USER MOD reduce.3.24.130724 H: found=0, std=0, add=636, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 638 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 140 GLN : amide:sc= 0.406 X(o=-1.1,f=-0.96) USER MOD Set 1.2: A 152 ASN : amide:sc= -1.47 X(o=-1.1,f=-0.96) USER MOD Set 2.1: A 115 SER OG : rot 160:sc= 1.83 USER MOD Set 2.2: A 117 THR OG1 : rot 171:sc= 1.26 USER MOD Single : A 99 SER OG : rot -26:sc= 0.621 USER MOD Single : A 105 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0189) USER MOD Single : A 114 ASN : amide:sc= 2.07 K(o=2.1,f=-6.5!) USER MOD Single : A 119 THR OG1 : rot -69:sc= 1.82 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 173:sc=-0.00598 (180deg=-0.0838) USER MOD Single : A 133 ASN : amide:sc= 0.776 K(o=0.78,f=-0.35) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0.258 USER MOD Single : A 142 MET CE :methyl 162:sc= -0.102 (180deg=-0.305) USER MOD Single : A 163 MET CE :methyl -171:sc= -3.15! (180deg=-3.64!) USER MOD Single : A 164 LYS NZ :NH3+ -120:sc= -0.0874 (180deg=-0.427) USER MOD Single : A 165 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0198) USER MOD Single : A 166 THR OG1 : rot 83:sc= 0.96 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : B 246 SER OG : rot 180:sc= 0 USER MOD Single : B 247 LYS NZ :NH3+ -169:sc= 0.463 (180deg=0.398) USER MOD Single : B 249 HIS : no HD1:sc= -0.439 K(o=-0.44,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 79 N SER A 99 10.543 0.692 -0.163 1.00 0.00 N ATOM 80 CA SER A 99 9.173 1.106 0.100 1.00 0.00 C ATOM 81 C SER A 99 8.328 1.068 -1.178 1.00 0.00 C ATOM 82 O SER A 99 7.237 0.509 -1.174 1.00 0.00 O ATOM 83 CB SER A 99 9.209 2.510 0.713 1.00 0.00 C ATOM 84 OG SER A 99 10.231 3.270 0.090 1.00 0.00 O ATOM 0 HA SER A 99 8.702 0.415 0.800 1.00 0.00 H new ATOM 0 HB2 SER A 99 8.245 3.001 0.582 1.00 0.00 H new ATOM 0 HB3 SER A 99 9.391 2.446 1.786 1.00 0.00 H new ATOM 0 HG SER A 99 10.920 2.667 -0.259 1.00 0.00 H new ATOM 90 N ARG A 100 8.843 1.630 -2.272 1.00 0.00 N ATOM 91 CA ARG A 100 8.227 1.597 -3.593 1.00 0.00 C ATOM 92 C ARG A 100 7.870 0.163 -4.000 1.00 0.00 C ATOM 93 O ARG A 100 6.730 -0.118 -4.366 1.00 0.00 O ATOM 94 CB ARG A 100 9.187 2.244 -4.601 1.00 0.00 C ATOM 95 CG ARG A 100 8.543 2.442 -5.980 1.00 0.00 C ATOM 96 CD ARG A 100 9.556 3.056 -6.952 1.00 0.00 C ATOM 97 NE ARG A 100 10.676 2.131 -7.183 1.00 0.00 N ATOM 98 CZ ARG A 100 11.986 2.390 -7.064 1.00 0.00 C ATOM 99 NH1 ARG A 100 12.455 3.601 -6.746 1.00 0.00 N ATOM 100 NH2 ARG A 100 12.862 1.403 -7.256 1.00 0.00 N ATOM 0 H ARG A 100 9.729 2.136 -2.260 1.00 0.00 H new ATOM 0 HA ARG A 100 7.294 2.160 -3.575 1.00 0.00 H new ATOM 0 HB2 ARG A 100 9.518 3.209 -4.216 1.00 0.00 H new ATOM 0 HB3 ARG A 100 10.075 1.621 -4.704 1.00 0.00 H new ATOM 0 HG2 ARG A 100 8.191 1.485 -6.366 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.672 3.091 -5.893 1.00 0.00 H new ATOM 0 HD2 ARG A 100 9.067 3.287 -7.898 1.00 0.00 H new ATOM 0 HD3 ARG A 100 9.931 3.997 -6.549 1.00 0.00 H new ATOM 0 HE ARG A 100 10.427 1.183 -7.466 1.00 0.00 H new ATOM 0 HH11 ARG A 100 11.807 4.372 -6.583 1.00 0.00 H new ATOM 0 HH12 ARG A 100 13.460 3.754 -6.666 1.00 0.00 H new ATOM 0 HH21 ARG A 100 12.532 0.467 -7.490 1.00 0.00 H new ATOM 0 HH22 ARG A 100 13.862 1.584 -7.169 1.00 0.00 H new ATOM 114 N GLU A 101 8.839 -0.753 -3.939 1.00 0.00 N ATOM 115 CA GLU A 101 8.615 -2.149 -4.282 1.00 0.00 C ATOM 116 C GLU A 101 7.520 -2.740 -3.390 1.00 0.00 C ATOM 117 O GLU A 101 6.610 -3.393 -3.892 1.00 0.00 O ATOM 118 CB GLU A 101 9.918 -2.958 -4.174 1.00 0.00 C ATOM 119 CG GLU A 101 10.875 -2.735 -5.356 1.00 0.00 C ATOM 120 CD GLU A 101 11.348 -1.294 -5.518 1.00 0.00 C ATOM 121 OE1 GLU A 101 11.687 -0.678 -4.484 1.00 0.00 O ATOM 122 OE2 GLU A 101 11.360 -0.834 -6.681 1.00 0.00 O ATOM 0 H GLU A 101 9.795 -0.544 -3.651 1.00 0.00 H new ATOM 0 HA GLU A 101 8.281 -2.204 -5.318 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.427 -2.690 -3.248 1.00 0.00 H new ATOM 0 HB3 GLU A 101 9.674 -4.018 -4.109 1.00 0.00 H new ATOM 0 HG2 GLU A 101 11.746 -3.379 -5.230 1.00 0.00 H new ATOM 0 HG3 GLU A 101 10.378 -3.047 -6.274 1.00 0.00 H new ATOM 129 N GLU A 102 7.589 -2.512 -2.076 1.00 0.00 N ATOM 130 CA GLU A 102 6.625 -3.089 -1.144 1.00 0.00 C ATOM 131 C GLU A 102 5.214 -2.553 -1.414 1.00 0.00 C ATOM 132 O GLU A 102 4.249 -3.317 -1.476 1.00 0.00 O ATOM 133 CB GLU A 102 7.068 -2.842 0.303 1.00 0.00 C ATOM 134 CG GLU A 102 8.434 -3.472 0.619 1.00 0.00 C ATOM 135 CD GLU A 102 8.430 -4.985 0.429 1.00 0.00 C ATOM 136 OE1 GLU A 102 7.856 -5.664 1.308 1.00 0.00 O ATOM 137 OE2 GLU A 102 8.972 -5.435 -0.605 1.00 0.00 O ATOM 0 H GLU A 102 8.303 -1.932 -1.636 1.00 0.00 H new ATOM 0 HA GLU A 102 6.590 -4.168 -1.298 1.00 0.00 H new ATOM 0 HB2 GLU A 102 7.116 -1.769 0.486 1.00 0.00 H new ATOM 0 HB3 GLU A 102 6.319 -3.248 0.983 1.00 0.00 H new ATOM 0 HG2 GLU A 102 9.194 -3.029 -0.025 1.00 0.00 H new ATOM 0 HG3 GLU A 102 8.711 -3.238 1.647 1.00 0.00 H new ATOM 144 N ILE A 103 5.105 -1.240 -1.621 1.00 0.00 N ATOM 145 CA ILE A 103 3.883 -0.598 -2.080 1.00 0.00 C ATOM 146 C ILE A 103 3.370 -1.321 -3.324 1.00 0.00 C ATOM 147 O ILE A 103 2.201 -1.686 -3.392 1.00 0.00 O ATOM 148 CB ILE A 103 4.145 0.894 -2.365 1.00 0.00 C ATOM 149 CG1 ILE A 103 4.331 1.672 -1.055 1.00 0.00 C ATOM 150 CG2 ILE A 103 2.971 1.494 -3.150 1.00 0.00 C ATOM 151 CD1 ILE A 103 4.985 3.046 -1.242 1.00 0.00 C ATOM 0 H ILE A 103 5.875 -0.589 -1.471 1.00 0.00 H new ATOM 0 HA ILE A 103 3.119 -0.658 -1.305 1.00 0.00 H new ATOM 0 HB ILE A 103 5.058 0.973 -2.956 1.00 0.00 H new ATOM 0 HG12 ILE A 103 3.359 1.804 -0.580 1.00 0.00 H new ATOM 0 HG13 ILE A 103 4.941 1.079 -0.374 1.00 0.00 H new ATOM 0 HG21 ILE A 103 3.166 2.548 -3.346 1.00 0.00 H new ATOM 0 HG22 ILE A 103 2.857 0.964 -4.095 1.00 0.00 H new ATOM 0 HG23 ILE A 103 2.056 1.397 -2.566 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.084 3.537 -0.274 1.00 0.00 H new ATOM 0 HD12 ILE A 103 5.972 2.922 -1.688 1.00 0.00 H new ATOM 0 HD13 ILE A 103 4.365 3.658 -1.897 1.00 0.00 H new ATOM 163 N LEU A 104 4.230 -1.507 -4.326 1.00 0.00 N ATOM 164 CA LEU A 104 3.806 -2.052 -5.606 1.00 0.00 C ATOM 165 C LEU A 104 3.353 -3.512 -5.453 1.00 0.00 C ATOM 166 O LEU A 104 2.317 -3.906 -5.991 1.00 0.00 O ATOM 167 CB LEU A 104 4.927 -1.828 -6.632 1.00 0.00 C ATOM 168 CG LEU A 104 4.506 -1.795 -8.110 1.00 0.00 C ATOM 169 CD1 LEU A 104 4.336 -3.194 -8.709 1.00 0.00 C ATOM 170 CD2 LEU A 104 3.256 -0.946 -8.378 1.00 0.00 C ATOM 0 H LEU A 104 5.224 -1.286 -4.271 1.00 0.00 H new ATOM 0 HA LEU A 104 2.926 -1.531 -5.984 1.00 0.00 H new ATOM 0 HB2 LEU A 104 5.422 -0.886 -6.397 1.00 0.00 H new ATOM 0 HB3 LEU A 104 5.668 -2.617 -6.506 1.00 0.00 H new ATOM 0 HG LEU A 104 5.339 -1.307 -8.616 1.00 0.00 H new ATOM 0 HD11 LEU A 104 4.038 -3.109 -9.754 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.280 -3.735 -8.644 1.00 0.00 H new ATOM 0 HD13 LEU A 104 3.568 -3.736 -8.156 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.021 -0.971 -9.442 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.416 -1.347 -7.811 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.443 0.083 -8.072 1.00 0.00 H new ATOM 182 N LYS A 105 4.082 -4.309 -4.668 1.00 0.00 N ATOM 183 CA LYS A 105 3.657 -5.655 -4.306 1.00 0.00 C ATOM 184 C LYS A 105 2.261 -5.622 -3.679 1.00 0.00 C ATOM 185 O LYS A 105 1.364 -6.319 -4.150 1.00 0.00 O ATOM 186 CB LYS A 105 4.675 -6.307 -3.361 1.00 0.00 C ATOM 187 CG LYS A 105 5.983 -6.649 -4.085 1.00 0.00 C ATOM 188 CD LYS A 105 7.017 -7.158 -3.072 1.00 0.00 C ATOM 189 CE LYS A 105 8.393 -7.372 -3.711 1.00 0.00 C ATOM 190 NZ LYS A 105 8.363 -8.417 -4.750 1.00 0.00 N ATOM 0 H LYS A 105 4.980 -4.037 -4.269 1.00 0.00 H new ATOM 0 HA LYS A 105 3.607 -6.261 -5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 105 4.884 -5.633 -2.530 1.00 0.00 H new ATOM 0 HB3 LYS A 105 4.247 -7.214 -2.935 1.00 0.00 H new ATOM 0 HG2 LYS A 105 5.801 -7.408 -4.846 1.00 0.00 H new ATOM 0 HG3 LYS A 105 6.367 -5.768 -4.599 1.00 0.00 H new ATOM 0 HD2 LYS A 105 7.105 -6.443 -2.254 1.00 0.00 H new ATOM 0 HD3 LYS A 105 6.669 -8.096 -2.639 1.00 0.00 H new ATOM 0 HE2 LYS A 105 8.739 -6.436 -4.149 1.00 0.00 H new ATOM 0 HE3 LYS A 105 9.112 -7.648 -2.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 9.323 -8.566 -5.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 8.009 -9.305 -4.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 7.735 -8.119 -5.524 1.00 0.00 H new ATOM 204 N ALA A 106 2.056 -4.806 -2.638 1.00 0.00 N ATOM 205 CA ALA A 106 0.745 -4.671 -2.006 1.00 0.00 C ATOM 206 C ALA A 106 -0.324 -4.265 -3.023 1.00 0.00 C ATOM 207 O ALA A 106 -1.408 -4.846 -3.059 1.00 0.00 O ATOM 208 CB ALA A 106 0.827 -3.687 -0.838 1.00 0.00 C ATOM 0 H ALA A 106 2.785 -4.230 -2.217 1.00 0.00 H new ATOM 0 HA ALA A 106 0.445 -5.641 -1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -0.154 -3.592 -0.373 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.543 -4.054 -0.103 1.00 0.00 H new ATOM 0 HB3 ALA A 106 1.150 -2.713 -1.205 1.00 0.00 H new ATOM 214 N PHE A 107 -0.006 -3.289 -3.875 1.00 0.00 N ATOM 215 CA PHE A 107 -0.887 -2.834 -4.937 1.00 0.00 C ATOM 216 C PHE A 107 -1.358 -4.023 -5.772 1.00 0.00 C ATOM 217 O PHE A 107 -2.558 -4.225 -5.946 1.00 0.00 O ATOM 218 CB PHE A 107 -0.179 -1.791 -5.810 1.00 0.00 C ATOM 219 CG PHE A 107 -1.068 -1.178 -6.871 1.00 0.00 C ATOM 220 CD1 PHE A 107 -1.189 -1.773 -8.141 1.00 0.00 C ATOM 221 CD2 PHE A 107 -1.833 -0.047 -6.553 1.00 0.00 C ATOM 222 CE1 PHE A 107 -2.082 -1.235 -9.083 1.00 0.00 C ATOM 223 CE2 PHE A 107 -2.724 0.489 -7.490 1.00 0.00 C ATOM 224 CZ PHE A 107 -2.847 -0.102 -8.755 1.00 0.00 C ATOM 0 H PHE A 107 0.883 -2.790 -3.841 1.00 0.00 H new ATOM 0 HA PHE A 107 -1.762 -2.360 -4.493 1.00 0.00 H new ATOM 0 HB2 PHE A 107 0.208 -0.998 -5.170 1.00 0.00 H new ATOM 0 HB3 PHE A 107 0.679 -2.258 -6.293 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -0.597 -2.641 -8.391 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -1.734 0.413 -5.581 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -2.181 -1.691 -10.057 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -3.316 1.357 -7.239 1.00 0.00 H new ATOM 0 HZ PHE A 107 -3.531 0.314 -9.480 1.00 0.00 H new ATOM 234 N ARG A 108 -0.413 -4.819 -6.282 1.00 0.00 N ATOM 235 CA ARG A 108 -0.749 -5.978 -7.094 1.00 0.00 C ATOM 236 C ARG A 108 -1.520 -7.033 -6.300 1.00 0.00 C ATOM 237 O ARG A 108 -2.499 -7.568 -6.815 1.00 0.00 O ATOM 238 CB ARG A 108 0.499 -6.570 -7.755 1.00 0.00 C ATOM 239 CG ARG A 108 1.014 -5.621 -8.846 1.00 0.00 C ATOM 240 CD ARG A 108 2.067 -6.291 -9.742 1.00 0.00 C ATOM 241 NE ARG A 108 1.578 -7.541 -10.345 1.00 0.00 N ATOM 242 CZ ARG A 108 0.578 -7.647 -11.234 1.00 0.00 C ATOM 243 NH1 ARG A 108 -0.004 -6.570 -11.766 1.00 0.00 N ATOM 244 NH2 ARG A 108 0.132 -8.852 -11.598 1.00 0.00 N ATOM 0 H ARG A 108 0.588 -4.677 -6.143 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.414 -5.635 -7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 108 1.275 -6.733 -7.007 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.265 -7.543 -8.188 1.00 0.00 H new ATOM 0 HG2 ARG A 108 0.177 -5.285 -9.459 1.00 0.00 H new ATOM 0 HG3 ARG A 108 1.445 -4.734 -8.381 1.00 0.00 H new ATOM 0 HD2 ARG A 108 2.360 -5.600 -10.532 1.00 0.00 H new ATOM 0 HD3 ARG A 108 2.961 -6.500 -9.154 1.00 0.00 H new ATOM 0 HE ARG A 108 2.041 -8.405 -10.062 1.00 0.00 H new ATOM 0 HH11 ARG A 108 0.309 -5.637 -11.499 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -0.762 -6.680 -12.440 1.00 0.00 H new ATOM 0 HH21 ARG A 108 0.551 -9.693 -11.200 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -0.628 -8.932 -12.274 1.00 0.00 H new ATOM 258 N LEU A 109 -1.102 -7.336 -5.061 1.00 0.00 N ATOM 259 CA LEU A 109 -1.814 -8.299 -4.221 1.00 0.00 C ATOM 260 C LEU A 109 -3.280 -7.876 -4.108 1.00 0.00 C ATOM 261 O LEU A 109 -4.181 -8.702 -4.239 1.00 0.00 O ATOM 262 CB LEU A 109 -1.088 -8.565 -2.874 1.00 0.00 C ATOM 263 CG LEU A 109 -1.674 -7.965 -1.574 1.00 0.00 C ATOM 264 CD1 LEU A 109 -2.884 -8.753 -1.050 1.00 0.00 C ATOM 265 CD2 LEU A 109 -0.646 -8.006 -0.431 1.00 0.00 C ATOM 0 H LEU A 109 -0.276 -6.927 -4.624 1.00 0.00 H new ATOM 0 HA LEU A 109 -1.809 -9.281 -4.693 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.029 -9.645 -2.740 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.066 -8.199 -2.973 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.959 -6.947 -1.842 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -3.254 -8.287 -0.137 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -3.672 -8.752 -1.803 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.586 -9.780 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -1.086 -7.578 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -0.358 -9.039 -0.238 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.235 -7.430 -0.713 1.00 0.00 H new ATOM 277 N PHE A 110 -3.523 -6.578 -3.903 1.00 0.00 N ATOM 278 CA PHE A 110 -4.875 -6.051 -3.864 1.00 0.00 C ATOM 279 C PHE A 110 -5.565 -6.145 -5.221 1.00 0.00 C ATOM 280 O PHE A 110 -6.691 -6.636 -5.296 1.00 0.00 O ATOM 281 CB PHE A 110 -4.888 -4.616 -3.326 1.00 0.00 C ATOM 282 CG PHE A 110 -4.541 -4.411 -1.862 1.00 0.00 C ATOM 283 CD1 PHE A 110 -4.403 -5.489 -0.962 1.00 0.00 C ATOM 284 CD2 PHE A 110 -4.485 -3.096 -1.371 1.00 0.00 C ATOM 285 CE1 PHE A 110 -4.220 -5.251 0.410 1.00 0.00 C ATOM 286 CE2 PHE A 110 -4.299 -2.858 0.000 1.00 0.00 C ATOM 287 CZ PHE A 110 -4.189 -3.936 0.894 1.00 0.00 C ATOM 0 H PHE A 110 -2.794 -5.878 -3.762 1.00 0.00 H new ATOM 0 HA PHE A 110 -5.447 -6.673 -3.176 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.191 -4.027 -3.922 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -5.882 -4.202 -3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.438 -6.504 -1.331 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.586 -2.264 -2.052 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.103 -6.081 1.092 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.240 -1.844 0.368 1.00 0.00 H new ATOM 0 HZ PHE A 110 -4.081 -3.752 1.953 1.00 0.00 H new ATOM 297 N ASP A 111 -4.931 -5.660 -6.291 1.00 0.00 N ATOM 298 CA ASP A 111 -5.519 -5.643 -7.626 1.00 0.00 C ATOM 299 C ASP A 111 -5.487 -7.041 -8.258 1.00 0.00 C ATOM 300 O ASP A 111 -4.910 -7.235 -9.326 1.00 0.00 O ATOM 301 CB ASP A 111 -4.823 -4.592 -8.506 1.00 0.00 C ATOM 302 CG ASP A 111 -5.473 -4.442 -9.884 1.00 0.00 C ATOM 303 OD1 ASP A 111 -6.591 -4.973 -10.071 1.00 0.00 O ATOM 304 OD2 ASP A 111 -4.833 -3.795 -10.741 1.00 0.00 O ATOM 0 H ASP A 111 -3.991 -5.267 -6.252 1.00 0.00 H new ATOM 0 HA ASP A 111 -6.568 -5.357 -7.543 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -4.840 -3.629 -7.995 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -3.776 -4.867 -8.632 1.00 0.00 H new ATOM 309 N ASP A 112 -6.173 -7.996 -7.624 1.00 0.00 N ATOM 310 CA ASP A 112 -6.370 -9.351 -8.120 1.00 0.00 C ATOM 311 C ASP A 112 -6.898 -9.329 -9.555 1.00 0.00 C ATOM 312 O ASP A 112 -6.479 -10.132 -10.384 1.00 0.00 O ATOM 313 CB ASP A 112 -7.343 -10.087 -7.191 1.00 0.00 C ATOM 314 CG ASP A 112 -7.609 -11.514 -7.661 1.00 0.00 C ATOM 315 OD1 ASP A 112 -8.529 -11.681 -8.489 1.00 0.00 O ATOM 316 OD2 ASP A 112 -6.910 -12.422 -7.157 1.00 0.00 O ATOM 0 H ASP A 112 -6.620 -7.836 -6.721 1.00 0.00 H new ATOM 0 HA ASP A 112 -5.415 -9.877 -8.129 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -6.935 -10.108 -6.181 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -8.284 -9.539 -7.143 1.00 0.00 H new ATOM 321 N ASP A 113 -7.810 -8.395 -9.845 1.00 0.00 N ATOM 322 CA ASP A 113 -8.380 -8.224 -11.175 1.00 0.00 C ATOM 323 C ASP A 113 -7.306 -7.958 -12.240 1.00 0.00 C ATOM 324 O ASP A 113 -7.512 -8.274 -13.408 1.00 0.00 O ATOM 325 CB ASP A 113 -9.408 -7.088 -11.140 1.00 0.00 C ATOM 326 CG ASP A 113 -10.120 -6.943 -12.481 1.00 0.00 C ATOM 327 OD1 ASP A 113 -11.046 -7.748 -12.719 1.00 0.00 O ATOM 328 OD2 ASP A 113 -9.734 -6.026 -13.237 1.00 0.00 O ATOM 0 H ASP A 113 -8.172 -7.736 -9.156 1.00 0.00 H new ATOM 0 HA ASP A 113 -8.870 -9.155 -11.458 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -10.140 -7.281 -10.356 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -8.910 -6.152 -10.887 1.00 0.00 H new ATOM 333 N ASN A 114 -6.178 -7.355 -11.849 1.00 0.00 N ATOM 334 CA ASN A 114 -5.106 -6.935 -12.743 1.00 0.00 C ATOM 335 C ASN A 114 -5.645 -5.985 -13.818 1.00 0.00 C ATOM 336 O ASN A 114 -5.338 -6.109 -15.003 1.00 0.00 O ATOM 337 CB ASN A 114 -4.349 -8.150 -13.302 1.00 0.00 C ATOM 338 CG ASN A 114 -2.962 -7.780 -13.830 1.00 0.00 C ATOM 339 OD1 ASN A 114 -1.951 -8.041 -13.184 1.00 0.00 O ATOM 340 ND2 ASN A 114 -2.879 -7.162 -15.002 1.00 0.00 N ATOM 0 H ASN A 114 -5.985 -7.142 -10.870 1.00 0.00 H new ATOM 0 HA ASN A 114 -4.367 -6.364 -12.181 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -4.248 -8.903 -12.520 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -4.932 -8.600 -14.105 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -1.967 -6.898 -15.376 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -3.727 -6.951 -15.529 1.00 0.00 H new ATOM 347 N SER A 115 -6.436 -5.004 -13.387 1.00 0.00 N ATOM 348 CA SER A 115 -6.875 -3.884 -14.208 1.00 0.00 C ATOM 349 C SER A 115 -5.728 -2.890 -14.382 1.00 0.00 C ATOM 350 O SER A 115 -5.569 -2.277 -15.434 1.00 0.00 O ATOM 351 CB SER A 115 -7.985 -3.166 -13.436 1.00 0.00 C ATOM 352 OG SER A 115 -7.540 -3.060 -12.095 1.00 0.00 O ATOM 0 H SER A 115 -6.797 -4.968 -12.434 1.00 0.00 H new ATOM 0 HA SER A 115 -7.209 -4.242 -15.182 1.00 0.00 H new ATOM 0 HB2 SER A 115 -8.177 -2.180 -13.860 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.920 -3.724 -13.491 1.00 0.00 H new ATOM 0 HG SER A 115 -8.043 -2.353 -11.638 1.00 0.00 H new ATOM 358 N GLY A 116 -4.973 -2.712 -13.297 1.00 0.00 N ATOM 359 CA GLY A 116 -3.981 -1.673 -13.110 1.00 0.00 C ATOM 360 C GLY A 116 -4.524 -0.633 -12.121 1.00 0.00 C ATOM 361 O GLY A 116 -3.856 0.368 -11.874 1.00 0.00 O ATOM 0 H GLY A 116 -5.048 -3.326 -12.486 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -3.053 -2.103 -12.732 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.748 -1.199 -14.064 1.00 0.00 H new ATOM 365 N THR A 117 -5.722 -0.852 -11.553 1.00 0.00 N ATOM 366 CA THR A 117 -6.374 0.046 -10.610 1.00 0.00 C ATOM 367 C THR A 117 -7.176 -0.789 -9.596 1.00 0.00 C ATOM 368 O THR A 117 -7.988 -1.629 -9.976 1.00 0.00 O ATOM 369 CB THR A 117 -7.273 1.032 -11.374 1.00 0.00 C ATOM 370 OG1 THR A 117 -8.221 0.315 -12.141 1.00 0.00 O ATOM 371 CG2 THR A 117 -6.504 1.952 -12.326 1.00 0.00 C ATOM 0 H THR A 117 -6.273 -1.688 -11.750 1.00 0.00 H new ATOM 0 HA THR A 117 -5.633 0.629 -10.063 1.00 0.00 H new ATOM 0 HB THR A 117 -7.747 1.654 -10.615 1.00 0.00 H new ATOM 0 HG1 THR A 117 -8.886 0.937 -12.504 1.00 0.00 H new ATOM 0 HG21 THR A 117 -7.203 2.620 -12.830 1.00 0.00 H new ATOM 0 HG22 THR A 117 -5.783 2.541 -11.759 1.00 0.00 H new ATOM 0 HG23 THR A 117 -5.978 1.351 -13.067 1.00 0.00 H new ATOM 379 N ILE A 118 -6.977 -0.582 -8.294 1.00 0.00 N ATOM 380 CA ILE A 118 -7.606 -1.424 -7.281 1.00 0.00 C ATOM 381 C ILE A 118 -9.065 -0.980 -7.146 1.00 0.00 C ATOM 382 O ILE A 118 -9.331 0.096 -6.620 1.00 0.00 O ATOM 383 CB ILE A 118 -6.877 -1.274 -5.932 1.00 0.00 C ATOM 384 CG1 ILE A 118 -5.365 -1.549 -5.998 1.00 0.00 C ATOM 385 CG2 ILE A 118 -7.500 -2.210 -4.889 1.00 0.00 C ATOM 386 CD1 ILE A 118 -4.640 -0.712 -4.940 1.00 0.00 C ATOM 0 H ILE A 118 -6.386 0.160 -7.919 1.00 0.00 H new ATOM 0 HA ILE A 118 -7.553 -2.472 -7.574 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.999 -0.228 -5.651 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.171 -2.609 -5.832 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.985 -1.307 -6.990 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -6.977 -2.096 -3.939 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -8.552 -1.958 -4.757 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -7.414 -3.242 -5.229 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -3.569 -0.910 -4.990 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -4.822 0.346 -5.126 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -5.012 -0.976 -3.950 1.00 0.00 H new ATOM 398 N THR A 119 -10.025 -1.771 -7.619 1.00 0.00 N ATOM 399 CA THR A 119 -11.431 -1.389 -7.539 1.00 0.00 C ATOM 400 C THR A 119 -11.999 -1.650 -6.144 1.00 0.00 C ATOM 401 O THR A 119 -11.446 -2.421 -5.362 1.00 0.00 O ATOM 402 CB THR A 119 -12.233 -2.154 -8.594 1.00 0.00 C ATOM 403 OG1 THR A 119 -12.214 -3.538 -8.308 1.00 0.00 O ATOM 404 CG2 THR A 119 -11.672 -1.887 -9.992 1.00 0.00 C ATOM 0 H THR A 119 -9.856 -2.675 -8.059 1.00 0.00 H new ATOM 0 HA THR A 119 -11.509 -0.319 -7.732 1.00 0.00 H new ATOM 0 HB THR A 119 -13.266 -1.806 -8.569 1.00 0.00 H new ATOM 0 HG1 THR A 119 -11.310 -3.889 -8.450 1.00 0.00 H new ATOM 0 HG21 THR A 119 -12.255 -2.439 -10.729 1.00 0.00 H new ATOM 0 HG22 THR A 119 -11.729 -0.820 -10.209 1.00 0.00 H new ATOM 0 HG23 THR A 119 -10.632 -2.211 -10.035 1.00 0.00 H new ATOM 412 N ILE A 120 -13.164 -1.065 -5.854 1.00 0.00 N ATOM 413 CA ILE A 120 -13.918 -1.397 -4.650 1.00 0.00 C ATOM 414 C ILE A 120 -14.168 -2.913 -4.563 1.00 0.00 C ATOM 415 O ILE A 120 -14.112 -3.504 -3.486 1.00 0.00 O ATOM 416 CB ILE A 120 -15.187 -0.540 -4.585 1.00 0.00 C ATOM 417 CG1 ILE A 120 -15.669 -0.427 -3.134 1.00 0.00 C ATOM 418 CG2 ILE A 120 -16.296 -1.015 -5.533 1.00 0.00 C ATOM 419 CD1 ILE A 120 -16.493 0.831 -2.931 1.00 0.00 C ATOM 0 H ILE A 120 -13.604 -0.357 -6.441 1.00 0.00 H new ATOM 0 HA ILE A 120 -13.338 -1.154 -3.760 1.00 0.00 H new ATOM 0 HB ILE A 120 -14.925 0.456 -4.943 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -16.265 -1.302 -2.876 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -14.811 -0.416 -2.462 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -17.164 -0.363 -5.434 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -15.934 -0.984 -6.561 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -16.579 -2.036 -5.279 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -16.822 0.887 -1.893 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -15.886 1.705 -3.167 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -17.363 0.806 -3.587 1.00 0.00 H new ATOM 431 N LYS A 121 -14.395 -3.551 -5.716 1.00 0.00 N ATOM 432 CA LYS A 121 -14.548 -4.994 -5.810 1.00 0.00 C ATOM 433 C LYS A 121 -13.252 -5.696 -5.398 1.00 0.00 C ATOM 434 O LYS A 121 -13.293 -6.639 -4.610 1.00 0.00 O ATOM 435 CB LYS A 121 -14.968 -5.401 -7.228 1.00 0.00 C ATOM 436 CG LYS A 121 -16.282 -4.727 -7.643 1.00 0.00 C ATOM 437 CD LYS A 121 -16.834 -5.298 -8.957 1.00 0.00 C ATOM 438 CE LYS A 121 -15.909 -5.019 -10.149 1.00 0.00 C ATOM 439 NZ LYS A 121 -16.520 -5.460 -11.415 1.00 0.00 N ATOM 0 H LYS A 121 -14.477 -3.071 -6.612 1.00 0.00 H new ATOM 0 HA LYS A 121 -15.336 -5.306 -5.124 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -14.181 -5.131 -7.933 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.082 -6.484 -7.278 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.021 -4.857 -6.853 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -16.120 -3.655 -7.754 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -16.973 -6.374 -8.853 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -17.816 -4.867 -9.153 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -15.690 -3.952 -10.200 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -14.959 -5.533 -10.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -15.871 -5.258 -12.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -16.706 -6.482 -11.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -17.415 -4.951 -11.565 1.00 0.00 H new ATOM 453 N ASP A 122 -12.102 -5.224 -5.901 1.00 0.00 N ATOM 454 CA ASP A 122 -10.809 -5.768 -5.488 1.00 0.00 C ATOM 455 C ASP A 122 -10.682 -5.658 -3.968 1.00 0.00 C ATOM 456 O ASP A 122 -10.308 -6.619 -3.299 1.00 0.00 O ATOM 457 CB ASP A 122 -9.627 -5.058 -6.165 1.00 0.00 C ATOM 458 CG ASP A 122 -9.439 -5.415 -7.636 1.00 0.00 C ATOM 459 OD1 ASP A 122 -9.008 -6.559 -7.909 1.00 0.00 O ATOM 460 OD2 ASP A 122 -9.708 -4.517 -8.466 1.00 0.00 O ATOM 0 H ASP A 122 -12.045 -4.473 -6.589 1.00 0.00 H new ATOM 0 HA ASP A 122 -10.773 -6.812 -5.800 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -9.769 -3.981 -6.080 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -8.713 -5.303 -5.624 1.00 0.00 H new ATOM 465 N LEU A 123 -11.008 -4.491 -3.409 1.00 0.00 N ATOM 466 CA LEU A 123 -10.943 -4.303 -1.968 1.00 0.00 C ATOM 467 C LEU A 123 -11.855 -5.293 -1.237 1.00 0.00 C ATOM 468 O LEU A 123 -11.411 -5.932 -0.286 1.00 0.00 O ATOM 469 CB LEU A 123 -11.253 -2.854 -1.580 1.00 0.00 C ATOM 470 CG LEU A 123 -10.266 -1.838 -2.171 1.00 0.00 C ATOM 471 CD1 LEU A 123 -10.784 -0.422 -1.912 1.00 0.00 C ATOM 472 CD2 LEU A 123 -8.859 -1.984 -1.581 1.00 0.00 C ATOM 0 H LEU A 123 -11.317 -3.671 -3.932 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.920 -4.510 -1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -12.261 -2.605 -1.912 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -11.245 -2.767 -0.493 1.00 0.00 H new ATOM 0 HG LEU A 123 -10.193 -2.030 -3.242 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.086 0.303 -2.330 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.759 -0.300 -2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -10.876 -0.259 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -8.197 -1.244 -2.031 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.899 -1.828 -0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -8.479 -2.984 -1.789 1.00 0.00 H new ATOM 484 N ARG A 124 -13.112 -5.454 -1.667 1.00 0.00 N ATOM 485 CA ARG A 124 -14.004 -6.426 -1.040 1.00 0.00 C ATOM 486 C ARG A 124 -13.396 -7.831 -1.116 1.00 0.00 C ATOM 487 O ARG A 124 -13.351 -8.536 -0.113 1.00 0.00 O ATOM 488 CB ARG A 124 -15.415 -6.372 -1.652 1.00 0.00 C ATOM 489 CG ARG A 124 -16.417 -7.192 -0.818 1.00 0.00 C ATOM 490 CD ARG A 124 -17.132 -6.381 0.274 1.00 0.00 C ATOM 491 NE ARG A 124 -18.342 -5.738 -0.258 1.00 0.00 N ATOM 492 CZ ARG A 124 -19.483 -5.590 0.434 1.00 0.00 C ATOM 493 NH1 ARG A 124 -19.486 -5.688 1.768 1.00 0.00 N ATOM 494 NH2 ARG A 124 -20.624 -5.359 -0.223 1.00 0.00 N ATOM 0 H ARG A 124 -13.527 -4.929 -2.437 1.00 0.00 H new ATOM 0 HA ARG A 124 -14.113 -6.166 0.013 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -15.749 -5.336 -1.711 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -15.387 -6.756 -2.672 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -17.164 -7.621 -1.486 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -15.890 -8.025 -0.352 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -17.398 -7.036 1.104 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -16.457 -5.623 0.670 1.00 0.00 H new ATOM 0 HE ARG A 124 -18.313 -5.382 -1.213 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -18.617 -5.877 2.267 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -20.357 -5.574 2.286 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -20.623 -5.297 -1.241 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -21.496 -5.245 0.294 1.00 0.00 H new ATOM 508 N ARG A 125 -12.919 -8.235 -2.295 1.00 0.00 N ATOM 509 CA ARG A 125 -12.233 -9.504 -2.502 1.00 0.00 C ATOM 510 C ARG A 125 -11.113 -9.697 -1.466 1.00 0.00 C ATOM 511 O ARG A 125 -11.118 -10.680 -0.724 1.00 0.00 O ATOM 512 CB ARG A 125 -11.777 -9.559 -3.967 1.00 0.00 C ATOM 513 CG ARG A 125 -10.817 -10.693 -4.324 1.00 0.00 C ATOM 514 CD ARG A 125 -11.360 -12.096 -4.016 1.00 0.00 C ATOM 515 NE ARG A 125 -10.933 -13.088 -5.017 1.00 0.00 N ATOM 516 CZ ARG A 125 -9.685 -13.278 -5.477 1.00 0.00 C ATOM 517 NH1 ARG A 125 -8.632 -12.691 -4.901 1.00 0.00 N ATOM 518 NH2 ARG A 125 -9.490 -14.060 -6.543 1.00 0.00 N ATOM 0 H ARG A 125 -13.002 -7.677 -3.145 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.896 -10.353 -2.336 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -12.661 -9.644 -4.600 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.298 -8.612 -4.214 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -10.579 -10.632 -5.386 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.884 -10.549 -3.780 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.018 -12.408 -3.029 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -12.449 -12.063 -3.981 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.659 -13.693 -5.401 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.766 -12.083 -4.093 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -7.694 -12.851 -5.269 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -10.285 -14.507 -7.000 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -8.546 -14.210 -6.900 1.00 0.00 H new ATOM 532 N VAL A 126 -10.186 -8.738 -1.375 1.00 0.00 N ATOM 533 CA VAL A 126 -9.123 -8.748 -0.372 1.00 0.00 C ATOM 534 C VAL A 126 -9.713 -8.931 1.028 1.00 0.00 C ATOM 535 O VAL A 126 -9.285 -9.803 1.781 1.00 0.00 O ATOM 536 CB VAL A 126 -8.317 -7.440 -0.455 1.00 0.00 C ATOM 537 CG1 VAL A 126 -7.343 -7.268 0.719 1.00 0.00 C ATOM 538 CG2 VAL A 126 -7.514 -7.380 -1.754 1.00 0.00 C ATOM 0 H VAL A 126 -10.154 -7.931 -1.998 1.00 0.00 H new ATOM 0 HA VAL A 126 -8.454 -9.585 -0.570 1.00 0.00 H new ATOM 0 HB VAL A 126 -9.050 -6.634 -0.419 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -6.802 -6.328 0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -7.900 -7.257 1.656 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -6.634 -8.096 0.728 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -6.952 -6.447 -1.791 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -6.823 -8.222 -1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -8.194 -7.428 -2.605 1.00 0.00 H new ATOM 548 N ALA A 127 -10.680 -8.088 1.384 1.00 0.00 N ATOM 549 CA ALA A 127 -11.305 -8.076 2.695 1.00 0.00 C ATOM 550 C ALA A 127 -11.823 -9.475 3.053 1.00 0.00 C ATOM 551 O ALA A 127 -11.456 -10.053 4.077 1.00 0.00 O ATOM 552 CB ALA A 127 -12.414 -7.018 2.687 1.00 0.00 C ATOM 0 H ALA A 127 -11.055 -7.381 0.752 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.582 -7.813 3.468 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.898 -6.991 3.663 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.983 -6.041 2.469 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -13.150 -7.269 1.923 1.00 0.00 H new ATOM 558 N LYS A 128 -12.635 -10.041 2.158 1.00 0.00 N ATOM 559 CA LYS A 128 -13.172 -11.386 2.283 1.00 0.00 C ATOM 560 C LYS A 128 -12.043 -12.402 2.476 1.00 0.00 C ATOM 561 O LYS A 128 -12.118 -13.216 3.392 1.00 0.00 O ATOM 562 CB LYS A 128 -14.039 -11.724 1.061 1.00 0.00 C ATOM 563 CG LYS A 128 -15.301 -10.852 0.960 1.00 0.00 C ATOM 564 CD LYS A 128 -16.434 -11.355 1.866 1.00 0.00 C ATOM 565 CE LYS A 128 -17.628 -10.389 1.869 1.00 0.00 C ATOM 566 NZ LYS A 128 -18.181 -10.174 0.520 1.00 0.00 N ATOM 0 H LYS A 128 -12.940 -9.562 1.311 1.00 0.00 H new ATOM 0 HA LYS A 128 -13.807 -11.435 3.168 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -13.445 -11.600 0.156 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -14.332 -12.773 1.109 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -15.053 -9.825 1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -15.646 -10.836 -0.074 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.762 -12.338 1.528 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.061 -11.476 2.883 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.409 -10.783 2.520 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -17.316 -9.432 2.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -19.053 -9.612 0.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -17.486 -9.665 -0.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.394 -11.093 0.082 1.00 0.00 H new ATOM 580 N GLU A 129 -10.988 -12.348 1.654 1.00 0.00 N ATOM 581 CA GLU A 129 -9.835 -13.233 1.820 1.00 0.00 C ATOM 582 C GLU A 129 -9.205 -13.094 3.211 1.00 0.00 C ATOM 583 O GLU A 129 -8.883 -14.101 3.838 1.00 0.00 O ATOM 584 CB GLU A 129 -8.789 -12.981 0.729 1.00 0.00 C ATOM 585 CG GLU A 129 -9.271 -13.473 -0.638 1.00 0.00 C ATOM 586 CD GLU A 129 -8.284 -13.073 -1.728 1.00 0.00 C ATOM 587 OE1 GLU A 129 -8.416 -11.932 -2.224 1.00 0.00 O ATOM 588 OE2 GLU A 129 -7.410 -13.908 -2.042 1.00 0.00 O ATOM 0 H GLU A 129 -10.912 -11.701 0.869 1.00 0.00 H new ATOM 0 HA GLU A 129 -10.198 -14.256 1.723 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -8.568 -11.915 0.675 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.860 -13.487 0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -9.384 -14.557 -0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -10.253 -13.053 -0.857 1.00 0.00 H new ATOM 595 N LEU A 130 -9.012 -11.863 3.696 1.00 0.00 N ATOM 596 CA LEU A 130 -8.492 -11.644 5.043 1.00 0.00 C ATOM 597 C LEU A 130 -9.468 -12.179 6.099 1.00 0.00 C ATOM 598 O LEU A 130 -9.055 -12.515 7.205 1.00 0.00 O ATOM 599 CB LEU A 130 -8.251 -10.145 5.288 1.00 0.00 C ATOM 600 CG LEU A 130 -7.151 -9.528 4.410 1.00 0.00 C ATOM 601 CD1 LEU A 130 -7.246 -8.000 4.481 1.00 0.00 C ATOM 602 CD2 LEU A 130 -5.750 -9.949 4.865 1.00 0.00 C ATOM 0 H LEU A 130 -9.208 -11.008 3.175 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.548 -12.182 5.127 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -9.183 -9.606 5.114 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -7.988 -9.998 6.336 1.00 0.00 H new ATOM 0 HG LEU A 130 -7.303 -9.885 3.391 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -6.467 -7.558 3.860 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -8.224 -7.679 4.121 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -7.115 -7.675 5.513 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -5.004 -9.490 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -5.588 -9.623 5.892 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -5.660 -11.034 4.810 1.00 0.00 H new ATOM 614 N GLY A 131 -10.759 -12.246 5.762 1.00 0.00 N ATOM 615 CA GLY A 131 -11.835 -12.662 6.651 1.00 0.00 C ATOM 616 C GLY A 131 -12.686 -11.456 7.040 1.00 0.00 C ATOM 617 O GLY A 131 -13.890 -11.581 7.275 1.00 0.00 O ATOM 0 H GLY A 131 -11.090 -12.002 4.828 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -12.455 -13.412 6.159 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -11.420 -13.128 7.545 1.00 0.00 H new ATOM 621 N GLU A 132 -12.065 -10.276 7.093 1.00 0.00 N ATOM 622 CA GLU A 132 -12.722 -9.019 7.382 1.00 0.00 C ATOM 623 C GLU A 132 -13.797 -8.749 6.334 1.00 0.00 C ATOM 624 O GLU A 132 -13.508 -8.228 5.262 1.00 0.00 O ATOM 625 CB GLU A 132 -11.673 -7.896 7.401 1.00 0.00 C ATOM 626 CG GLU A 132 -10.609 -8.110 8.486 1.00 0.00 C ATOM 627 CD GLU A 132 -11.224 -8.143 9.882 1.00 0.00 C ATOM 628 OE1 GLU A 132 -11.869 -7.129 10.229 1.00 0.00 O ATOM 629 OE2 GLU A 132 -11.044 -9.170 10.569 1.00 0.00 O ATOM 0 H GLU A 132 -11.063 -10.176 6.930 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.204 -9.063 8.359 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.188 -7.838 6.426 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.170 -6.940 7.567 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -10.082 -9.045 8.299 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -9.870 -7.311 8.433 1.00 0.00 H new ATOM 636 N ASN A 133 -15.052 -9.069 6.643 1.00 0.00 N ATOM 637 CA ASN A 133 -16.179 -8.773 5.767 1.00 0.00 C ATOM 638 C ASN A 133 -16.465 -7.268 5.818 1.00 0.00 C ATOM 639 O ASN A 133 -17.457 -6.833 6.397 1.00 0.00 O ATOM 640 CB ASN A 133 -17.399 -9.620 6.167 1.00 0.00 C ATOM 641 CG ASN A 133 -17.355 -11.041 5.604 1.00 0.00 C ATOM 642 OD1 ASN A 133 -18.299 -11.476 4.952 1.00 0.00 O ATOM 643 ND2 ASN A 133 -16.280 -11.793 5.825 1.00 0.00 N ATOM 0 H ASN A 133 -15.314 -9.541 7.508 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.941 -9.036 4.736 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.459 -9.668 7.254 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.306 -9.126 5.819 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -16.235 -12.741 5.451 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -15.501 -11.422 6.368 1.00 0.00 H new ATOM 650 N LEU A 134 -15.573 -6.465 5.227 1.00 0.00 N ATOM 651 CA LEU A 134 -15.707 -5.017 5.184 1.00 0.00 C ATOM 652 C LEU A 134 -16.971 -4.637 4.410 1.00 0.00 C ATOM 653 O LEU A 134 -17.329 -5.286 3.425 1.00 0.00 O ATOM 654 CB LEU A 134 -14.457 -4.369 4.560 1.00 0.00 C ATOM 655 CG LEU A 134 -13.206 -4.457 5.458 1.00 0.00 C ATOM 656 CD1 LEU A 134 -11.948 -3.998 4.705 1.00 0.00 C ATOM 657 CD2 LEU A 134 -13.358 -3.578 6.705 1.00 0.00 C ATOM 0 H LEU A 134 -14.733 -6.812 4.763 1.00 0.00 H new ATOM 0 HA LEU A 134 -15.797 -4.640 6.203 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.245 -4.852 3.606 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -14.669 -3.321 4.347 1.00 0.00 H new ATOM 0 HG LEU A 134 -13.103 -5.502 5.749 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.083 -4.071 5.364 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -11.794 -4.633 3.832 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -12.073 -2.964 4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.461 -3.660 7.319 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -13.498 -2.540 6.404 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -14.223 -3.909 7.280 1.00 0.00 H new ATOM 669 N THR A 135 -17.652 -3.584 4.862 1.00 0.00 N ATOM 670 CA THR A 135 -18.844 -3.076 4.212 1.00 0.00 C ATOM 671 C THR A 135 -18.432 -2.284 2.975 1.00 0.00 C ATOM 672 O THR A 135 -17.414 -1.587 2.990 1.00 0.00 O ATOM 673 CB THR A 135 -19.634 -2.196 5.192 1.00 0.00 C ATOM 674 OG1 THR A 135 -18.824 -1.131 5.649 1.00 0.00 O ATOM 675 CG2 THR A 135 -20.119 -3.010 6.396 1.00 0.00 C ATOM 0 H THR A 135 -17.384 -3.061 5.696 1.00 0.00 H new ATOM 0 HA THR A 135 -19.487 -3.901 3.905 1.00 0.00 H new ATOM 0 HB THR A 135 -20.501 -1.801 4.662 1.00 0.00 H new ATOM 0 HG1 THR A 135 -19.336 -0.574 6.272 1.00 0.00 H new ATOM 0 HG21 THR A 135 -20.675 -2.362 7.073 1.00 0.00 H new ATOM 0 HG22 THR A 135 -20.766 -3.817 6.053 1.00 0.00 H new ATOM 0 HG23 THR A 135 -19.261 -3.431 6.920 1.00 0.00 H new ATOM 683 N GLU A 136 -19.247 -2.353 1.917 1.00 0.00 N ATOM 684 CA GLU A 136 -19.034 -1.545 0.726 1.00 0.00 C ATOM 685 C GLU A 136 -18.844 -0.080 1.119 1.00 0.00 C ATOM 686 O GLU A 136 -17.966 0.582 0.587 1.00 0.00 O ATOM 687 CB GLU A 136 -20.196 -1.726 -0.257 1.00 0.00 C ATOM 688 CG GLU A 136 -19.866 -1.119 -1.627 1.00 0.00 C ATOM 689 CD GLU A 136 -20.958 -1.428 -2.646 1.00 0.00 C ATOM 690 OE1 GLU A 136 -21.056 -2.616 -3.023 1.00 0.00 O ATOM 691 OE2 GLU A 136 -21.679 -0.476 -3.016 1.00 0.00 O ATOM 0 H GLU A 136 -20.062 -2.965 1.868 1.00 0.00 H new ATOM 0 HA GLU A 136 -18.127 -1.876 0.221 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -20.417 -2.787 -0.371 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -21.093 -1.255 0.146 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -19.750 -0.039 -1.531 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -18.913 -1.512 -1.981 1.00 0.00 H new ATOM 698 N GLU A 137 -19.638 0.412 2.076 1.00 0.00 N ATOM 699 CA GLU A 137 -19.508 1.761 2.606 1.00 0.00 C ATOM 700 C GLU A 137 -18.085 2.030 3.114 1.00 0.00 C ATOM 701 O GLU A 137 -17.458 2.990 2.669 1.00 0.00 O ATOM 702 CB GLU A 137 -20.562 1.974 3.703 1.00 0.00 C ATOM 703 CG GLU A 137 -20.588 3.428 4.195 1.00 0.00 C ATOM 704 CD GLU A 137 -21.680 3.641 5.239 1.00 0.00 C ATOM 705 OE1 GLU A 137 -21.641 2.914 6.255 1.00 0.00 O ATOM 706 OE2 GLU A 137 -22.540 4.515 4.994 1.00 0.00 O ATOM 0 H GLU A 137 -20.393 -0.124 2.504 1.00 0.00 H new ATOM 0 HA GLU A 137 -19.686 2.481 1.807 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -21.546 1.703 3.320 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -20.353 1.310 4.542 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -19.619 3.687 4.621 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -20.754 4.097 3.351 1.00 0.00 H new ATOM 713 N GLU A 138 -17.556 1.200 4.025 1.00 0.00 N ATOM 714 CA GLU A 138 -16.200 1.396 4.534 1.00 0.00 C ATOM 715 C GLU A 138 -15.201 1.422 3.379 1.00 0.00 C ATOM 716 O GLU A 138 -14.346 2.306 3.303 1.00 0.00 O ATOM 717 CB GLU A 138 -15.843 0.289 5.536 1.00 0.00 C ATOM 718 CG GLU A 138 -16.525 0.505 6.898 1.00 0.00 C ATOM 719 CD GLU A 138 -15.702 1.385 7.838 1.00 0.00 C ATOM 720 OE1 GLU A 138 -15.180 2.416 7.362 1.00 0.00 O ATOM 721 OE2 GLU A 138 -15.585 0.988 9.018 1.00 0.00 O ATOM 0 H GLU A 138 -18.045 0.396 4.418 1.00 0.00 H new ATOM 0 HA GLU A 138 -16.153 2.355 5.051 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -16.141 -0.678 5.130 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -14.762 0.258 5.672 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -17.502 0.962 6.742 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -16.697 -0.462 7.371 1.00 0.00 H new ATOM 728 N LEU A 139 -15.324 0.466 2.458 1.00 0.00 N ATOM 729 CA LEU A 139 -14.474 0.458 1.279 1.00 0.00 C ATOM 730 C LEU A 139 -14.618 1.761 0.487 1.00 0.00 C ATOM 731 O LEU A 139 -13.631 2.293 -0.011 1.00 0.00 O ATOM 732 CB LEU A 139 -14.768 -0.764 0.407 1.00 0.00 C ATOM 733 CG LEU A 139 -14.585 -2.091 1.152 1.00 0.00 C ATOM 734 CD1 LEU A 139 -14.860 -3.236 0.183 1.00 0.00 C ATOM 735 CD2 LEU A 139 -13.179 -2.210 1.743 1.00 0.00 C ATOM 0 H LEU A 139 -15.995 -0.300 2.508 1.00 0.00 H new ATOM 0 HA LEU A 139 -13.437 0.390 1.608 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -15.791 -0.701 0.036 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -14.111 -0.749 -0.463 1.00 0.00 H new ATOM 0 HG LEU A 139 -15.287 -2.133 1.985 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -14.734 -4.188 0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -15.881 -3.159 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -14.162 -3.181 -0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -13.083 -3.162 2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -12.442 -2.159 0.942 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -13.009 -1.393 2.445 1.00 0.00 H new ATOM 747 N GLN A 140 -15.833 2.293 0.379 1.00 0.00 N ATOM 748 CA GLN A 140 -16.086 3.541 -0.313 1.00 0.00 C ATOM 749 C GLN A 140 -15.384 4.691 0.407 1.00 0.00 C ATOM 750 O GLN A 140 -14.796 5.540 -0.248 1.00 0.00 O ATOM 751 CB GLN A 140 -17.593 3.802 -0.472 1.00 0.00 C ATOM 752 CG GLN A 140 -17.930 4.299 -1.882 1.00 0.00 C ATOM 753 CD GLN A 140 -17.112 5.521 -2.290 1.00 0.00 C ATOM 754 OE1 GLN A 140 -17.278 6.599 -1.732 1.00 0.00 O ATOM 755 NE2 GLN A 140 -16.217 5.363 -3.262 1.00 0.00 N ATOM 0 H GLN A 140 -16.670 1.863 0.773 1.00 0.00 H new ATOM 0 HA GLN A 140 -15.674 3.468 -1.320 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -18.146 2.886 -0.266 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -17.915 4.540 0.262 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -17.755 3.495 -2.597 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -18.991 4.545 -1.932 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -16.103 4.452 -3.707 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -15.645 6.153 -3.562 1.00 0.00 H new ATOM 764 N GLU A 141 -15.408 4.728 1.741 1.00 0.00 N ATOM 765 CA GLU A 141 -14.658 5.730 2.494 1.00 0.00 C ATOM 766 C GLU A 141 -13.164 5.637 2.150 1.00 0.00 C ATOM 767 O GLU A 141 -12.527 6.636 1.812 1.00 0.00 O ATOM 768 CB GLU A 141 -14.902 5.554 4.000 1.00 0.00 C ATOM 769 CG GLU A 141 -16.367 5.802 4.386 1.00 0.00 C ATOM 770 CD GLU A 141 -16.639 5.393 5.831 1.00 0.00 C ATOM 771 OE1 GLU A 141 -15.955 5.954 6.714 1.00 0.00 O ATOM 772 OE2 GLU A 141 -17.525 4.531 6.026 1.00 0.00 O ATOM 0 H GLU A 141 -15.938 4.076 2.319 1.00 0.00 H new ATOM 0 HA GLU A 141 -15.005 6.725 2.215 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -14.616 4.545 4.297 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -14.262 6.242 4.552 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -16.606 6.857 4.254 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -17.021 5.241 3.718 1.00 0.00 H new ATOM 779 N MET A 142 -12.612 4.422 2.223 1.00 0.00 N ATOM 780 CA MET A 142 -11.218 4.151 1.881 1.00 0.00 C ATOM 781 C MET A 142 -10.893 4.645 0.468 1.00 0.00 C ATOM 782 O MET A 142 -9.885 5.324 0.259 1.00 0.00 O ATOM 783 CB MET A 142 -10.943 2.652 2.029 1.00 0.00 C ATOM 784 CG MET A 142 -11.047 2.209 3.491 1.00 0.00 C ATOM 785 SD MET A 142 -11.285 0.434 3.721 1.00 0.00 S ATOM 786 CE MET A 142 -9.702 -0.186 3.127 1.00 0.00 C ATOM 0 H MET A 142 -13.127 3.594 2.524 1.00 0.00 H new ATOM 0 HA MET A 142 -10.567 4.696 2.565 1.00 0.00 H new ATOM 0 HB2 MET A 142 -11.654 2.088 1.425 1.00 0.00 H new ATOM 0 HB3 MET A 142 -9.948 2.423 1.647 1.00 0.00 H new ATOM 0 HG2 MET A 142 -10.140 2.512 4.015 1.00 0.00 H new ATOM 0 HG3 MET A 142 -11.877 2.738 3.959 1.00 0.00 H new ATOM 0 HE1 MET A 142 -9.552 -1.204 3.486 1.00 0.00 H new ATOM 0 HE2 MET A 142 -9.695 -0.181 2.037 1.00 0.00 H new ATOM 0 HE3 MET A 142 -8.899 0.452 3.498 1.00 0.00 H new ATOM 796 N ILE A 143 -11.763 4.314 -0.490 1.00 0.00 N ATOM 797 CA ILE A 143 -11.665 4.782 -1.863 1.00 0.00 C ATOM 798 C ILE A 143 -11.648 6.305 -1.879 1.00 0.00 C ATOM 799 O ILE A 143 -10.688 6.883 -2.364 1.00 0.00 O ATOM 800 CB ILE A 143 -12.779 4.179 -2.748 1.00 0.00 C ATOM 801 CG1 ILE A 143 -12.612 2.650 -2.909 1.00 0.00 C ATOM 802 CG2 ILE A 143 -12.893 4.896 -4.103 1.00 0.00 C ATOM 803 CD1 ILE A 143 -12.370 2.138 -4.337 1.00 0.00 C ATOM 0 H ILE A 143 -12.564 3.705 -0.325 1.00 0.00 H new ATOM 0 HA ILE A 143 -10.728 4.435 -2.298 1.00 0.00 H new ATOM 0 HB ILE A 143 -13.724 4.344 -2.231 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -11.778 2.329 -2.285 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -13.507 2.165 -2.519 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -13.689 4.438 -4.691 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -13.123 5.949 -3.939 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -11.949 4.810 -4.641 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -12.269 1.053 -4.322 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -13.212 2.415 -4.971 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -11.457 2.582 -4.733 1.00 0.00 H new ATOM 815 N ALA A 144 -12.680 6.962 -1.356 1.00 0.00 N ATOM 816 CA ALA A 144 -12.829 8.409 -1.385 1.00 0.00 C ATOM 817 C ALA A 144 -11.593 9.112 -0.817 1.00 0.00 C ATOM 818 O ALA A 144 -11.130 10.097 -1.385 1.00 0.00 O ATOM 819 CB ALA A 144 -14.102 8.797 -0.629 1.00 0.00 C ATOM 0 H ALA A 144 -13.453 6.488 -0.889 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.920 8.739 -2.420 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -14.220 9.880 -0.647 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -14.964 8.330 -1.105 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -14.030 8.457 0.404 1.00 0.00 H new ATOM 825 N GLU A 145 -11.044 8.600 0.288 1.00 0.00 N ATOM 826 CA GLU A 145 -9.830 9.145 0.886 1.00 0.00 C ATOM 827 C GLU A 145 -8.653 9.119 -0.104 1.00 0.00 C ATOM 828 O GLU A 145 -7.876 10.069 -0.176 1.00 0.00 O ATOM 829 CB GLU A 145 -9.518 8.348 2.162 1.00 0.00 C ATOM 830 CG GLU A 145 -8.359 8.908 3.002 1.00 0.00 C ATOM 831 CD GLU A 145 -8.756 10.121 3.839 1.00 0.00 C ATOM 832 OE1 GLU A 145 -8.930 11.202 3.239 1.00 0.00 O ATOM 833 OE2 GLU A 145 -8.870 9.941 5.071 1.00 0.00 O ATOM 0 H GLU A 145 -11.429 7.799 0.789 1.00 0.00 H new ATOM 0 HA GLU A 145 -9.987 10.193 1.143 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -10.414 8.314 2.781 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -9.284 7.320 1.884 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -7.986 8.125 3.662 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -7.539 9.184 2.340 1.00 0.00 H new ATOM 840 N ALA A 146 -8.483 8.009 -0.828 1.00 0.00 N ATOM 841 CA ALA A 146 -7.306 7.773 -1.661 1.00 0.00 C ATOM 842 C ALA A 146 -7.462 8.309 -3.089 1.00 0.00 C ATOM 843 O ALA A 146 -6.510 8.799 -3.695 1.00 0.00 O ATOM 844 CB ALA A 146 -7.057 6.264 -1.702 1.00 0.00 C ATOM 0 H ALA A 146 -9.162 7.248 -0.851 1.00 0.00 H new ATOM 0 HA ALA A 146 -6.465 8.310 -1.223 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -6.182 6.056 -2.318 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -6.884 5.896 -0.691 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -7.927 5.763 -2.127 1.00 0.00 H new ATOM 850 N ASP A 147 -8.655 8.146 -3.659 1.00 0.00 N ATOM 851 CA ASP A 147 -8.948 8.378 -5.059 1.00 0.00 C ATOM 852 C ASP A 147 -9.130 9.870 -5.328 1.00 0.00 C ATOM 853 O ASP A 147 -10.200 10.422 -5.086 1.00 0.00 O ATOM 854 CB ASP A 147 -10.205 7.575 -5.436 1.00 0.00 C ATOM 855 CG ASP A 147 -10.556 7.637 -6.916 1.00 0.00 C ATOM 856 OD1 ASP A 147 -9.882 8.410 -7.625 1.00 0.00 O ATOM 857 OD2 ASP A 147 -11.518 6.943 -7.315 1.00 0.00 O ATOM 0 H ASP A 147 -9.471 7.836 -3.131 1.00 0.00 H new ATOM 0 HA ASP A 147 -8.115 8.043 -5.677 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -10.058 6.533 -5.151 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -11.050 7.948 -4.856 1.00 0.00 H new ATOM 924 N ASN A 152 -13.514 5.611 -8.777 1.00 0.00 N ATOM 925 CA ASN A 152 -13.796 4.554 -7.816 1.00 0.00 C ATOM 926 C ASN A 152 -12.875 3.347 -8.054 1.00 0.00 C ATOM 927 O ASN A 152 -13.277 2.193 -7.898 1.00 0.00 O ATOM 928 CB ASN A 152 -15.303 4.239 -7.787 1.00 0.00 C ATOM 929 CG ASN A 152 -15.744 3.368 -6.611 1.00 0.00 C ATOM 930 OD1 ASN A 152 -16.187 3.862 -5.577 1.00 0.00 O ATOM 931 ND2 ASN A 152 -15.676 2.056 -6.768 1.00 0.00 N ATOM 0 HA ASN A 152 -13.560 4.889 -6.806 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -15.857 5.177 -7.756 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -15.575 3.738 -8.716 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -15.995 1.436 -6.023 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -15.305 1.665 -7.634 1.00 0.00 H new ATOM 938 N GLU A 153 -11.616 3.626 -8.415 1.00 0.00 N ATOM 939 CA GLU A 153 -10.534 2.660 -8.482 1.00 0.00 C ATOM 940 C GLU A 153 -9.270 3.361 -7.974 1.00 0.00 C ATOM 941 O GLU A 153 -9.057 4.527 -8.300 1.00 0.00 O ATOM 942 CB GLU A 153 -10.330 2.160 -9.920 1.00 0.00 C ATOM 943 CG GLU A 153 -11.626 1.975 -10.720 1.00 0.00 C ATOM 944 CD GLU A 153 -11.381 1.343 -12.088 1.00 0.00 C ATOM 945 OE1 GLU A 153 -10.410 1.768 -12.752 1.00 0.00 O ATOM 946 OE2 GLU A 153 -12.163 0.436 -12.441 1.00 0.00 O ATOM 0 H GLU A 153 -11.322 4.567 -8.676 1.00 0.00 H new ATOM 0 HA GLU A 153 -10.767 1.788 -7.871 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -9.689 2.866 -10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -9.799 1.209 -9.888 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -12.314 1.349 -10.152 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -12.110 2.943 -10.851 1.00 0.00 H new ATOM 953 N ILE A 154 -8.437 2.687 -7.176 1.00 0.00 N ATOM 954 CA ILE A 154 -7.201 3.275 -6.675 1.00 0.00 C ATOM 955 C ILE A 154 -6.104 3.009 -7.700 1.00 0.00 C ATOM 956 O ILE A 154 -5.694 1.861 -7.870 1.00 0.00 O ATOM 957 CB ILE A 154 -6.784 2.741 -5.298 1.00 0.00 C ATOM 958 CG1 ILE A 154 -7.957 2.392 -4.388 1.00 0.00 C ATOM 959 CG2 ILE A 154 -5.843 3.740 -4.612 1.00 0.00 C ATOM 960 CD1 ILE A 154 -8.938 3.524 -4.123 1.00 0.00 C ATOM 0 H ILE A 154 -8.601 1.730 -6.864 1.00 0.00 H new ATOM 0 HA ILE A 154 -7.366 4.344 -6.538 1.00 0.00 H new ATOM 0 HB ILE A 154 -6.262 1.801 -5.477 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -8.502 1.558 -4.830 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -7.563 2.045 -3.433 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -5.552 3.354 -3.635 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -4.954 3.883 -5.226 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -6.354 4.694 -4.487 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -9.733 3.171 -3.466 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -8.416 4.354 -3.647 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -9.370 3.860 -5.066 1.00 0.00 H new ATOM 972 N ASP A 155 -5.626 4.042 -8.389 1.00 0.00 N ATOM 973 CA ASP A 155 -4.478 3.907 -9.275 1.00 0.00 C ATOM 974 C ASP A 155 -3.181 3.876 -8.454 1.00 0.00 C ATOM 975 O ASP A 155 -3.182 4.158 -7.254 1.00 0.00 O ATOM 976 CB ASP A 155 -4.485 4.985 -10.375 1.00 0.00 C ATOM 977 CG ASP A 155 -4.211 6.403 -9.880 1.00 0.00 C ATOM 978 OD1 ASP A 155 -3.198 6.585 -9.172 1.00 0.00 O ATOM 979 OD2 ASP A 155 -5.012 7.294 -10.236 1.00 0.00 O ATOM 0 H ASP A 155 -6.018 4.983 -8.349 1.00 0.00 H new ATOM 0 HA ASP A 155 -4.542 2.956 -9.803 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -3.737 4.725 -11.124 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -5.454 4.970 -10.874 1.00 0.00 H new ATOM 984 N GLU A 156 -2.066 3.530 -9.104 1.00 0.00 N ATOM 985 CA GLU A 156 -0.781 3.407 -8.428 1.00 0.00 C ATOM 986 C GLU A 156 -0.394 4.688 -7.696 1.00 0.00 C ATOM 987 O GLU A 156 -0.063 4.619 -6.517 1.00 0.00 O ATOM 988 CB GLU A 156 0.308 2.950 -9.405 1.00 0.00 C ATOM 989 CG GLU A 156 0.138 1.447 -9.657 1.00 0.00 C ATOM 990 CD GLU A 156 1.132 0.878 -10.666 1.00 0.00 C ATOM 991 OE1 GLU A 156 2.183 1.525 -10.865 1.00 0.00 O ATOM 992 OE2 GLU A 156 0.826 -0.206 -11.210 1.00 0.00 O ATOM 0 H GLU A 156 -2.033 3.330 -10.104 1.00 0.00 H new ATOM 0 HA GLU A 156 -0.882 2.637 -7.663 1.00 0.00 H new ATOM 0 HB2 GLU A 156 0.232 3.502 -10.342 1.00 0.00 H new ATOM 0 HB3 GLU A 156 1.296 3.155 -8.993 1.00 0.00 H new ATOM 0 HG2 GLU A 156 0.248 0.914 -8.712 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -0.875 1.259 -10.013 1.00 0.00 H new ATOM 999 N ASP A 157 -0.446 5.849 -8.360 1.00 0.00 N ATOM 1000 CA ASP A 157 -0.129 7.116 -7.706 1.00 0.00 C ATOM 1001 C ASP A 157 -0.971 7.289 -6.444 1.00 0.00 C ATOM 1002 O ASP A 157 -0.430 7.492 -5.368 1.00 0.00 O ATOM 1003 CB ASP A 157 -0.323 8.310 -8.648 1.00 0.00 C ATOM 1004 CG ASP A 157 -0.225 9.627 -7.877 1.00 0.00 C ATOM 1005 OD1 ASP A 157 0.871 9.895 -7.335 1.00 0.00 O ATOM 1006 OD2 ASP A 157 -1.258 10.327 -7.815 1.00 0.00 O ATOM 0 H ASP A 157 -0.703 5.933 -9.343 1.00 0.00 H new ATOM 0 HA ASP A 157 0.925 7.087 -7.429 1.00 0.00 H new ATOM 0 HB2 ASP A 157 0.432 8.286 -9.434 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.295 8.240 -9.137 1.00 0.00 H new ATOM 1011 N GLU A 158 -2.293 7.204 -6.570 1.00 0.00 N ATOM 1012 CA GLU A 158 -3.206 7.351 -5.444 1.00 0.00 C ATOM 1013 C GLU A 158 -2.800 6.436 -4.283 1.00 0.00 C ATOM 1014 O GLU A 158 -2.729 6.872 -3.132 1.00 0.00 O ATOM 1015 CB GLU A 158 -4.625 7.044 -5.926 1.00 0.00 C ATOM 1016 CG GLU A 158 -5.114 8.154 -6.866 1.00 0.00 C ATOM 1017 CD GLU A 158 -6.393 7.784 -7.609 1.00 0.00 C ATOM 1018 OE1 GLU A 158 -6.665 6.571 -7.732 1.00 0.00 O ATOM 1019 OE2 GLU A 158 -7.082 8.727 -8.054 1.00 0.00 O ATOM 0 H GLU A 158 -2.761 7.031 -7.460 1.00 0.00 H new ATOM 0 HA GLU A 158 -3.165 8.373 -5.068 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -4.642 6.085 -6.443 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -5.297 6.958 -5.072 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -5.286 9.062 -6.288 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -4.332 8.380 -7.591 1.00 0.00 H new ATOM 1026 N PHE A 159 -2.518 5.169 -4.596 1.00 0.00 N ATOM 1027 CA PHE A 159 -2.123 4.195 -3.593 1.00 0.00 C ATOM 1028 C PHE A 159 -0.810 4.629 -2.934 1.00 0.00 C ATOM 1029 O PHE A 159 -0.756 4.769 -1.716 1.00 0.00 O ATOM 1030 CB PHE A 159 -2.030 2.809 -4.239 1.00 0.00 C ATOM 1031 CG PHE A 159 -1.954 1.664 -3.248 1.00 0.00 C ATOM 1032 CD1 PHE A 159 -3.091 1.317 -2.494 1.00 0.00 C ATOM 1033 CD2 PHE A 159 -0.790 0.879 -3.154 1.00 0.00 C ATOM 1034 CE1 PHE A 159 -3.065 0.197 -1.650 1.00 0.00 C ATOM 1035 CE2 PHE A 159 -0.763 -0.240 -2.302 1.00 0.00 C ATOM 1036 CZ PHE A 159 -1.905 -0.591 -1.562 1.00 0.00 C ATOM 0 H PHE A 159 -2.558 4.798 -5.545 1.00 0.00 H new ATOM 0 HA PHE A 159 -2.872 4.138 -2.803 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -2.898 2.661 -4.882 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -1.149 2.778 -4.881 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -3.987 1.916 -2.566 1.00 0.00 H new ATOM 0 HD2 PHE A 159 0.083 1.136 -3.736 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -3.937 -0.060 -1.067 1.00 0.00 H new ATOM 0 HE2 PHE A 159 0.137 -0.831 -2.216 1.00 0.00 H new ATOM 0 HZ PHE A 159 -1.891 -1.465 -0.927 1.00 0.00 H new ATOM 1046 N ILE A 160 0.229 4.884 -3.734 1.00 0.00 N ATOM 1047 CA ILE A 160 1.511 5.411 -3.269 1.00 0.00 C ATOM 1048 C ILE A 160 1.304 6.601 -2.312 1.00 0.00 C ATOM 1049 O ILE A 160 1.841 6.618 -1.202 1.00 0.00 O ATOM 1050 CB ILE A 160 2.378 5.774 -4.496 1.00 0.00 C ATOM 1051 CG1 ILE A 160 2.870 4.499 -5.212 1.00 0.00 C ATOM 1052 CG2 ILE A 160 3.594 6.622 -4.094 1.00 0.00 C ATOM 1053 CD1 ILE A 160 3.320 4.744 -6.656 1.00 0.00 C ATOM 0 H ILE A 160 0.200 4.726 -4.741 1.00 0.00 H new ATOM 0 HA ILE A 160 2.040 4.652 -2.693 1.00 0.00 H new ATOM 0 HB ILE A 160 1.750 6.355 -5.171 1.00 0.00 H new ATOM 0 HG12 ILE A 160 3.700 4.073 -4.649 1.00 0.00 H new ATOM 0 HG13 ILE A 160 2.070 3.759 -5.210 1.00 0.00 H new ATOM 0 HG21 ILE A 160 4.181 6.859 -4.981 1.00 0.00 H new ATOM 0 HG22 ILE A 160 3.254 7.546 -3.626 1.00 0.00 H new ATOM 0 HG23 ILE A 160 4.210 6.063 -3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 160 3.653 3.805 -7.098 1.00 0.00 H new ATOM 0 HD12 ILE A 160 2.486 5.142 -7.234 1.00 0.00 H new ATOM 0 HD13 ILE A 160 4.142 5.460 -6.665 1.00 0.00 H new ATOM 1065 N ARG A 161 0.529 7.597 -2.747 1.00 0.00 N ATOM 1066 CA ARG A 161 0.248 8.800 -1.980 1.00 0.00 C ATOM 1067 C ARG A 161 -0.353 8.428 -0.625 1.00 0.00 C ATOM 1068 O ARG A 161 0.175 8.843 0.405 1.00 0.00 O ATOM 1069 CB ARG A 161 -0.698 9.738 -2.750 1.00 0.00 C ATOM 1070 CG ARG A 161 -0.129 10.310 -4.059 1.00 0.00 C ATOM 1071 CD ARG A 161 0.751 11.554 -3.887 1.00 0.00 C ATOM 1072 NE ARG A 161 2.093 11.239 -3.378 1.00 0.00 N ATOM 1073 CZ ARG A 161 3.091 10.719 -4.110 1.00 0.00 C ATOM 1074 NH1 ARG A 161 2.884 10.294 -5.363 1.00 0.00 N ATOM 1075 NH2 ARG A 161 4.315 10.636 -3.580 1.00 0.00 N ATOM 0 H ARG A 161 0.074 7.584 -3.660 1.00 0.00 H new ATOM 0 HA ARG A 161 1.186 9.331 -1.817 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.616 9.196 -2.978 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -0.971 10.568 -2.098 1.00 0.00 H new ATOM 0 HG2 ARG A 161 0.455 9.535 -4.555 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -0.958 10.557 -4.722 1.00 0.00 H new ATOM 0 HD2 ARG A 161 0.842 12.064 -4.846 1.00 0.00 H new ATOM 0 HD3 ARG A 161 0.262 12.247 -3.203 1.00 0.00 H new ATOM 0 HE ARG A 161 2.281 11.430 -2.394 1.00 0.00 H new ATOM 0 HH11 ARG A 161 1.955 10.362 -5.778 1.00 0.00 H new ATOM 0 HH12 ARG A 161 3.656 9.902 -5.903 1.00 0.00 H new ATOM 0 HH21 ARG A 161 4.483 10.966 -2.629 1.00 0.00 H new ATOM 0 HH22 ARG A 161 5.082 10.243 -4.126 1.00 0.00 H new ATOM 1089 N ILE A 162 -1.453 7.660 -0.598 1.00 0.00 N ATOM 1090 CA ILE A 162 -2.080 7.345 0.682 1.00 0.00 C ATOM 1091 C ILE A 162 -1.162 6.486 1.558 1.00 0.00 C ATOM 1092 O ILE A 162 -1.118 6.672 2.776 1.00 0.00 O ATOM 1093 CB ILE A 162 -3.512 6.794 0.546 1.00 0.00 C ATOM 1094 CG1 ILE A 162 -4.141 6.746 1.944 1.00 0.00 C ATOM 1095 CG2 ILE A 162 -3.597 5.389 -0.056 1.00 0.00 C ATOM 1096 CD1 ILE A 162 -5.662 6.867 1.918 1.00 0.00 C ATOM 0 H ILE A 162 -1.909 7.261 -1.419 1.00 0.00 H new ATOM 0 HA ILE A 162 -2.213 8.289 1.211 1.00 0.00 H new ATOM 0 HB ILE A 162 -4.036 7.461 -0.139 1.00 0.00 H new ATOM 0 HG12 ILE A 162 -3.865 5.810 2.429 1.00 0.00 H new ATOM 0 HG13 ILE A 162 -3.728 7.552 2.550 1.00 0.00 H new ATOM 0 HG21 ILE A 162 -4.641 5.081 -0.115 1.00 0.00 H new ATOM 0 HG22 ILE A 162 -3.164 5.395 -1.056 1.00 0.00 H new ATOM 0 HG23 ILE A 162 -3.047 4.690 0.574 1.00 0.00 H new ATOM 0 HD11 ILE A 162 -6.048 6.826 2.937 1.00 0.00 H new ATOM 0 HD12 ILE A 162 -5.944 7.816 1.461 1.00 0.00 H new ATOM 0 HD13 ILE A 162 -6.082 6.046 1.338 1.00 0.00 H new ATOM 1108 N MET A 163 -0.404 5.567 0.951 1.00 0.00 N ATOM 1109 CA MET A 163 0.584 4.758 1.650 1.00 0.00 C ATOM 1110 C MET A 163 1.578 5.634 2.412 1.00 0.00 C ATOM 1111 O MET A 163 1.827 5.378 3.592 1.00 0.00 O ATOM 1112 CB MET A 163 1.290 3.793 0.688 1.00 0.00 C ATOM 1113 CG MET A 163 0.650 2.397 0.633 1.00 0.00 C ATOM 1114 SD MET A 163 -1.130 2.237 0.342 1.00 0.00 S ATOM 1115 CE MET A 163 -1.743 1.998 2.024 1.00 0.00 C ATOM 0 H MET A 163 -0.464 5.367 -0.047 1.00 0.00 H new ATOM 0 HA MET A 163 0.060 4.151 2.388 1.00 0.00 H new ATOM 0 HB2 MET A 163 1.286 4.224 -0.313 1.00 0.00 H new ATOM 0 HB3 MET A 163 2.333 3.693 0.988 1.00 0.00 H new ATOM 0 HG2 MET A 163 1.160 1.836 -0.150 1.00 0.00 H new ATOM 0 HG3 MET A 163 0.872 1.900 1.577 1.00 0.00 H new ATOM 0 HE1 MET A 163 -2.798 1.726 1.992 1.00 0.00 H new ATOM 0 HE2 MET A 163 -1.178 1.201 2.508 1.00 0.00 H new ATOM 0 HE3 MET A 163 -1.624 2.922 2.589 1.00 0.00 H new ATOM 1125 N LYS A 164 2.119 6.661 1.750 1.00 0.00 N ATOM 1126 CA LYS A 164 2.952 7.657 2.412 1.00 0.00 C ATOM 1127 C LYS A 164 2.148 8.387 3.492 1.00 0.00 C ATOM 1128 O LYS A 164 2.516 8.348 4.665 1.00 0.00 O ATOM 1129 CB LYS A 164 3.528 8.639 1.385 1.00 0.00 C ATOM 1130 CG LYS A 164 4.601 7.978 0.514 1.00 0.00 C ATOM 1131 CD LYS A 164 5.106 8.990 -0.521 1.00 0.00 C ATOM 1132 CE LYS A 164 6.411 8.534 -1.182 1.00 0.00 C ATOM 1133 NZ LYS A 164 6.249 7.259 -1.902 1.00 0.00 N ATOM 0 H LYS A 164 1.991 6.821 0.751 1.00 0.00 H new ATOM 0 HA LYS A 164 3.788 7.154 2.898 1.00 0.00 H new ATOM 0 HB2 LYS A 164 2.725 9.016 0.751 1.00 0.00 H new ATOM 0 HB3 LYS A 164 3.956 9.498 1.902 1.00 0.00 H new ATOM 0 HG2 LYS A 164 5.427 7.632 1.135 1.00 0.00 H new ATOM 0 HG3 LYS A 164 4.190 7.102 0.013 1.00 0.00 H new ATOM 0 HD2 LYS A 164 4.344 9.136 -1.286 1.00 0.00 H new ATOM 0 HD3 LYS A 164 5.262 9.955 -0.038 1.00 0.00 H new ATOM 0 HE2 LYS A 164 6.753 9.301 -1.876 1.00 0.00 H new ATOM 0 HE3 LYS A 164 7.184 8.425 -0.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 6.892 6.548 -1.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 5.267 6.930 -1.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 6.474 7.397 -2.908 1.00 0.00 H new ATOM 1147 N LYS A 165 1.049 9.039 3.093 1.00 0.00 N ATOM 1148 CA LYS A 165 0.167 9.834 3.949 1.00 0.00 C ATOM 1149 C LYS A 165 -0.088 9.150 5.294 1.00 0.00 C ATOM 1150 O LYS A 165 -0.096 9.799 6.340 1.00 0.00 O ATOM 1151 CB LYS A 165 -1.166 10.051 3.212 1.00 0.00 C ATOM 1152 CG LYS A 165 -2.146 10.992 3.924 1.00 0.00 C ATOM 1153 CD LYS A 165 -3.528 11.018 3.252 1.00 0.00 C ATOM 1154 CE LYS A 165 -3.510 11.463 1.783 1.00 0.00 C ATOM 1155 NZ LYS A 165 -2.895 12.791 1.616 1.00 0.00 N ATOM 0 H LYS A 165 0.739 9.025 2.121 1.00 0.00 H new ATOM 0 HA LYS A 165 0.651 10.788 4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 165 -0.956 10.450 2.220 1.00 0.00 H new ATOM 0 HB3 LYS A 165 -1.649 9.084 3.071 1.00 0.00 H new ATOM 0 HG2 LYS A 165 -2.256 10.679 4.962 1.00 0.00 H new ATOM 0 HG3 LYS A 165 -1.732 12.000 3.937 1.00 0.00 H new ATOM 0 HD2 LYS A 165 -3.967 10.022 3.312 1.00 0.00 H new ATOM 0 HD3 LYS A 165 -4.179 11.687 3.814 1.00 0.00 H new ATOM 0 HE2 LYS A 165 -2.961 10.732 1.190 1.00 0.00 H new ATOM 0 HE3 LYS A 165 -4.530 11.485 1.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 -2.949 13.075 0.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 -3.403 13.485 2.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 -1.899 12.752 1.911 1.00 0.00 H new ATOM 1169 N THR A 166 -0.348 7.845 5.234 1.00 0.00 N ATOM 1170 CA THR A 166 -0.822 7.041 6.346 1.00 0.00 C ATOM 1171 C THR A 166 0.317 6.313 7.072 1.00 0.00 C ATOM 1172 O THR A 166 0.062 5.594 8.033 1.00 0.00 O ATOM 1173 CB THR A 166 -1.843 6.053 5.770 1.00 0.00 C ATOM 1174 OG1 THR A 166 -2.781 6.752 4.977 1.00 0.00 O ATOM 1175 CG2 THR A 166 -2.596 5.257 6.836 1.00 0.00 C ATOM 0 H THR A 166 -0.228 7.305 4.377 1.00 0.00 H new ATOM 0 HA THR A 166 -1.278 7.680 7.102 1.00 0.00 H new ATOM 0 HB THR A 166 -1.275 5.336 5.177 1.00 0.00 H new ATOM 0 HG1 THR A 166 -2.414 6.887 4.079 1.00 0.00 H new ATOM 0 HG21 THR A 166 -3.300 4.579 6.354 1.00 0.00 H new ATOM 0 HG22 THR A 166 -1.886 4.681 7.429 1.00 0.00 H new ATOM 0 HG23 THR A 166 -3.139 5.943 7.486 1.00 0.00 H new ATOM 1183 N SER A 167 1.573 6.454 6.634 1.00 0.00 N ATOM 1184 CA SER A 167 2.686 5.657 7.151 1.00 0.00 C ATOM 1185 C SER A 167 2.458 4.154 6.947 1.00 0.00 C ATOM 1186 O SER A 167 2.927 3.345 7.747 1.00 0.00 O ATOM 1187 CB SER A 167 2.932 5.943 8.640 1.00 0.00 C ATOM 1188 OG SER A 167 2.956 7.338 8.885 1.00 0.00 O ATOM 0 H SER A 167 1.844 7.123 5.913 1.00 0.00 H new ATOM 0 HA SER A 167 3.568 5.950 6.582 1.00 0.00 H new ATOM 0 HB2 SER A 167 2.150 5.477 9.239 1.00 0.00 H new ATOM 0 HB3 SER A 167 3.878 5.498 8.949 1.00 0.00 H new ATOM 0 HG SER A 167 3.112 7.500 9.839 1.00 0.00 H new ATOM 1194 N LEU A 168 1.752 3.769 5.881 1.00 0.00 N ATOM 1195 CA LEU A 168 1.585 2.364 5.529 1.00 0.00 C ATOM 1196 C LEU A 168 2.860 1.856 4.855 1.00 0.00 C ATOM 1197 O LEU A 168 3.248 0.709 5.070 1.00 0.00 O ATOM 1198 CB LEU A 168 0.287 2.149 4.737 1.00 0.00 C ATOM 1199 CG LEU A 168 -0.899 1.880 5.690 1.00 0.00 C ATOM 1200 CD1 LEU A 168 -2.244 2.413 5.205 1.00 0.00 C ATOM 1201 CD2 LEU A 168 -1.135 0.385 5.931 1.00 0.00 C ATOM 0 H LEU A 168 1.286 4.417 5.246 1.00 0.00 H new ATOM 0 HA LEU A 168 1.456 1.751 6.421 1.00 0.00 H new ATOM 0 HB2 LEU A 168 0.078 3.028 4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 168 0.408 1.309 4.053 1.00 0.00 H new ATOM 0 HG LEU A 168 -0.588 2.405 6.593 1.00 0.00 H new ATOM 0 HD11 LEU A 168 -3.015 2.177 5.939 1.00 0.00 H new ATOM 0 HD12 LEU A 168 -2.183 3.494 5.078 1.00 0.00 H new ATOM 0 HD13 LEU A 168 -2.497 1.949 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 168 -1.980 0.254 6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -1.350 -0.107 4.982 1.00 0.00 H new ATOM 0 HD23 LEU A 168 -0.243 -0.057 6.375 1.00 0.00 H new ATOM 1213 N PHE A 169 3.531 2.720 4.089 1.00 0.00 N ATOM 1214 CA PHE A 169 4.870 2.488 3.559 1.00 0.00 C ATOM 1215 C PHE A 169 5.566 3.836 3.349 1.00 0.00 C ATOM 1216 O PHE A 169 6.781 3.806 3.046 1.00 0.00 O ATOM 1217 CB PHE A 169 4.815 1.708 2.243 1.00 0.00 C ATOM 1218 CG PHE A 169 4.455 0.239 2.355 1.00 0.00 C ATOM 1219 CD1 PHE A 169 5.311 -0.646 3.039 1.00 0.00 C ATOM 1220 CD2 PHE A 169 3.328 -0.265 1.683 1.00 0.00 C ATOM 1221 CE1 PHE A 169 5.030 -2.023 3.059 1.00 0.00 C ATOM 1222 CE2 PHE A 169 3.090 -1.649 1.640 1.00 0.00 C ATOM 1223 CZ PHE A 169 3.931 -2.527 2.343 1.00 0.00 C ATOM 1224 OXT PHE A 169 4.871 4.868 3.478 1.00 0.00 O ATOM 0 H PHE A 169 3.144 3.623 3.815 1.00 0.00 H new ATOM 0 HA PHE A 169 5.434 1.890 4.274 1.00 0.00 H new ATOM 0 HB2 PHE A 169 4.090 2.190 1.588 1.00 0.00 H new ATOM 0 HB3 PHE A 169 5.787 1.787 1.756 1.00 0.00 H new ATOM 0 HD1 PHE A 169 6.184 -0.266 3.549 1.00 0.00 H new ATOM 0 HD2 PHE A 169 2.643 0.414 1.198 1.00 0.00 H new ATOM 0 HE1 PHE A 169 5.659 -2.694 3.625 1.00 0.00 H new ATOM 0 HE2 PHE A 169 2.261 -2.037 1.067 1.00 0.00 H new ATOM 0 HZ PHE A 169 3.733 -3.589 2.333 1.00 0.00 H new ATOM 1339 N ILE B 244 -10.622 6.264 8.781 1.00 0.00 N ATOM 1340 CA ILE B 244 -10.456 5.616 7.487 1.00 0.00 C ATOM 1341 C ILE B 244 -9.091 4.928 7.453 1.00 0.00 C ATOM 1342 O ILE B 244 -8.984 3.765 7.061 1.00 0.00 O ATOM 1343 CB ILE B 244 -10.626 6.625 6.334 1.00 0.00 C ATOM 1344 CG1 ILE B 244 -11.960 7.384 6.472 1.00 0.00 C ATOM 1345 CG2 ILE B 244 -10.573 5.864 5.002 1.00 0.00 C ATOM 1346 CD1 ILE B 244 -12.233 8.374 5.337 1.00 0.00 C ATOM 0 HA ILE B 244 -11.232 4.863 7.350 1.00 0.00 H new ATOM 0 HB ILE B 244 -9.821 7.359 6.368 1.00 0.00 H new ATOM 0 HG12 ILE B 244 -12.775 6.661 6.514 1.00 0.00 H new ATOM 0 HG13 ILE B 244 -11.963 7.923 7.419 1.00 0.00 H new ATOM 0 HG21 ILE B 244 -10.692 6.566 4.177 1.00 0.00 H new ATOM 0 HG22 ILE B 244 -9.613 5.356 4.911 1.00 0.00 H new ATOM 0 HG23 ILE B 244 -11.377 5.128 4.971 1.00 0.00 H new ATOM 0 HD11 ILE B 244 -13.190 8.867 5.507 1.00 0.00 H new ATOM 0 HD12 ILE B 244 -11.440 9.121 5.307 1.00 0.00 H new ATOM 0 HD13 ILE B 244 -12.264 7.839 4.388 1.00 0.00 H new ATOM 1358 N GLU B 245 -8.048 5.641 7.892 1.00 0.00 N ATOM 1359 CA GLU B 245 -6.700 5.106 8.007 1.00 0.00 C ATOM 1360 C GLU B 245 -6.717 3.774 8.748 1.00 0.00 C ATOM 1361 O GLU B 245 -6.072 2.835 8.306 1.00 0.00 O ATOM 1362 CB GLU B 245 -5.784 6.094 8.729 1.00 0.00 C ATOM 1363 CG GLU B 245 -5.501 7.343 7.890 1.00 0.00 C ATOM 1364 CD GLU B 245 -4.664 8.326 8.695 1.00 0.00 C ATOM 1365 OE1 GLU B 245 -5.280 9.145 9.410 1.00 0.00 O ATOM 1366 OE2 GLU B 245 -3.422 8.243 8.597 1.00 0.00 O ATOM 0 H GLU B 245 -8.124 6.617 8.179 1.00 0.00 H new ATOM 0 HA GLU B 245 -6.313 4.946 7.001 1.00 0.00 H new ATOM 0 HB2 GLU B 245 -6.243 6.389 9.672 1.00 0.00 H new ATOM 0 HB3 GLU B 245 -4.843 5.602 8.973 1.00 0.00 H new ATOM 0 HG2 GLU B 245 -4.975 7.067 6.976 1.00 0.00 H new ATOM 0 HG3 GLU B 245 -6.439 7.811 7.589 1.00 0.00 H new ATOM 1373 N SER B 246 -7.471 3.676 9.845 1.00 0.00 N ATOM 1374 CA SER B 246 -7.640 2.434 10.595 1.00 0.00 C ATOM 1375 C SER B 246 -8.028 1.248 9.701 1.00 0.00 C ATOM 1376 O SER B 246 -7.591 0.119 9.931 1.00 0.00 O ATOM 1377 CB SER B 246 -8.669 2.641 11.709 1.00 0.00 C ATOM 1378 OG SER B 246 -8.245 3.686 12.563 1.00 0.00 O ATOM 0 H SER B 246 -7.985 4.464 10.239 1.00 0.00 H new ATOM 0 HA SER B 246 -6.675 2.180 11.034 1.00 0.00 H new ATOM 0 HB2 SER B 246 -9.641 2.882 11.279 1.00 0.00 H new ATOM 0 HB3 SER B 246 -8.792 1.720 12.279 1.00 0.00 H new ATOM 0 HG SER B 246 -8.907 3.817 13.274 1.00 0.00 H new ATOM 1384 N LYS B 247 -8.850 1.491 8.679 1.00 0.00 N ATOM 1385 CA LYS B 247 -9.278 0.439 7.777 1.00 0.00 C ATOM 1386 C LYS B 247 -8.109 0.022 6.878 1.00 0.00 C ATOM 1387 O LYS B 247 -7.775 -1.159 6.825 1.00 0.00 O ATOM 1388 CB LYS B 247 -10.500 0.882 6.968 1.00 0.00 C ATOM 1389 CG LYS B 247 -11.605 1.579 7.777 1.00 0.00 C ATOM 1390 CD LYS B 247 -12.155 0.763 8.954 1.00 0.00 C ATOM 1391 CE LYS B 247 -12.748 -0.572 8.492 1.00 0.00 C ATOM 1392 NZ LYS B 247 -13.609 -1.162 9.532 1.00 0.00 N ATOM 0 H LYS B 247 -9.230 2.412 8.461 1.00 0.00 H new ATOM 0 HA LYS B 247 -9.583 -0.433 8.356 1.00 0.00 H new ATOM 0 HB2 LYS B 247 -10.168 1.558 6.180 1.00 0.00 H new ATOM 0 HB3 LYS B 247 -10.928 0.007 6.478 1.00 0.00 H new ATOM 0 HG2 LYS B 247 -11.216 2.523 8.158 1.00 0.00 H new ATOM 0 HG3 LYS B 247 -12.429 1.822 7.106 1.00 0.00 H new ATOM 0 HD2 LYS B 247 -11.356 0.577 9.672 1.00 0.00 H new ATOM 0 HD3 LYS B 247 -12.921 1.341 9.471 1.00 0.00 H new ATOM 0 HE2 LYS B 247 -13.326 -0.420 7.581 1.00 0.00 H new ATOM 0 HE3 LYS B 247 -11.943 -1.265 8.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 247 -13.845 -2.141 9.273 1.00 0.00 H new ATOM 0 HZ2 LYS B 247 -13.107 -1.156 10.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 247 -14.484 -0.605 9.616 1.00 0.00 H new ATOM 1406 N TRP B 248 -7.462 0.978 6.198 1.00 0.00 N ATOM 1407 CA TRP B 248 -6.280 0.697 5.379 1.00 0.00 C ATOM 1408 C TRP B 248 -5.180 0.010 6.197 1.00 0.00 C ATOM 1409 O TRP B 248 -4.597 -0.973 5.732 1.00 0.00 O ATOM 1410 CB TRP B 248 -5.768 1.969 4.687 1.00 0.00 C ATOM 1411 CG TRP B 248 -6.505 2.449 3.468 1.00 0.00 C ATOM 1412 CD1 TRP B 248 -6.984 3.702 3.284 1.00 0.00 C ATOM 1413 CD2 TRP B 248 -6.695 1.766 2.185 1.00 0.00 C ATOM 1414 NE1 TRP B 248 -7.512 3.825 2.017 1.00 0.00 N ATOM 1415 CE2 TRP B 248 -7.313 2.682 1.278 1.00 0.00 C ATOM 1416 CE3 TRP B 248 -6.383 0.482 1.678 1.00 0.00 C ATOM 1417 CZ2 TRP B 248 -7.602 2.351 -0.053 1.00 0.00 C ATOM 1418 CZ3 TRP B 248 -6.647 0.151 0.334 1.00 0.00 C ATOM 1419 CH2 TRP B 248 -7.249 1.082 -0.528 1.00 0.00 C ATOM 0 H TRP B 248 -7.742 1.959 6.201 1.00 0.00 H new ATOM 0 HA TRP B 248 -6.578 -0.001 4.596 1.00 0.00 H new ATOM 0 HB2 TRP B 248 -5.774 2.775 5.421 1.00 0.00 H new ATOM 0 HB3 TRP B 248 -4.728 1.802 4.406 1.00 0.00 H new ATOM 0 HD1 TRP B 248 -6.956 4.490 4.022 1.00 0.00 H new ATOM 0 HE1 TRP B 248 -7.989 4.657 1.671 1.00 0.00 H new ATOM 0 HE3 TRP B 248 -5.937 -0.254 2.330 1.00 0.00 H new ATOM 0 HZ2 TRP B 248 -8.089 3.064 -0.702 1.00 0.00 H new ATOM 0 HZ3 TRP B 248 -6.384 -0.829 -0.037 1.00 0.00 H new ATOM 0 HH2 TRP B 248 -7.440 0.819 -1.558 1.00 0.00 H new ATOM 1430 N HIS B 249 -4.925 0.504 7.414 1.00 0.00 N ATOM 1431 CA HIS B 249 -4.009 -0.093 8.372 1.00 0.00 C ATOM 1432 C HIS B 249 -4.262 -1.585 8.440 1.00 0.00 C ATOM 1433 O HIS B 249 -3.394 -2.378 8.085 1.00 0.00 O ATOM 1434 CB HIS B 249 -4.133 0.525 9.776 1.00 0.00 C ATOM 1435 CG HIS B 249 -3.680 1.954 9.934 1.00 0.00 C ATOM 1436 ND1 HIS B 249 -4.075 2.811 10.937 1.00 0.00 N ATOM 1437 CD2 HIS B 249 -2.705 2.590 9.214 1.00 0.00 C ATOM 1438 CE1 HIS B 249 -3.368 3.944 10.809 1.00 0.00 C ATOM 1439 NE2 HIS B 249 -2.518 3.855 9.776 1.00 0.00 N ATOM 0 H HIS B 249 -5.367 1.355 7.762 1.00 0.00 H new ATOM 0 HA HIS B 249 -2.994 0.107 8.027 1.00 0.00 H new ATOM 0 HB2 HIS B 249 -5.177 0.464 10.082 1.00 0.00 H new ATOM 0 HB3 HIS B 249 -3.561 -0.091 10.470 1.00 0.00 H new ATOM 0 HD2 HIS B 249 -2.175 2.186 8.364 1.00 0.00 H new ATOM 0 HE1 HIS B 249 -3.469 4.808 11.449 1.00 0.00 H new ATOM 0 HE2 HIS B 249 -1.863 4.571 9.462 1.00 0.00 H new ATOM 1447 N ARG B 250 -5.463 -1.965 8.874 1.00 0.00 N ATOM 1448 CA ARG B 250 -5.789 -3.371 8.991 1.00 0.00 C ATOM 1449 C ARG B 250 -5.646 -4.059 7.630 1.00 0.00 C ATOM 1450 O ARG B 250 -4.999 -5.093 7.536 1.00 0.00 O ATOM 1451 CB ARG B 250 -7.174 -3.533 9.628 1.00 0.00 C ATOM 1452 CG ARG B 250 -7.351 -4.936 10.226 1.00 0.00 C ATOM 1453 CD ARG B 250 -8.503 -4.997 11.238 1.00 0.00 C ATOM 1454 NE ARG B 250 -9.821 -5.081 10.598 1.00 0.00 N ATOM 1455 CZ ARG B 250 -10.624 -4.065 10.256 1.00 0.00 C ATOM 1456 NH1 ARG B 250 -10.215 -2.796 10.348 1.00 0.00 N ATOM 1457 NH2 ARG B 250 -11.855 -4.352 9.827 1.00 0.00 N ATOM 0 H ARG B 250 -6.210 -1.325 9.144 1.00 0.00 H new ATOM 0 HA ARG B 250 -5.086 -3.871 9.657 1.00 0.00 H new ATOM 0 HB2 ARG B 250 -7.308 -2.783 10.408 1.00 0.00 H new ATOM 0 HB3 ARG B 250 -7.945 -3.355 8.878 1.00 0.00 H new ATOM 0 HG2 ARG B 250 -7.537 -5.650 9.423 1.00 0.00 H new ATOM 0 HG3 ARG B 250 -6.425 -5.240 10.714 1.00 0.00 H new ATOM 0 HD2 ARG B 250 -8.364 -5.861 11.887 1.00 0.00 H new ATOM 0 HD3 ARG B 250 -8.469 -4.112 11.874 1.00 0.00 H new ATOM 0 HE ARG B 250 -10.164 -6.019 10.390 1.00 0.00 H new ATOM 0 HH11 ARG B 250 -9.275 -2.586 10.684 1.00 0.00 H new ATOM 0 HH12 ARG B 250 -10.843 -2.037 10.082 1.00 0.00 H new ATOM 0 HH21 ARG B 250 -12.161 -5.323 9.767 1.00 0.00 H new ATOM 0 HH22 ARG B 250 -12.490 -3.600 9.559 1.00 0.00 H new ATOM 1471 N LEU B 251 -6.203 -3.476 6.568 1.00 0.00 N ATOM 1472 CA LEU B 251 -6.255 -4.117 5.257 1.00 0.00 C ATOM 1473 C LEU B 251 -4.859 -4.551 4.780 1.00 0.00 C ATOM 1474 O LEU B 251 -4.708 -5.647 4.246 1.00 0.00 O ATOM 1475 CB LEU B 251 -6.942 -3.187 4.241 1.00 0.00 C ATOM 1476 CG LEU B 251 -7.488 -3.958 3.028 1.00 0.00 C ATOM 1477 CD1 LEU B 251 -8.886 -4.518 3.302 1.00 0.00 C ATOM 1478 CD2 LEU B 251 -7.534 -3.076 1.779 1.00 0.00 C ATOM 0 H LEU B 251 -6.629 -2.550 6.594 1.00 0.00 H new ATOM 0 HA LEU B 251 -6.849 -5.027 5.344 1.00 0.00 H new ATOM 0 HB2 LEU B 251 -7.759 -2.657 4.730 1.00 0.00 H new ATOM 0 HB3 LEU B 251 -6.231 -2.434 3.901 1.00 0.00 H new ATOM 0 HG LEU B 251 -6.803 -4.787 2.852 1.00 0.00 H new ATOM 0 HD11 LEU B 251 -9.241 -5.057 2.423 1.00 0.00 H new ATOM 0 HD12 LEU B 251 -8.845 -5.198 4.153 1.00 0.00 H new ATOM 0 HD13 LEU B 251 -9.569 -3.698 3.525 1.00 0.00 H new ATOM 0 HD21 LEU B 251 -7.925 -3.653 0.941 1.00 0.00 H new ATOM 0 HD22 LEU B 251 -8.181 -2.218 1.963 1.00 0.00 H new ATOM 0 HD23 LEU B 251 -6.529 -2.728 1.542 1.00 0.00 H new ATOM 1490 N LEU B 252 -3.834 -3.710 4.967 1.00 0.00 N ATOM 1491 CA LEU B 252 -2.455 -4.099 4.671 1.00 0.00 C ATOM 1492 C LEU B 252 -1.855 -4.885 5.833 1.00 0.00 C ATOM 1493 O LEU B 252 -1.492 -6.047 5.682 1.00 0.00 O ATOM 1494 CB LEU B 252 -1.574 -2.866 4.419 1.00 0.00 C ATOM 1495 CG LEU B 252 -1.726 -2.303 3.002 1.00 0.00 C ATOM 1496 CD1 LEU B 252 -2.883 -1.304 2.872 1.00 0.00 C ATOM 1497 CD2 LEU B 252 -0.419 -1.652 2.542 1.00 0.00 C ATOM 0 H LEU B 252 -3.936 -2.759 5.321 1.00 0.00 H new ATOM 0 HA LEU B 252 -2.482 -4.719 3.775 1.00 0.00 H new ATOM 0 HB2 LEU B 252 -1.828 -2.091 5.142 1.00 0.00 H new ATOM 0 HB3 LEU B 252 -0.530 -3.131 4.589 1.00 0.00 H new ATOM 0 HG LEU B 252 -1.963 -3.150 2.358 1.00 0.00 H new ATOM 0 HD11 LEU B 252 -2.938 -0.942 1.845 1.00 0.00 H new ATOM 0 HD12 LEU B 252 -3.820 -1.796 3.134 1.00 0.00 H new ATOM 0 HD13 LEU B 252 -2.715 -0.463 3.545 1.00 0.00 H new ATOM 0 HD21 LEU B 252 -0.544 -1.257 1.534 1.00 0.00 H new ATOM 0 HD22 LEU B 252 -0.159 -0.839 3.220 1.00 0.00 H new ATOM 0 HD23 LEU B 252 0.378 -2.395 2.544 1.00 0.00 H new ATOM 1509 N PHE B 253 -1.706 -4.229 6.984 1.00 0.00 N ATOM 1510 CA PHE B 253 -0.953 -4.745 8.126 1.00 0.00 C ATOM 1511 C PHE B 253 -1.445 -6.117 8.618 1.00 0.00 C ATOM 1512 O PHE B 253 -0.665 -6.866 9.203 1.00 0.00 O ATOM 1513 CB PHE B 253 -0.911 -3.717 9.273 1.00 0.00 C ATOM 1514 CG PHE B 253 -0.396 -2.305 8.981 1.00 0.00 C ATOM 1515 CD1 PHE B 253 0.505 -2.039 7.927 1.00 0.00 C ATOM 1516 CD2 PHE B 253 -0.760 -1.252 9.845 1.00 0.00 C ATOM 1517 CE1 PHE B 253 1.058 -0.753 7.768 1.00 0.00 C ATOM 1518 CE2 PHE B 253 -0.213 0.035 9.684 1.00 0.00 C ATOM 1519 CZ PHE B 253 0.690 0.290 8.642 1.00 0.00 C ATOM 0 H PHE B 253 -2.112 -3.308 7.151 1.00 0.00 H new ATOM 0 HA PHE B 253 0.064 -4.907 7.769 1.00 0.00 H new ATOM 0 HB2 PHE B 253 -1.922 -3.624 9.670 1.00 0.00 H new ATOM 0 HB3 PHE B 253 -0.294 -4.135 10.068 1.00 0.00 H new ATOM 0 HD1 PHE B 253 0.772 -2.827 7.238 1.00 0.00 H new ATOM 0 HD2 PHE B 253 -1.467 -1.435 10.640 1.00 0.00 H new ATOM 0 HE1 PHE B 253 1.766 -0.566 6.974 1.00 0.00 H new ATOM 0 HE2 PHE B 253 -0.489 0.827 10.364 1.00 0.00 H new ATOM 0 HZ PHE B 253 1.101 1.280 8.510 1.00 0.00 H new