B 58 -3.141 33.936 23.923 1.00 2.34 C ATOM 1873 CG ARG B 58 -3.050 32.550 24.540 1.00 13.23 C ATOM 1874 CD ARG B 58 -1.621 32.205 24.927 1.00 22.04 C ATOM 1875 NE ARG B 58 -1.318 32.591 26.303 1.00 43.43 N ATOM 1876 CZ ARG B 58 -1.668 31.871 27.363 1.00 51.54 C ATOM 1877 NH1 ARG B 58 -2.330 30.733 27.206 1.00 41.43 N ATOM 1878 NH2 ARG B 58 -1.356 32.289 28.583 1.00 40.43 N ATOM 0 H ARG B 58 -5.256 34.102 25.184 1.00 11.03 H new ATOM 0 HA ARG B 58 -2.629 35.009 25.713 1.00 25.13 H new ATOM 0 HB2 ARG B 58 -3.940 33.943 23.181 1.00 2.34 H new ATOM 0 HB3 ARG B 58 -2.213 34.150 23.394 1.00 2.34 H new ATOM 0 HG2 ARG B 58 -3.689 32.501 25.422 1.00 13.23 H new ATOM 0 HG3 ARG B 58 -3.425 31.810 23.833 1.00 13.23 H new ATOM 0 HD2 ARG B 58 -1.462 31.133 24.808 1.00 22.04 H new ATOM 0 HD3 ARG B 58 -0.931 32.707 24.249 1.00 22.04 H new ATOM 0 HE ARG B 58 -0.810 33.461 26.458 1.00 43.43 H new ATOM 0 HH11 ARG B 58 -2.572 30.409 26.270 1.00 41.43 H new ATOM 0 HH12 ARG B 58 -2.598 30.182 28.022 1.00 41.43 H new ATOM 0 HH21 ARG B 58 -0.847 33.164 28.708 1.00 40.43 H new ATOM 0 HH22 ARG B 58 -1.625 31.735 29.396 1.00 40.43 H new ATOM 1892 N LEU B 59 -4.446 36.809 23.649 1.00 44.33 N ATOM 1893 CA LEU B 59 -4.517 38.091 22.956 1.00 65.05 C ATOM 1894 C LEU B 59 -5.435 39.059 23.694 1.00 53.23 C ATOM 1895 O LEU B 59 -5.971 39.997 23.103 1.00 41.13 O ATOM 1896 CB LEU B 59 -5.013 37.891 21.522 1.00 1.34 C ATOM 1897 CG LEU B 59 -4.293 36.817 20.707 1.00 74.44 C ATOM 1898 CD1 LEU B 59 -5.108 36.445 19.478 1.00 72.35 C ATOM 1899 CD2 LEU B 59 -2.905 37.292 20.304 1.00 11.54 C ATOM 0 H LEU B 59 -5.309 36.265 23.620 1.00 44.33 H new ATOM 0 HA LEU B 59 -3.515 38.519 22.931 1.00 65.05 H new ATOM 0 HB2 LEU B 59 -6.074 37.642 21.557 1.00 1.34 H new ATOM 0 HB3 LEU B 59 -4.926 38.840 20.993 1.00 1.34 H new ATOM 0 HG LEU B 59 -4.184 35.929 21.329 1.00 74.44 H new ATOM 0 HD11 LEU B 59 -4.580 35.679 18.910 1.00 72.35 H new ATOM 0 HD12 LEU B 59 -6.080 36.061 19.788 1.00 72.35 H new ATOM 0 HD13 LEU B 59 -5.249 37.328 18.854 1.00 72.35 H new ATOM 0 HD21 LEU B 59 -2.408 36.514 19.725 1.00 11.54 H new ATOM 0 HD22 LEU B 59 -2.991 38.195 19.700 1.00 11.54 H new ATOM 0 HD23 LEU B 59 -2.320 37.508 21.198 1.00 11.54 H new