USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 653 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 173 TYR OH : rot -15:sc= -1.82 USER MOD Single : A 175 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 177 GLN : amide:sc= -4.19! C(o=-4.2!,f=-5!) USER MOD Single : A 184 TYR OH : rot 180:sc= -0.855 USER MOD Single : A 188 HIS : no HD1:sc= -0.229 X(o=-0.23,f=0) USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 180:sc= 0.0816 USER MOD Single : A 193 GLN :FLIP amide:sc= -0.0739 F(o=-1.4,f=-0.074) USER MOD Single : A 196 HIS :FLIP no HD1:sc= -1.42 F(o=-3.3!,f=-1.4) USER MOD Single : A 202 MET CE :methyl 165:sc= -1.85! (180deg=-2.35) USER MOD Single : A 203 LYS NZ :NH3+ -136:sc= 0.714 (180deg=-0.221) USER MOD Single : A 206 SER OG : rot 180:sc= 0 USER MOD Single : A 207 MET CE :methyl -146:sc= -5.57! (180deg=-7.47!) USER MOD Single : A 213 THR OG1 : rot -34:sc= 0.00145 USER MOD Single : A 214 THR OG1 : rot 170:sc= 0.806 USER MOD Single : A 216 ASN : amide:sc= 0 X(o=0,f=-0.0025) USER MOD Single : A 218 SER OG : rot -54:sc= 0.547 USER MOD Single : A 223 CYS SG : rot -29:sc= -0.0231 USER MOD Single : A 224 SER OG : rot 180:sc= 0 USER MOD Single : A 226 ASN : amide:sc= 0.0475 K(o=0.047,f=-3.9!) USER MOD Single : A 227 GLN : amide:sc= -2.99! C(o=-3!,f=-6.1!) USER MOD Single : A 232 GLN : amide:sc= -0.484 X(o=-0.48,f=-0.058) USER MOD Single : A 242 SER OG : rot 180:sc= 0 USER MOD Single : A 243 HIS : no HE2:sc= -3.84! C(o=-3.8!,f=-6.1!) USER MOD Single : A 249 LYS NZ :NH3+ -170:sc=-0.00485 (180deg=-0.103) USER MOD ----------------------------------------------------------------- ATOM 55 N ALA A 168 -10.072 -7.756 -5.331 1.00 0.41 N ATOM 56 CA ALA A 168 -10.057 -8.562 -4.109 1.00 0.40 C ATOM 57 C ALA A 168 -9.305 -7.852 -2.991 1.00 0.31 C ATOM 58 O ALA A 168 -9.784 -7.764 -1.858 1.00 0.35 O ATOM 59 CB ALA A 168 -9.437 -9.924 -4.378 1.00 0.53 C ATOM 0 HA ALA A 168 -11.089 -8.702 -3.788 1.00 0.40 H new ATOM 0 HB1 ALA A 168 -9.434 -10.510 -3.459 1.00 0.53 H new ATOM 0 HB2 ALA A 168 -10.019 -10.445 -5.139 1.00 0.53 H new ATOM 0 HB3 ALA A 168 -8.413 -9.795 -4.730 1.00 0.53 H new ATOM 65 N ALA A 169 -8.138 -7.325 -3.324 1.00 0.28 N ATOM 66 CA ALA A 169 -7.332 -6.595 -2.359 1.00 0.24 C ATOM 67 C ALA A 169 -7.917 -5.212 -2.107 1.00 0.20 C ATOM 68 O ALA A 169 -7.821 -4.675 -1.002 1.00 0.19 O ATOM 69 CB ALA A 169 -5.897 -6.482 -2.848 1.00 0.31 C ATOM 0 H ALA A 169 -7.728 -7.389 -4.256 1.00 0.28 H new ATOM 0 HA ALA A 169 -7.338 -7.146 -1.419 1.00 0.24 H new ATOM 0 HB1 ALA A 169 -5.305 -5.933 -2.116 1.00 0.31 H new ATOM 0 HB2 ALA A 169 -5.478 -7.480 -2.979 1.00 0.31 H new ATOM 0 HB3 ALA A 169 -5.878 -5.952 -3.800 1.00 0.31 H new ATOM 75 N LEU A 170 -8.558 -4.653 -3.128 1.00 0.21 N ATOM 76 CA LEU A 170 -9.069 -3.292 -3.052 1.00 0.19 C ATOM 77 C LEU A 170 -10.245 -3.199 -2.097 1.00 0.16 C ATOM 78 O LEU A 170 -10.216 -2.415 -1.152 1.00 0.17 O ATOM 79 CB LEU A 170 -9.500 -2.778 -4.423 1.00 0.23 C ATOM 80 CG LEU A 170 -9.863 -1.293 -4.442 1.00 0.26 C ATOM 81 CD1 LEU A 170 -8.610 -0.443 -4.564 1.00 0.29 C ATOM 82 CD2 LEU A 170 -10.842 -0.981 -5.559 1.00 0.29 C ATOM 0 H LEU A 170 -8.735 -5.122 -4.016 1.00 0.21 H new ATOM 0 HA LEU A 170 -8.253 -2.672 -2.681 1.00 0.19 H new ATOM 0 HB2 LEU A 170 -8.694 -2.954 -5.136 1.00 0.23 H new ATOM 0 HB3 LEU A 170 -10.359 -3.356 -4.763 1.00 0.23 H new ATOM 0 HG LEU A 170 -10.353 -1.051 -3.499 1.00 0.26 H new ATOM 0 HD11 LEU A 170 -8.885 0.612 -4.576 1.00 0.29 H new ATOM 0 HD12 LEU A 170 -7.955 -0.637 -3.715 1.00 0.29 H new ATOM 0 HD13 LEU A 170 -8.090 -0.693 -5.489 1.00 0.29 H new ATOM 0 HD21 LEU A 170 -11.081 0.082 -5.547 1.00 0.29 H new ATOM 0 HD22 LEU A 170 -10.395 -1.241 -6.518 1.00 0.29 H new ATOM 0 HD23 LEU A 170 -11.754 -1.560 -5.415 1.00 0.29 H new ATOM 94 N GLU A 171 -11.278 -3.999 -2.351 1.00 0.19 N ATOM 95 CA GLU A 171 -12.481 -3.979 -1.527 1.00 0.24 C ATOM 96 C GLU A 171 -12.133 -4.297 -0.080 1.00 0.22 C ATOM 97 O GLU A 171 -12.690 -3.712 0.848 1.00 0.26 O ATOM 98 CB GLU A 171 -13.516 -4.979 -2.053 1.00 0.36 C ATOM 99 CG GLU A 171 -13.030 -6.421 -2.064 1.00 1.00 C ATOM 100 CD GLU A 171 -14.130 -7.404 -2.388 1.00 1.16 C ATOM 101 OE1 GLU A 171 -14.964 -7.686 -1.502 1.00 1.46 O ATOM 102 OE2 GLU A 171 -14.164 -7.909 -3.529 1.00 1.10 O ATOM 0 H GLU A 171 -11.305 -4.668 -3.120 1.00 0.19 H new ATOM 0 HA GLU A 171 -12.913 -2.979 -1.576 1.00 0.24 H new ATOM 0 HB2 GLU A 171 -14.415 -4.913 -1.440 1.00 0.36 H new ATOM 0 HB3 GLU A 171 -13.800 -4.694 -3.066 1.00 0.36 H new ATOM 0 HG2 GLU A 171 -12.229 -6.525 -2.796 1.00 1.00 H new ATOM 0 HG3 GLU A 171 -12.606 -6.665 -1.090 1.00 1.00 H new ATOM 109 N GLY A 172 -11.190 -5.216 0.094 1.00 0.19 N ATOM 110 CA GLY A 172 -10.749 -5.584 1.416 1.00 0.22 C ATOM 111 C GLY A 172 -10.106 -4.427 2.147 1.00 0.19 C ATOM 112 O GLY A 172 -10.528 -4.075 3.249 1.00 0.22 O ATOM 0 H GLY A 172 -10.724 -5.712 -0.665 1.00 0.19 H new ATOM 0 HA2 GLY A 172 -11.599 -5.948 1.992 1.00 0.22 H new ATOM 0 HA3 GLY A 172 -10.037 -6.406 1.344 1.00 0.22 H new ATOM 116 N TYR A 173 -9.087 -3.826 1.537 1.00 0.17 N ATOM 117 CA TYR A 173 -8.361 -2.740 2.179 1.00 0.16 C ATOM 118 C TYR A 173 -9.234 -1.499 2.304 1.00 0.16 C ATOM 119 O TYR A 173 -9.149 -0.794 3.298 1.00 0.18 O ATOM 120 CB TYR A 173 -7.067 -2.415 1.429 1.00 0.17 C ATOM 121 CG TYR A 173 -6.224 -1.363 2.118 1.00 0.16 C ATOM 122 CD1 TYR A 173 -5.825 -1.519 3.438 1.00 0.19 C ATOM 123 CD2 TYR A 173 -5.812 -0.222 1.438 1.00 0.17 C ATOM 124 CE1 TYR A 173 -5.038 -0.570 4.060 1.00 0.20 C ATOM 125 CE2 TYR A 173 -5.029 0.730 2.056 1.00 0.20 C ATOM 126 CZ TYR A 173 -4.713 0.584 3.399 1.00 0.19 C ATOM 127 OH TYR A 173 -3.855 1.494 3.979 1.00 0.24 O ATOM 0 H TYR A 173 -8.750 -4.072 0.606 1.00 0.17 H new ATOM 0 HA TYR A 173 -8.093 -3.072 3.182 1.00 0.16 H new ATOM 0 HB2 TYR A 173 -6.480 -3.327 1.319 1.00 0.17 H new ATOM 0 HB3 TYR A 173 -7.314 -2.072 0.424 1.00 0.17 H new ATOM 0 HD1 TYR A 173 -6.135 -2.396 3.987 1.00 0.19 H new ATOM 0 HD2 TYR A 173 -6.110 -0.079 0.410 1.00 0.17 H new ATOM 0 HE1 TYR A 173 -4.680 -0.738 5.065 1.00 0.20 H new ATOM 0 HE2 TYR A 173 -4.665 1.581 1.500 1.00 0.20 H new ATOM 0 HH TYR A 173 -3.762 1.293 4.934 1.00 0.24 H new ATOM 137 N ARG A 174 -10.070 -1.227 1.302 1.00 0.18 N ATOM 138 CA ARG A 174 -11.050 -0.143 1.387 1.00 0.23 C ATOM 139 C ARG A 174 -11.958 -0.331 2.597 1.00 0.23 C ATOM 140 O ARG A 174 -12.260 0.636 3.294 1.00 0.25 O ATOM 141 CB ARG A 174 -11.905 -0.056 0.120 1.00 0.31 C ATOM 142 CG ARG A 174 -13.124 0.835 0.288 1.00 0.93 C ATOM 143 CD ARG A 174 -14.126 0.654 -0.834 1.00 0.74 C ATOM 144 NE ARG A 174 -15.442 1.164 -0.452 1.00 1.05 N ATOM 145 CZ ARG A 174 -16.490 1.213 -1.267 1.00 1.35 C ATOM 146 NH1 ARG A 174 -16.372 0.811 -2.524 1.00 1.31 N ATOM 147 NH2 ARG A 174 -17.657 1.663 -0.826 1.00 2.09 N ATOM 0 H ARG A 174 -10.089 -1.742 0.422 1.00 0.18 H new ATOM 0 HA ARG A 174 -10.492 0.787 1.493 1.00 0.23 H new ATOM 0 HB2 ARG A 174 -11.294 0.324 -0.699 1.00 0.31 H new ATOM 0 HB3 ARG A 174 -12.230 -1.057 -0.162 1.00 0.31 H new ATOM 0 HG2 ARG A 174 -13.605 0.614 1.241 1.00 0.93 H new ATOM 0 HG3 ARG A 174 -12.807 1.877 0.325 1.00 0.93 H new ATOM 0 HD2 ARG A 174 -13.776 1.174 -1.726 1.00 0.74 H new ATOM 0 HD3 ARG A 174 -14.202 -0.403 -1.090 1.00 0.74 H new ATOM 0 HE ARG A 174 -15.563 1.504 0.502 1.00 1.05 H new ATOM 0 HH11 ARG A 174 -15.476 0.464 -2.866 1.00 1.31 H new ATOM 0 HH12 ARG A 174 -17.177 0.849 -3.149 1.00 1.31 H new ATOM 0 HH21 ARG A 174 -17.752 1.973 0.141 1.00 2.09 H new ATOM 0 HH22 ARG A 174 -18.460 1.699 -1.454 1.00 2.09 H new ATOM 161 N LYS A 175 -12.369 -1.557 2.862 1.00 0.22 N ATOM 162 CA LYS A 175 -13.191 -1.843 4.033 1.00 0.25 C ATOM 163 C LYS A 175 -12.419 -1.521 5.322 1.00 0.24 C ATOM 164 O LYS A 175 -13.011 -1.349 6.387 1.00 0.29 O ATOM 165 CB LYS A 175 -13.653 -3.302 3.974 1.00 0.26 C ATOM 166 CG LYS A 175 -14.457 -3.797 5.161 1.00 0.89 C ATOM 167 CD LYS A 175 -14.700 -5.291 5.026 1.00 0.84 C ATOM 168 CE LYS A 175 -15.543 -5.848 6.155 1.00 1.71 C ATOM 169 NZ LYS A 175 -15.766 -7.311 5.996 1.00 2.34 N ATOM 0 H LYS A 175 -12.151 -2.371 2.287 1.00 0.22 H new ATOM 0 HA LYS A 175 -14.077 -1.208 4.036 1.00 0.25 H new ATOM 0 HB2 LYS A 175 -14.253 -3.435 3.074 1.00 0.26 H new ATOM 0 HB3 LYS A 175 -12.773 -3.936 3.867 1.00 0.26 H new ATOM 0 HG2 LYS A 175 -13.922 -3.588 6.088 1.00 0.89 H new ATOM 0 HG3 LYS A 175 -15.408 -3.267 5.215 1.00 0.89 H new ATOM 0 HD2 LYS A 175 -15.195 -5.491 4.075 1.00 0.84 H new ATOM 0 HD3 LYS A 175 -13.742 -5.811 5.002 1.00 0.84 H new ATOM 0 HE2 LYS A 175 -15.051 -5.655 7.108 1.00 1.71 H new ATOM 0 HE3 LYS A 175 -16.503 -5.333 6.182 1.00 1.71 H new ATOM 0 HZ1 LYS A 175 -16.346 -7.661 6.785 1.00 2.34 H new ATOM 0 HZ2 LYS A 175 -16.258 -7.492 5.097 1.00 2.34 H new ATOM 0 HZ3 LYS A 175 -14.850 -7.804 5.995 1.00 2.34 H new ATOM 183 N GLU A 176 -11.098 -1.425 5.213 1.00 0.20 N ATOM 184 CA GLU A 176 -10.274 -0.965 6.321 1.00 0.18 C ATOM 185 C GLU A 176 -10.101 0.560 6.251 1.00 0.20 C ATOM 186 O GLU A 176 -10.273 1.262 7.247 1.00 0.44 O ATOM 187 CB GLU A 176 -8.904 -1.654 6.296 1.00 0.19 C ATOM 188 CG GLU A 176 -8.079 -1.425 7.553 1.00 0.24 C ATOM 189 CD GLU A 176 -8.602 -2.194 8.755 1.00 0.34 C ATOM 190 OE1 GLU A 176 -9.684 -1.836 9.271 1.00 0.69 O ATOM 191 OE2 GLU A 176 -7.952 -3.173 9.177 1.00 0.70 O ATOM 0 H GLU A 176 -10.577 -1.660 4.368 1.00 0.20 H new ATOM 0 HA GLU A 176 -10.773 -1.223 7.255 1.00 0.18 H new ATOM 0 HB2 GLU A 176 -9.049 -2.725 6.158 1.00 0.19 H new ATOM 0 HB3 GLU A 176 -8.343 -1.295 5.434 1.00 0.19 H new ATOM 0 HG2 GLU A 176 -7.047 -1.719 7.362 1.00 0.24 H new ATOM 0 HG3 GLU A 176 -8.070 -0.360 7.786 1.00 0.24 H new ATOM 198 N GLN A 177 -9.752 1.054 5.059 1.00 0.29 N ATOM 199 CA GLN A 177 -9.558 2.488 4.800 1.00 0.22 C ATOM 200 C GLN A 177 -10.694 3.353 5.331 1.00 0.25 C ATOM 201 O GLN A 177 -10.476 4.193 6.196 1.00 0.25 O ATOM 202 CB GLN A 177 -9.416 2.744 3.300 1.00 0.21 C ATOM 203 CG GLN A 177 -8.264 1.999 2.657 1.00 0.20 C ATOM 204 CD GLN A 177 -8.106 2.325 1.187 1.00 0.22 C ATOM 205 OE1 GLN A 177 -8.694 1.670 0.327 1.00 0.24 O ATOM 206 NE2 GLN A 177 -7.303 3.330 0.885 1.00 0.24 N ATOM 0 H GLN A 177 -9.595 0.468 4.239 1.00 0.29 H new ATOM 0 HA GLN A 177 -8.647 2.767 5.330 1.00 0.22 H new ATOM 0 HB2 GLN A 177 -10.343 2.458 2.803 1.00 0.21 H new ATOM 0 HB3 GLN A 177 -9.282 3.813 3.135 1.00 0.21 H new ATOM 0 HG2 GLN A 177 -7.340 2.245 3.181 1.00 0.20 H new ATOM 0 HG3 GLN A 177 -8.421 0.926 2.772 1.00 0.20 H new ATOM 0 HE21 GLN A 177 -6.834 3.849 1.627 1.00 0.24 H new ATOM 0 HE22 GLN A 177 -7.153 3.587 -0.091 1.00 0.24 H new ATOM 215 N GLU A 178 -11.901 3.139 4.823 1.00 0.27 N ATOM 216 CA GLU A 178 -13.034 3.991 5.190 1.00 0.31 C ATOM 217 C GLU A 178 -13.347 3.870 6.678 1.00 0.33 C ATOM 218 O GLU A 178 -13.885 4.786 7.300 1.00 0.36 O ATOM 219 CB GLU A 178 -14.267 3.649 4.350 1.00 0.35 C ATOM 220 CG GLU A 178 -14.674 2.187 4.384 1.00 0.39 C ATOM 221 CD GLU A 178 -15.860 1.915 3.484 1.00 0.46 C ATOM 222 OE1 GLU A 178 -15.660 1.747 2.264 1.00 0.41 O ATOM 223 OE2 GLU A 178 -16.998 1.827 3.994 1.00 0.71 O ATOM 0 H GLU A 178 -12.123 2.393 4.163 1.00 0.27 H new ATOM 0 HA GLU A 178 -12.757 5.025 4.984 1.00 0.31 H new ATOM 0 HB2 GLU A 178 -15.105 4.253 4.697 1.00 0.35 H new ATOM 0 HB3 GLU A 178 -14.075 3.934 3.316 1.00 0.35 H new ATOM 0 HG2 GLU A 178 -13.832 1.568 4.074 1.00 0.39 H new ATOM 0 HG3 GLU A 178 -14.920 1.901 5.407 1.00 0.39 H new ATOM 230 N ARG A 179 -12.980 2.727 7.228 1.00 0.34 N ATOM 231 CA ARG A 179 -13.172 2.411 8.636 1.00 0.40 C ATOM 232 C ARG A 179 -12.196 3.195 9.529 1.00 0.35 C ATOM 233 O ARG A 179 -12.461 3.419 10.712 1.00 0.38 O ATOM 234 CB ARG A 179 -12.959 0.903 8.789 1.00 0.48 C ATOM 235 CG ARG A 179 -13.087 0.349 10.193 1.00 0.65 C ATOM 236 CD ARG A 179 -12.701 -1.120 10.198 1.00 0.83 C ATOM 237 NE ARG A 179 -12.880 -1.755 11.498 1.00 1.03 N ATOM 238 CZ ARG A 179 -12.146 -2.785 11.914 1.00 1.80 C ATOM 239 NH1 ARG A 179 -11.121 -3.213 11.184 1.00 2.15 N ATOM 240 NH2 ARG A 179 -12.416 -3.372 13.071 1.00 2.55 N ATOM 0 H ARG A 179 -12.532 1.977 6.701 1.00 0.34 H new ATOM 0 HA ARG A 179 -14.175 2.697 8.953 1.00 0.40 H new ATOM 0 HB2 ARG A 179 -13.678 0.389 8.151 1.00 0.48 H new ATOM 0 HB3 ARG A 179 -11.966 0.657 8.413 1.00 0.48 H new ATOM 0 HG2 ARG A 179 -12.445 0.907 10.875 1.00 0.65 H new ATOM 0 HG3 ARG A 179 -14.110 0.468 10.550 1.00 0.65 H new ATOM 0 HD2 ARG A 179 -13.300 -1.649 9.457 1.00 0.83 H new ATOM 0 HD3 ARG A 179 -11.659 -1.216 9.894 1.00 0.83 H new ATOM 0 HE ARG A 179 -13.603 -1.392 12.119 1.00 1.03 H new ATOM 0 HH11 ARG A 179 -10.895 -2.752 10.303 1.00 2.15 H new ATOM 0 HH12 ARG A 179 -10.560 -4.002 11.505 1.00 2.15 H new ATOM 0 HH21 ARG A 179 -13.188 -3.035 13.646 1.00 2.55 H new ATOM 0 HH22 ARG A 179 -11.852 -4.161 13.387 1.00 2.55 H new ATOM 254 N LEU A 180 -11.088 3.640 8.944 1.00 0.30 N ATOM 255 CA LEU A 180 -9.998 4.265 9.699 1.00 0.28 C ATOM 256 C LEU A 180 -9.641 5.652 9.157 1.00 0.25 C ATOM 257 O LEU A 180 -8.837 6.365 9.757 1.00 0.24 O ATOM 258 CB LEU A 180 -8.751 3.371 9.659 1.00 0.28 C ATOM 259 CG LEU A 180 -8.926 1.963 10.237 1.00 0.33 C ATOM 260 CD1 LEU A 180 -7.616 1.196 10.159 1.00 0.35 C ATOM 261 CD2 LEU A 180 -9.424 2.028 11.676 1.00 0.38 C ATOM 0 H LEU A 180 -10.917 3.580 7.940 1.00 0.30 H new ATOM 0 HA LEU A 180 -10.344 4.383 10.726 1.00 0.28 H new ATOM 0 HB2 LEU A 180 -8.424 3.281 8.623 1.00 0.28 H new ATOM 0 HB3 LEU A 180 -7.950 3.871 10.204 1.00 0.28 H new ATOM 0 HG LEU A 180 -9.674 1.437 9.643 1.00 0.33 H new ATOM 0 HD11 LEU A 180 -7.754 0.197 10.573 1.00 0.35 H new ATOM 0 HD12 LEU A 180 -7.302 1.117 9.118 1.00 0.35 H new ATOM 0 HD13 LEU A 180 -6.851 1.723 10.730 1.00 0.35 H new ATOM 0 HD21 LEU A 180 -9.541 1.017 12.066 1.00 0.38 H new ATOM 0 HD22 LEU A 180 -8.703 2.571 12.286 1.00 0.38 H new ATOM 0 HD23 LEU A 180 -10.385 2.542 11.706 1.00 0.38 H new ATOM 273 N GLY A 181 -10.221 6.031 8.030 1.00 0.24 N ATOM 274 CA GLY A 181 -9.958 7.345 7.469 1.00 0.22 C ATOM 275 C GLY A 181 -8.781 7.339 6.514 1.00 0.18 C ATOM 276 O GLY A 181 -8.413 8.373 5.957 1.00 0.18 O ATOM 0 H GLY A 181 -10.869 5.456 7.492 1.00 0.24 H new ATOM 0 HA2 GLY A 181 -10.846 7.698 6.945 1.00 0.22 H new ATOM 0 HA3 GLY A 181 -9.763 8.050 8.277 1.00 0.22 H new ATOM 280 N ILE A 182 -8.191 6.166 6.330 1.00 0.17 N ATOM 281 CA ILE A 182 -7.010 6.014 5.489 1.00 0.16 C ATOM 282 C ILE A 182 -7.332 6.362 4.036 1.00 0.15 C ATOM 283 O ILE A 182 -8.265 5.809 3.450 1.00 0.17 O ATOM 284 CB ILE A 182 -6.462 4.572 5.557 1.00 0.17 C ATOM 285 CG1 ILE A 182 -6.191 4.177 7.012 1.00 0.20 C ATOM 286 CG2 ILE A 182 -5.194 4.449 4.721 1.00 0.19 C ATOM 287 CD1 ILE A 182 -5.771 2.733 7.181 1.00 0.22 C ATOM 0 H ILE A 182 -8.514 5.298 6.756 1.00 0.17 H new ATOM 0 HA ILE A 182 -6.251 6.700 5.865 1.00 0.16 H new ATOM 0 HB ILE A 182 -7.210 3.892 5.149 1.00 0.17 H new ATOM 0 HG12 ILE A 182 -5.411 4.823 7.416 1.00 0.20 H new ATOM 0 HG13 ILE A 182 -7.090 4.356 7.602 1.00 0.20 H new ATOM 0 HG21 ILE A 182 -4.818 3.427 4.778 1.00 0.19 H new ATOM 0 HG22 ILE A 182 -5.417 4.696 3.683 1.00 0.19 H new ATOM 0 HG23 ILE A 182 -4.438 5.135 5.103 1.00 0.19 H new ATOM 0 HD11 ILE A 182 -5.596 2.526 8.237 1.00 0.22 H new ATOM 0 HD12 ILE A 182 -6.559 2.079 6.808 1.00 0.22 H new ATOM 0 HD13 ILE A 182 -4.854 2.553 6.620 1.00 0.22 H new ATOM 299 N PRO A 183 -6.574 7.300 3.447 1.00 0.14 N ATOM 300 CA PRO A 183 -6.772 7.721 2.062 1.00 0.15 C ATOM 301 C PRO A 183 -6.366 6.642 1.064 1.00 0.14 C ATOM 302 O PRO A 183 -5.528 5.782 1.345 1.00 0.16 O ATOM 303 CB PRO A 183 -5.869 8.951 1.922 1.00 0.20 C ATOM 304 CG PRO A 183 -4.826 8.788 2.965 1.00 0.24 C ATOM 305 CD PRO A 183 -5.471 8.032 4.093 1.00 0.15 C ATOM 0 HA PRO A 183 -7.821 7.925 1.848 1.00 0.15 H new ATOM 0 HB2 PRO A 183 -5.426 9.004 0.927 1.00 0.20 H new ATOM 0 HB3 PRO A 183 -6.433 9.872 2.069 1.00 0.20 H new ATOM 0 HG2 PRO A 183 -3.967 8.244 2.574 1.00 0.24 H new ATOM 0 HG3 PRO A 183 -4.461 9.757 3.305 1.00 0.24 H new ATOM 0 HD2 PRO A 183 -4.767 7.352 4.572 1.00 0.15 H new ATOM 0 HD3 PRO A 183 -5.839 8.706 4.867 1.00 0.15 H new ATOM 313 N TYR A 184 -6.983 6.710 -0.103 1.00 0.15 N ATOM 314 CA TYR A 184 -6.717 5.792 -1.200 1.00 0.16 C ATOM 315 C TYR A 184 -5.384 6.103 -1.868 1.00 0.16 C ATOM 316 O TYR A 184 -4.674 5.208 -2.319 1.00 0.19 O ATOM 317 CB TYR A 184 -7.821 5.936 -2.237 1.00 0.17 C ATOM 318 CG TYR A 184 -8.813 4.796 -2.281 1.00 0.10 C ATOM 319 CD1 TYR A 184 -9.878 4.723 -1.393 1.00 0.30 C ATOM 320 CD2 TYR A 184 -8.697 3.807 -3.243 1.00 0.23 C ATOM 321 CE1 TYR A 184 -10.795 3.688 -1.466 1.00 0.42 C ATOM 322 CE2 TYR A 184 -9.607 2.779 -3.330 1.00 0.27 C ATOM 323 CZ TYR A 184 -10.655 2.721 -2.439 1.00 0.36 C ATOM 324 OH TYR A 184 -11.571 1.699 -2.531 1.00 0.50 O ATOM 0 H TYR A 184 -7.691 7.412 -0.319 1.00 0.15 H new ATOM 0 HA TYR A 184 -6.681 4.778 -0.801 1.00 0.16 H new ATOM 0 HB2 TYR A 184 -8.363 6.861 -2.042 1.00 0.17 H new ATOM 0 HB3 TYR A 184 -7.363 6.037 -3.221 1.00 0.17 H new ATOM 0 HD1 TYR A 184 -9.993 5.484 -0.635 1.00 0.30 H new ATOM 0 HD2 TYR A 184 -7.874 3.843 -3.941 1.00 0.23 H new ATOM 0 HE1 TYR A 184 -11.615 3.638 -0.765 1.00 0.42 H new ATOM 0 HE2 TYR A 184 -9.500 2.022 -4.093 1.00 0.27 H new ATOM 0 HH TYR A 184 -11.325 1.105 -3.271 1.00 0.50 H new ATOM 334 N ASP A 185 -5.067 7.390 -1.926 1.00 0.16 N ATOM 335 CA ASP A 185 -3.893 7.872 -2.643 1.00 0.17 C ATOM 336 C ASP A 185 -2.677 7.844 -1.725 1.00 0.14 C ATOM 337 O ASP A 185 -2.666 8.479 -0.666 1.00 0.17 O ATOM 338 CB ASP A 185 -4.169 9.287 -3.170 1.00 0.27 C ATOM 339 CG ASP A 185 -3.008 9.921 -3.920 1.00 0.33 C ATOM 340 OD1 ASP A 185 -2.078 9.202 -4.328 1.00 0.74 O ATOM 341 OD2 ASP A 185 -3.046 11.153 -4.116 1.00 0.58 O ATOM 0 H ASP A 185 -5.614 8.127 -1.480 1.00 0.16 H new ATOM 0 HA ASP A 185 -3.681 7.224 -3.493 1.00 0.17 H new ATOM 0 HB2 ASP A 185 -5.035 9.252 -3.831 1.00 0.27 H new ATOM 0 HB3 ASP A 185 -4.435 9.928 -2.330 1.00 0.27 H new ATOM 346 N PRO A 186 -1.642 7.092 -2.136 1.00 0.13 N ATOM 347 CA PRO A 186 -0.467 6.794 -1.310 1.00 0.11 C ATOM 348 C PRO A 186 0.245 8.032 -0.786 1.00 0.12 C ATOM 349 O PRO A 186 0.781 8.026 0.319 1.00 0.13 O ATOM 350 CB PRO A 186 0.467 6.027 -2.259 1.00 0.13 C ATOM 351 CG PRO A 186 -0.057 6.296 -3.626 1.00 0.20 C ATOM 352 CD PRO A 186 -1.536 6.474 -3.463 1.00 0.18 C ATOM 0 HA PRO A 186 -0.760 6.241 -0.417 1.00 0.11 H new ATOM 0 HB2 PRO A 186 1.497 6.368 -2.158 1.00 0.13 H new ATOM 0 HB3 PRO A 186 0.462 4.960 -2.039 1.00 0.13 H new ATOM 0 HG2 PRO A 186 0.401 7.189 -4.053 1.00 0.20 H new ATOM 0 HG3 PRO A 186 0.166 5.470 -4.301 1.00 0.20 H new ATOM 0 HD2 PRO A 186 -1.955 7.112 -4.241 1.00 0.18 H new ATOM 0 HD3 PRO A 186 -2.066 5.523 -3.510 1.00 0.18 H new ATOM 360 N ILE A 187 0.245 9.088 -1.578 1.00 0.13 N ATOM 361 CA ILE A 187 1.019 10.275 -1.257 1.00 0.17 C ATOM 362 C ILE A 187 0.501 10.994 -0.005 1.00 0.19 C ATOM 363 O ILE A 187 1.252 11.728 0.640 1.00 0.22 O ATOM 364 CB ILE A 187 1.065 11.256 -2.455 1.00 0.25 C ATOM 365 CG1 ILE A 187 2.142 12.326 -2.245 1.00 0.42 C ATOM 366 CG2 ILE A 187 -0.290 11.908 -2.665 1.00 0.29 C ATOM 367 CD1 ILE A 187 2.309 13.263 -3.423 1.00 0.55 C ATOM 0 H ILE A 187 -0.282 9.149 -2.449 1.00 0.13 H new ATOM 0 HA ILE A 187 2.031 9.932 -1.043 1.00 0.17 H new ATOM 0 HB ILE A 187 1.319 10.684 -3.348 1.00 0.25 H new ATOM 0 HG12 ILE A 187 1.892 12.911 -1.360 1.00 0.42 H new ATOM 0 HG13 ILE A 187 3.095 11.835 -2.045 1.00 0.42 H new ATOM 0 HG21 ILE A 187 -0.237 12.593 -3.511 1.00 0.29 H new ATOM 0 HG22 ILE A 187 -1.036 11.140 -2.867 1.00 0.29 H new ATOM 0 HG23 ILE A 187 -0.571 12.460 -1.768 1.00 0.29 H new ATOM 0 HD11 ILE A 187 3.088 13.992 -3.200 1.00 0.55 H new ATOM 0 HD12 ILE A 187 2.590 12.690 -4.307 1.00 0.55 H new ATOM 0 HD13 ILE A 187 1.369 13.782 -3.611 1.00 0.55 H new ATOM 379 N HIS A 188 -0.767 10.799 0.361 1.00 0.18 N ATOM 380 CA HIS A 188 -1.310 11.488 1.529 1.00 0.20 C ATOM 381 C HIS A 188 -1.297 10.608 2.781 1.00 0.19 C ATOM 382 O HIS A 188 -1.856 10.992 3.809 1.00 0.22 O ATOM 383 CB HIS A 188 -2.739 11.978 1.266 1.00 0.25 C ATOM 384 CG HIS A 188 -2.882 12.850 0.056 1.00 0.32 C ATOM 385 ND1 HIS A 188 -2.429 14.148 0.040 1.00 0.39 N ATOM 386 CD2 HIS A 188 -3.443 12.563 -1.141 1.00 0.42 C ATOM 387 CE1 HIS A 188 -2.725 14.618 -1.161 1.00 0.48 C ATOM 388 NE2 HIS A 188 -3.339 13.692 -1.910 1.00 0.50 N ATOM 0 H HIS A 188 -1.422 10.185 -0.122 1.00 0.18 H new ATOM 0 HA HIS A 188 -0.660 12.344 1.709 1.00 0.20 H new ATOM 0 HB2 HIS A 188 -3.392 11.112 1.154 1.00 0.25 H new ATOM 0 HB3 HIS A 188 -3.087 12.529 2.139 1.00 0.25 H new ATOM 0 HD2 HIS A 188 -3.888 11.624 -1.434 1.00 0.42 H new ATOM 0 HE1 HIS A 188 -2.500 15.620 -1.495 1.00 0.48 H new ATOM 0 HE2 HIS A 188 -3.666 13.806 -2.869 1.00 0.50 H new ATOM 396 N TRP A 189 -0.684 9.426 2.709 1.00 0.18 N ATOM 397 CA TRP A 189 -0.630 8.551 3.883 1.00 0.19 C ATOM 398 C TRP A 189 0.261 9.163 4.961 1.00 0.20 C ATOM 399 O TRP A 189 1.259 9.818 4.660 1.00 0.20 O ATOM 400 CB TRP A 189 -0.071 7.157 3.561 1.00 0.18 C ATOM 401 CG TRP A 189 -0.906 6.283 2.679 1.00 0.15 C ATOM 402 CD1 TRP A 189 -2.266 6.230 2.604 1.00 0.18 C ATOM 403 CD2 TRP A 189 -0.409 5.288 1.777 1.00 0.12 C ATOM 404 NE1 TRP A 189 -2.649 5.284 1.680 1.00 0.15 N ATOM 405 CE2 TRP A 189 -1.522 4.689 1.163 1.00 0.12 C ATOM 406 CE3 TRP A 189 0.879 4.857 1.422 1.00 0.11 C ATOM 407 CZ2 TRP A 189 -1.388 3.676 0.212 1.00 0.12 C ATOM 408 CZ3 TRP A 189 1.013 3.852 0.480 1.00 0.12 C ATOM 409 CH2 TRP A 189 -0.115 3.273 -0.116 1.00 0.12 C ATOM 0 H TRP A 189 -0.228 9.058 1.874 1.00 0.18 H new ATOM 0 HA TRP A 189 -1.659 8.449 4.227 1.00 0.19 H new ATOM 0 HB2 TRP A 189 0.904 7.282 3.090 1.00 0.18 H new ATOM 0 HB3 TRP A 189 0.094 6.632 4.502 1.00 0.18 H new ATOM 0 HD1 TRP A 189 -2.943 6.840 3.184 1.00 0.18 H new ATOM 0 HE1 TRP A 189 -3.610 5.061 1.421 1.00 0.15 H new ATOM 0 HE3 TRP A 189 1.751 5.303 1.877 1.00 0.11 H new ATOM 0 HZ2 TRP A 189 -2.254 3.225 -0.250 1.00 0.12 H new ATOM 0 HZ3 TRP A 189 1.999 3.510 0.201 1.00 0.12 H new ATOM 0 HH2 TRP A 189 0.018 2.492 -0.850 1.00 0.12 H new ATOM 420 N SER A 190 -0.105 8.948 6.211 1.00 0.23 N ATOM 421 CA SER A 190 0.767 9.288 7.322 1.00 0.25 C ATOM 422 C SER A 190 1.552 8.047 7.720 1.00 0.25 C ATOM 423 O SER A 190 1.142 6.940 7.382 1.00 0.25 O ATOM 424 CB SER A 190 -0.055 9.818 8.499 1.00 0.29 C ATOM 425 OG SER A 190 0.774 10.232 9.571 1.00 1.18 O ATOM 0 H SER A 190 -0.999 8.540 6.483 1.00 0.23 H new ATOM 0 HA SER A 190 1.461 10.074 7.025 1.00 0.25 H new ATOM 0 HB2 SER A 190 -0.667 10.657 8.167 1.00 0.29 H new ATOM 0 HB3 SER A 190 -0.738 9.042 8.845 1.00 0.29 H new ATOM 0 HG SER A 190 0.217 10.566 10.305 1.00 1.18 H new ATOM 431 N THR A 191 2.659 8.242 8.436 1.00 0.26 N ATOM 432 CA THR A 191 3.611 7.177 8.765 1.00 0.28 C ATOM 433 C THR A 191 2.928 5.855 9.145 1.00 0.25 C ATOM 434 O THR A 191 3.217 4.812 8.559 1.00 0.25 O ATOM 435 CB THR A 191 4.517 7.638 9.920 1.00 0.31 C ATOM 436 OG1 THR A 191 4.828 9.030 9.752 1.00 0.74 O ATOM 437 CG2 THR A 191 5.805 6.828 9.961 1.00 0.62 C ATOM 0 H THR A 191 2.925 9.153 8.809 1.00 0.26 H new ATOM 0 HA THR A 191 4.198 6.985 7.867 1.00 0.28 H new ATOM 0 HB THR A 191 3.987 7.484 10.860 1.00 0.31 H new ATOM 0 HG1 THR A 191 5.404 9.328 10.487 1.00 0.74 H new ATOM 0 HG21 THR A 191 6.427 7.175 10.787 1.00 0.62 H new ATOM 0 HG22 THR A 191 5.567 5.774 10.103 1.00 0.62 H new ATOM 0 HG23 THR A 191 6.345 6.955 9.022 1.00 0.62 H new ATOM 445 N ASP A 192 2.017 5.905 10.114 1.00 0.24 N ATOM 446 CA ASP A 192 1.287 4.710 10.538 1.00 0.24 C ATOM 447 C ASP A 192 0.459 4.127 9.403 1.00 0.23 C ATOM 448 O ASP A 192 0.516 2.933 9.148 1.00 0.25 O ATOM 449 CB ASP A 192 0.378 5.006 11.732 1.00 0.29 C ATOM 450 CG ASP A 192 1.142 5.111 13.034 1.00 1.06 C ATOM 451 OD1 ASP A 192 1.620 4.067 13.532 1.00 1.37 O ATOM 452 OD2 ASP A 192 1.257 6.233 13.571 1.00 1.75 O ATOM 0 H ASP A 192 1.767 6.755 10.619 1.00 0.24 H new ATOM 0 HA ASP A 192 2.036 3.976 10.837 1.00 0.24 H new ATOM 0 HB2 ASP A 192 -0.158 5.938 11.553 1.00 0.29 H new ATOM 0 HB3 ASP A 192 -0.371 4.219 11.817 1.00 0.29 H new ATOM 457 N GLN A 193 -0.296 4.978 8.722 1.00 0.22 N ATOM 458 CA GLN A 193 -1.187 4.551 7.637 1.00 0.21 C ATOM 459 C GLN A 193 -0.412 4.016 6.437 1.00 0.17 C ATOM 460 O GLN A 193 -0.902 3.122 5.745 1.00 0.14 O ATOM 461 CB GLN A 193 -2.089 5.705 7.211 1.00 0.24 C ATOM 462 CG GLN A 193 -2.906 6.287 8.351 1.00 0.30 C ATOM 463 CD GLN A 193 -3.470 7.655 8.021 1.00 0.41 C ATOM 464 OE1 GLN A 193 -3.719 7.904 6.746 1.00 1.34 O flip ATOM 465 NE2 GLN A 193 -3.669 8.486 8.903 1.00 0.85 N flip ATOM 0 H GLN A 193 -0.313 5.982 8.901 1.00 0.22 H new ATOM 0 HA GLN A 193 -1.800 3.735 8.019 1.00 0.21 H new ATOM 0 HB2 GLN A 193 -1.476 6.493 6.775 1.00 0.24 H new ATOM 0 HB3 GLN A 193 -2.765 5.358 6.430 1.00 0.24 H new ATOM 0 HG2 GLN A 193 -3.724 5.608 8.591 1.00 0.30 H new ATOM 0 HG3 GLN A 193 -2.281 6.360 9.241 1.00 0.30 H new ATOM 0 HE21 GLN A 193 -3.464 8.256 9.876 1.00 0.85 H new ATOM 0 HE22 GLN A 193 -4.039 9.406 8.663 1.00 0.85 H new ATOM 474 N VAL A 194 0.768 4.549 6.189 1.00 0.16 N ATOM 475 CA VAL A 194 1.651 3.980 5.170 1.00 0.14 C ATOM 476 C VAL A 194 1.847 2.481 5.424 1.00 0.13 C ATOM 477 O VAL A 194 1.773 1.659 4.510 1.00 0.13 O ATOM 478 CB VAL A 194 3.032 4.679 5.158 1.00 0.16 C ATOM 479 CG1 VAL A 194 3.924 4.110 4.071 1.00 0.17 C ATOM 480 CG2 VAL A 194 2.877 6.178 4.970 1.00 0.17 C ATOM 0 H VAL A 194 1.142 5.367 6.670 1.00 0.16 H new ATOM 0 HA VAL A 194 1.178 4.136 4.200 1.00 0.14 H new ATOM 0 HB VAL A 194 3.503 4.493 6.123 1.00 0.16 H new ATOM 0 HG11 VAL A 194 4.887 4.620 4.087 1.00 0.17 H new ATOM 0 HG12 VAL A 194 4.075 3.045 4.245 1.00 0.17 H new ATOM 0 HG13 VAL A 194 3.452 4.256 3.099 1.00 0.17 H new ATOM 0 HG21 VAL A 194 3.861 6.648 4.965 1.00 0.17 H new ATOM 0 HG22 VAL A 194 2.375 6.376 4.023 1.00 0.17 H new ATOM 0 HG23 VAL A 194 2.284 6.588 5.787 1.00 0.17 H new ATOM 490 N LEU A 195 2.045 2.137 6.686 1.00 0.14 N ATOM 491 CA LEU A 195 2.223 0.748 7.096 1.00 0.14 C ATOM 492 C LEU A 195 0.914 0.112 7.568 1.00 0.12 C ATOM 493 O LEU A 195 0.881 -1.095 7.783 1.00 0.14 O ATOM 494 CB LEU A 195 3.317 0.603 8.155 1.00 0.16 C ATOM 495 CG LEU A 195 4.675 1.191 7.778 1.00 0.18 C ATOM 496 CD1 LEU A 195 5.620 1.141 8.966 1.00 0.23 C ATOM 497 CD2 LEU A 195 5.270 0.438 6.599 1.00 0.18 C ATOM 0 H LEU A 195 2.087 2.807 7.454 1.00 0.14 H new ATOM 0 HA LEU A 195 2.546 0.204 6.209 1.00 0.14 H new ATOM 0 HB2 LEU A 195 2.976 1.080 9.073 1.00 0.16 H new ATOM 0 HB3 LEU A 195 3.447 -0.456 8.376 1.00 0.16 H new ATOM 0 HG LEU A 195 4.533 2.232 7.489 1.00 0.18 H new ATOM 0 HD11 LEU A 195 6.584 1.563 8.682 1.00 0.23 H new ATOM 0 HD12 LEU A 195 5.200 1.718 9.790 1.00 0.23 H new ATOM 0 HD13 LEU A 195 5.756 0.106 9.280 1.00 0.23 H new ATOM 0 HD21 LEU A 195 6.238 0.869 6.343 1.00 0.18 H new ATOM 0 HD22 LEU A 195 5.399 -0.611 6.865 1.00 0.18 H new ATOM 0 HD23 LEU A 195 4.600 0.515 5.743 1.00 0.18 H new ATOM 509 N HIS A 196 -0.165 0.870 7.715 1.00 0.11 N ATOM 510 CA HIS A 196 -1.478 0.231 7.836 1.00 0.10 C ATOM 511 C HIS A 196 -1.753 -0.531 6.543 1.00 0.09 C ATOM 512 O HIS A 196 -2.190 -1.680 6.551 1.00 0.12 O ATOM 513 CB HIS A 196 -2.604 1.240 8.098 1.00 0.13 C ATOM 514 CG HIS A 196 -2.728 1.680 9.529 1.00 0.16 C ATOM 515 ND1 HIS A 196 -2.629 2.922 10.062 1.00 0.30 N flip ATOM 516 CD2 HIS A 196 -3.014 0.786 10.531 1.00 0.30 C flip ATOM 517 CE1 HIS A 196 -2.858 2.796 11.407 1.00 0.30 C flip ATOM 518 NE2 HIS A 196 -3.085 1.499 11.641 1.00 0.28 N flip ATOM 0 H HIS A 196 -0.167 1.889 7.753 1.00 0.11 H new ATOM 0 HA HIS A 196 -1.458 -0.441 8.694 1.00 0.10 H new ATOM 0 HB2 HIS A 196 -2.439 2.119 7.474 1.00 0.13 H new ATOM 0 HB3 HIS A 196 -3.550 0.799 7.784 1.00 0.13 H new ATOM 0 HD2 HIS A 196 -3.152 -0.281 10.432 1.00 0.30 H new ATOM 0 HE1 HIS A 196 -2.856 3.591 12.138 1.00 0.30 H new ATOM 0 HE2 HIS A 196 -3.288 1.109 12.561 1.00 0.28 H new ATOM 526 N TRP A 197 -1.460 0.144 5.439 1.00 0.10 N ATOM 527 CA TRP A 197 -1.467 -0.472 4.115 1.00 0.09 C ATOM 528 C TRP A 197 -0.493 -1.637 4.056 1.00 0.10 C ATOM 529 O TRP A 197 -0.895 -2.749 3.730 1.00 0.13 O ATOM 530 CB TRP A 197 -1.117 0.572 3.047 1.00 0.09 C ATOM 531 CG TRP A 197 -1.080 0.043 1.638 1.00 0.07 C ATOM 532 CD1 TRP A 197 -2.140 -0.402 0.906 1.00 0.09 C ATOM 533 CD2 TRP A 197 0.069 -0.065 0.782 1.00 0.07 C ATOM 534 NE1 TRP A 197 -1.725 -0.797 -0.343 1.00 0.08 N ATOM 535 CE2 TRP A 197 -0.375 -0.594 -0.447 1.00 0.07 C ATOM 536 CE3 TRP A 197 1.427 0.232 0.932 1.00 0.12 C ATOM 537 CZ2 TRP A 197 0.491 -0.830 -1.516 1.00 0.10 C ATOM 538 CZ3 TRP A 197 2.286 -0.002 -0.130 1.00 0.16 C ATOM 539 CH2 TRP A 197 1.815 -0.527 -1.342 1.00 0.14 C ATOM 0 H TRP A 197 -1.211 1.133 5.434 1.00 0.10 H new ATOM 0 HA TRP A 197 -2.468 -0.857 3.918 1.00 0.09 H new ATOM 0 HB2 TRP A 197 -1.845 1.382 3.098 1.00 0.09 H new ATOM 0 HB3 TRP A 197 -0.144 1.003 3.285 1.00 0.09 H new ATOM 0 HD1 TRP A 197 -3.161 -0.439 1.257 1.00 0.09 H new ATOM 0 HE1 TRP A 197 -2.325 -1.179 -1.074 1.00 0.08 H new ATOM 0 HE3 TRP A 197 1.801 0.637 1.861 1.00 0.12 H new ATOM 0 HZ2 TRP A 197 0.129 -1.238 -2.448 1.00 0.10 H new ATOM 0 HZ3 TRP A 197 3.337 0.224 -0.022 1.00 0.16 H new ATOM 0 HH2 TRP A 197 2.509 -0.695 -2.152 1.00 0.14 H new ATOM 550 N VAL A 198 0.768 -1.412 4.380 1.00 0.10 N ATOM 551 CA VAL A 198 1.759 -2.474 4.294 1.00 0.12 C ATOM 552 C VAL A 198 1.415 -3.678 5.189 1.00 0.13 C ATOM 553 O VAL A 198 1.595 -4.810 4.761 1.00 0.15 O ATOM 554 CB VAL A 198 3.180 -1.950 4.588 1.00 0.14 C ATOM 555 CG1 VAL A 198 4.194 -3.073 4.549 1.00 0.23 C ATOM 556 CG2 VAL A 198 3.560 -0.863 3.596 1.00 0.13 C ATOM 0 H VAL A 198 1.129 -0.514 4.702 1.00 0.10 H new ATOM 0 HA VAL A 198 1.739 -2.830 3.264 1.00 0.12 H new ATOM 0 HB VAL A 198 3.181 -1.527 5.592 1.00 0.14 H new ATOM 0 HG11 VAL A 198 5.186 -2.675 4.760 1.00 0.23 H new ATOM 0 HG12 VAL A 198 3.937 -3.822 5.298 1.00 0.23 H new ATOM 0 HG13 VAL A 198 4.190 -3.533 3.561 1.00 0.23 H new ATOM 0 HG21 VAL A 198 4.565 -0.504 3.817 1.00 0.13 H new ATOM 0 HG22 VAL A 198 3.534 -1.268 2.584 1.00 0.13 H new ATOM 0 HG23 VAL A 198 2.854 -0.036 3.674 1.00 0.13 H new ATOM 566 N VAL A 199 0.893 -3.460 6.390 1.00 0.13 N ATOM 567 CA VAL A 199 0.522 -4.583 7.259 1.00 0.14 C ATOM 568 C VAL A 199 -0.730 -5.311 6.744 1.00 0.13 C ATOM 569 O VAL A 199 -0.720 -6.528 6.554 1.00 0.15 O ATOM 570 CB VAL A 199 0.300 -4.129 8.721 1.00 0.18 C ATOM 571 CG1 VAL A 199 -0.268 -5.261 9.565 1.00 0.21 C ATOM 572 CG2 VAL A 199 1.603 -3.629 9.330 1.00 0.20 C ATOM 0 H VAL A 199 0.717 -2.536 6.784 1.00 0.13 H new ATOM 0 HA VAL A 199 1.361 -5.279 7.238 1.00 0.14 H new ATOM 0 HB VAL A 199 -0.421 -3.312 8.710 1.00 0.18 H new ATOM 0 HG11 VAL A 199 -0.414 -4.914 10.588 1.00 0.21 H new ATOM 0 HG12 VAL A 199 -1.224 -5.580 9.150 1.00 0.21 H new ATOM 0 HG13 VAL A 199 0.427 -6.101 9.562 1.00 0.21 H new ATOM 0 HG21 VAL A 199 1.427 -3.314 10.359 1.00 0.20 H new ATOM 0 HG22 VAL A 199 2.342 -4.430 9.317 1.00 0.20 H new ATOM 0 HG23 VAL A 199 1.975 -2.784 8.751 1.00 0.20 H new ATOM 582 N TRP A 200 -1.789 -4.555 6.502 1.00 0.13 N ATOM 583 CA TRP A 200 -3.050 -5.129 6.027 1.00 0.13 C ATOM 584 C TRP A 200 -2.872 -5.789 4.661 1.00 0.13 C ATOM 585 O TRP A 200 -3.305 -6.918 4.450 1.00 0.13 O ATOM 586 CB TRP A 200 -4.144 -4.054 5.959 1.00 0.14 C ATOM 587 CG TRP A 200 -5.533 -4.612 5.831 1.00 0.14 C ATOM 588 CD1 TRP A 200 -6.500 -4.621 6.794 1.00 0.15 C ATOM 589 CD2 TRP A 200 -6.107 -5.253 4.684 1.00 0.13 C ATOM 590 NE1 TRP A 200 -7.636 -5.226 6.316 1.00 0.16 N ATOM 591 CE2 TRP A 200 -7.419 -5.624 5.025 1.00 0.15 C ATOM 592 CE3 TRP A 200 -5.638 -5.549 3.402 1.00 0.13 C ATOM 593 CZ2 TRP A 200 -8.260 -6.277 4.132 1.00 0.15 C ATOM 594 CZ3 TRP A 200 -6.467 -6.196 2.519 1.00 0.14 C ATOM 595 CH2 TRP A 200 -7.768 -6.555 2.884 1.00 0.15 C ATOM 0 H TRP A 200 -1.806 -3.543 6.625 1.00 0.13 H new ATOM 0 HA TRP A 200 -3.357 -5.895 6.739 1.00 0.13 H new ATOM 0 HB2 TRP A 200 -4.091 -3.437 6.856 1.00 0.14 H new ATOM 0 HB3 TRP A 200 -3.945 -3.400 5.110 1.00 0.14 H new ATOM 0 HD1 TRP A 200 -6.388 -4.212 7.787 1.00 0.15 H new ATOM 0 HE1 TRP A 200 -8.502 -5.358 6.839 1.00 0.16 H new ATOM 0 HE3 TRP A 200 -4.636 -5.272 3.109 1.00 0.13 H new ATOM 0 HZ2 TRP A 200 -9.265 -6.555 4.412 1.00 0.15 H new ATOM 0 HZ3 TRP A 200 -6.109 -6.431 1.528 1.00 0.14 H new ATOM 0 HH2 TRP A 200 -8.398 -7.062 2.168 1.00 0.15 H new ATOM 606 N VAL A 201 -2.233 -5.112 3.745 1.00 0.14 N ATOM 607 CA VAL A 201 -2.096 -5.643 2.399 1.00 0.16 C ATOM 608 C VAL A 201 -1.025 -6.738 2.312 1.00 0.16 C ATOM 609 O VAL A 201 -1.137 -7.631 1.477 1.00 0.18 O ATOM 610 CB VAL A 201 -1.867 -4.532 1.360 1.00 0.20 C ATOM 611 CG1 VAL A 201 -1.810 -5.104 -0.043 1.00 0.26 C ATOM 612 CG2 VAL A 201 -2.977 -3.503 1.458 1.00 0.22 C ATOM 0 H VAL A 201 -1.800 -4.201 3.895 1.00 0.14 H new ATOM 0 HA VAL A 201 -3.047 -6.115 2.154 1.00 0.16 H new ATOM 0 HB VAL A 201 -0.910 -4.054 1.570 1.00 0.20 H new ATOM 0 HG11 VAL A 201 -1.647 -4.298 -0.758 1.00 0.26 H new ATOM 0 HG12 VAL A 201 -0.991 -5.820 -0.111 1.00 0.26 H new ATOM 0 HG13 VAL A 201 -2.751 -5.606 -0.270 1.00 0.26 H new ATOM 0 HG21 VAL A 201 -2.811 -2.718 0.721 1.00 0.22 H new ATOM 0 HG22 VAL A 201 -3.937 -3.984 1.267 1.00 0.22 H new ATOM 0 HG23 VAL A 201 -2.982 -3.067 2.457 1.00 0.22 H new ATOM 622 N MET A 202 -0.027 -6.738 3.185 1.00 0.17 N ATOM 623 CA MET A 202 0.867 -7.898 3.225 1.00 0.20 C ATOM 624 C MET A 202 0.109 -9.115 3.766 1.00 0.19 C ATOM 625 O MET A 202 0.449 -10.254 3.468 1.00 0.22 O ATOM 626 CB MET A 202 2.139 -7.654 4.050 1.00 0.23 C ATOM 627 CG MET A 202 1.924 -7.687 5.553 1.00 0.23 C ATOM 628 SD MET A 202 3.460 -7.874 6.484 1.00 0.40 S ATOM 629 CE MET A 202 4.366 -6.427 5.946 1.00 0.56 C ATOM 0 H MET A 202 0.183 -5.991 3.847 1.00 0.17 H new ATOM 0 HA MET A 202 1.195 -8.083 2.202 1.00 0.20 H new ATOM 0 HB2 MET A 202 2.881 -8.407 3.784 1.00 0.23 H new ATOM 0 HB3 MET A 202 2.556 -6.685 3.775 1.00 0.23 H new ATOM 0 HG2 MET A 202 1.428 -6.768 5.863 1.00 0.23 H new ATOM 0 HG3 MET A 202 1.254 -8.510 5.800 1.00 0.23 H new ATOM 0 HE1 MET A 202 5.208 -6.254 6.617 1.00 0.56 H new ATOM 0 HE2 MET A 202 4.736 -6.585 4.933 1.00 0.56 H new ATOM 0 HE3 MET A 202 3.707 -5.559 5.960 1.00 0.56 H new ATOM 639 N LYS A 203 -0.935 -8.852 4.541 1.00 0.16 N ATOM 640 CA LYS A 203 -1.806 -9.898 5.080 1.00 0.18 C ATOM 641 C LYS A 203 -2.520 -10.676 3.974 1.00 0.18 C ATOM 642 O LYS A 203 -2.481 -11.906 3.958 1.00 0.20 O ATOM 643 CB LYS A 203 -2.857 -9.263 5.996 1.00 0.19 C ATOM 644 CG LYS A 203 -3.985 -10.198 6.388 1.00 0.36 C ATOM 645 CD LYS A 203 -5.149 -9.431 6.991 1.00 0.82 C ATOM 646 CE LYS A 203 -5.887 -8.629 5.933 1.00 1.61 C ATOM 647 NZ LYS A 203 -6.653 -9.505 5.004 1.00 2.35 N ATOM 0 H LYS A 203 -1.205 -7.908 4.816 1.00 0.16 H new ATOM 0 HA LYS A 203 -1.179 -10.595 5.635 1.00 0.18 H new ATOM 0 HB2 LYS A 203 -2.366 -8.905 6.901 1.00 0.19 H new ATOM 0 HB3 LYS A 203 -3.279 -8.391 5.496 1.00 0.19 H new ATOM 0 HG2 LYS A 203 -4.325 -10.750 5.512 1.00 0.36 H new ATOM 0 HG3 LYS A 203 -3.619 -10.933 7.105 1.00 0.36 H new ATOM 0 HD2 LYS A 203 -5.838 -10.127 7.469 1.00 0.82 H new ATOM 0 HD3 LYS A 203 -4.782 -8.761 7.769 1.00 0.82 H new ATOM 0 HE2 LYS A 203 -6.569 -7.930 6.418 1.00 1.61 H new ATOM 0 HE3 LYS A 203 -5.172 -8.034 5.364 1.00 1.61 H new ATOM 0 HZ1 LYS A 203 -6.512 -9.181 4.026 1.00 2.35 H new ATOM 0 HZ2 LYS A 203 -6.318 -10.485 5.096 1.00 2.35 H new ATOM 0 HZ3 LYS A 203 -7.665 -9.461 5.241 1.00 2.35 H new ATOM 661 N GLU A 204 -3.159 -9.955 3.049 1.00 0.18 N ATOM 662 CA GLU A 204 -4.069 -10.562 2.072 1.00 0.18 C ATOM 663 C GLU A 204 -3.391 -11.685 1.278 1.00 0.23 C ATOM 664 O GLU A 204 -3.973 -12.753 1.072 1.00 0.47 O ATOM 665 CB GLU A 204 -4.609 -9.488 1.123 1.00 0.23 C ATOM 666 CG GLU A 204 -5.879 -9.899 0.393 1.00 0.42 C ATOM 667 CD GLU A 204 -6.975 -10.325 1.348 1.00 0.93 C ATOM 668 OE1 GLU A 204 -7.222 -9.607 2.341 1.00 1.45 O ATOM 669 OE2 GLU A 204 -7.594 -11.384 1.112 1.00 1.72 O ATOM 0 H GLU A 204 -3.062 -8.944 2.956 1.00 0.18 H new ATOM 0 HA GLU A 204 -4.897 -11.009 2.622 1.00 0.18 H new ATOM 0 HB2 GLU A 204 -4.805 -8.579 1.691 1.00 0.23 H new ATOM 0 HB3 GLU A 204 -3.841 -9.245 0.389 1.00 0.23 H new ATOM 0 HG2 GLU A 204 -6.232 -9.066 -0.215 1.00 0.42 H new ATOM 0 HG3 GLU A 204 -5.655 -10.719 -0.289 1.00 0.42 H new ATOM 676 N PHE A 205 -2.162 -11.446 0.851 1.00 0.18 N ATOM 677 CA PHE A 205 -1.406 -12.412 0.051 1.00 0.19 C ATOM 678 C PHE A 205 -0.346 -13.114 0.892 1.00 0.22 C ATOM 679 O PHE A 205 0.551 -13.769 0.357 1.00 0.25 O ATOM 680 CB PHE A 205 -0.732 -11.709 -1.129 1.00 0.19 C ATOM 681 CG PHE A 205 -1.401 -10.426 -1.518 1.00 0.18 C ATOM 682 CD1 PHE A 205 -2.535 -10.460 -2.298 1.00 0.24 C ATOM 683 CD2 PHE A 205 -0.898 -9.197 -1.119 1.00 0.21 C ATOM 684 CE1 PHE A 205 -3.169 -9.303 -2.679 1.00 0.29 C ATOM 685 CE2 PHE A 205 -1.527 -8.026 -1.497 1.00 0.25 C ATOM 686 CZ PHE A 205 -2.612 -8.025 -2.198 1.00 0.29 C ATOM 0 H PHE A 205 -1.656 -10.582 1.045 1.00 0.18 H new ATOM 0 HA PHE A 205 -2.108 -13.159 -0.319 1.00 0.19 H new ATOM 0 HB2 PHE A 205 0.308 -11.505 -0.875 1.00 0.19 H new ATOM 0 HB3 PHE A 205 -0.725 -12.381 -1.987 1.00 0.19 H new ATOM 0 HD1 PHE A 205 -2.933 -11.413 -2.616 1.00 0.24 H new ATOM 0 HD2 PHE A 205 -0.008 -9.155 -0.508 1.00 0.21 H new ATOM 0 HE1 PHE A 205 -4.046 -9.328 -3.309 1.00 0.29 H new ATOM 0 HE2 PHE A 205 -1.098 -7.082 -1.197 1.00 0.25 H new ATOM 0 HZ PHE A 205 -3.108 -7.094 -2.430 1.00 0.29 H new ATOM 696 N SER A 206 -0.472 -12.978 2.212 1.00 0.21 N ATOM 697 CA SER A 206 0.392 -13.677 3.164 1.00 0.23 C ATOM 698 C SER A 206 1.870 -13.375 2.910 1.00 0.24 C ATOM 699 O SER A 206 2.704 -14.273 2.860 1.00 0.28 O ATOM 700 CB SER A 206 0.129 -15.185 3.114 1.00 0.26 C ATOM 701 OG SER A 206 -1.251 -15.465 3.290 1.00 1.14 O ATOM 0 H SER A 206 -1.174 -12.382 2.651 1.00 0.21 H new ATOM 0 HA SER A 206 0.152 -13.313 4.163 1.00 0.23 H new ATOM 0 HB2 SER A 206 0.466 -15.585 2.158 1.00 0.26 H new ATOM 0 HB3 SER A 206 0.707 -15.685 3.891 1.00 0.26 H new ATOM 0 HG SER A 206 -1.396 -16.434 3.253 1.00 1.14 H new ATOM 707 N MET A 207 2.178 -12.086 2.773 1.00 0.25 N ATOM 708 CA MET A 207 3.545 -11.615 2.585 1.00 0.27 C ATOM 709 C MET A 207 4.105 -11.088 3.895 1.00 0.52 C ATOM 710 O MET A 207 4.992 -10.242 3.885 1.00 1.36 O ATOM 711 CB MET A 207 3.601 -10.490 1.554 1.00 0.32 C ATOM 712 CG MET A 207 2.865 -10.772 0.260 1.00 0.52 C ATOM 713 SD MET A 207 3.024 -9.407 -0.898 1.00 0.95 S ATOM 714 CE MET A 207 2.335 -8.065 0.068 1.00 0.94 C ATOM 0 H MET A 207 1.483 -11.339 2.790 1.00 0.25 H new ATOM 0 HA MET A 207 4.137 -12.460 2.234 1.00 0.27 H new ATOM 0 HB2 MET A 207 3.186 -9.586 2.001 1.00 0.32 H new ATOM 0 HB3 MET A 207 4.645 -10.281 1.323 1.00 0.32 H new ATOM 0 HG2 MET A 207 3.258 -11.682 -0.193 1.00 0.52 H new ATOM 0 HG3 MET A 207 1.811 -10.951 0.471 1.00 0.52 H new ATOM 0 HE1 MET A 207 1.812 -7.373 -0.592 1.00 0.94 H new ATOM 0 HE2 MET A 207 1.635 -8.466 0.801 1.00 0.94 H new ATOM 0 HE3 MET A 207 3.138 -7.538 0.584 1.00 0.94 H new ATOM 769 N ASP A 211 9.551 -5.429 4.529 1.00 0.28 N ATOM 770 CA ASP A 211 10.154 -4.403 5.376 1.00 0.28 C ATOM 771 C ASP A 211 9.159 -3.343 5.823 1.00 0.27 C ATOM 772 O ASP A 211 8.822 -2.434 5.065 1.00 0.33 O ATOM 773 CB ASP A 211 11.305 -3.732 4.634 1.00 0.34 C ATOM 774 CG ASP A 211 12.534 -4.608 4.567 1.00 0.65 C ATOM 775 OD1 ASP A 211 12.481 -5.670 3.918 1.00 0.91 O ATOM 776 OD2 ASP A 211 13.561 -4.238 5.172 1.00 0.88 O ATOM 0 HA ASP A 211 10.516 -4.907 6.272 1.00 0.28 H new ATOM 0 HB2 ASP A 211 10.985 -3.481 3.623 1.00 0.34 H new ATOM 0 HB3 ASP A 211 11.557 -2.795 5.130 1.00 0.34 H new ATOM 781 N LEU A 212 8.712 -3.460 7.064 1.00 0.30 N ATOM 782 CA LEU A 212 7.854 -2.462 7.674 1.00 0.36 C ATOM 783 C LEU A 212 8.663 -1.241 8.093 1.00 0.42 C ATOM 784 O LEU A 212 8.338 -0.115 7.725 1.00 0.56 O ATOM 785 CB LEU A 212 7.144 -3.052 8.895 1.00 0.43 C ATOM 786 CG LEU A 212 6.091 -4.114 8.588 1.00 0.48 C ATOM 787 CD1 LEU A 212 5.669 -4.832 9.860 1.00 0.56 C ATOM 788 CD2 LEU A 212 4.886 -3.475 7.917 1.00 0.52 C ATOM 0 H LEU A 212 8.934 -4.248 7.673 1.00 0.30 H new ATOM 0 HA LEU A 212 7.111 -2.155 6.938 1.00 0.36 H new ATOM 0 HB2 LEU A 212 7.894 -3.488 9.555 1.00 0.43 H new ATOM 0 HB3 LEU A 212 6.668 -2.240 9.445 1.00 0.43 H new ATOM 0 HG LEU A 212 6.525 -4.848 7.908 1.00 0.48 H new ATOM 0 HD11 LEU A 212 4.918 -5.585 9.621 1.00 0.56 H new ATOM 0 HD12 LEU A 212 6.536 -5.315 10.310 1.00 0.56 H new ATOM 0 HD13 LEU A 212 5.249 -4.112 10.562 1.00 0.56 H new ATOM 0 HD21 LEU A 212 4.141 -4.241 7.702 1.00 0.52 H new ATOM 0 HD22 LEU A 212 4.455 -2.725 8.581 1.00 0.52 H new ATOM 0 HD23 LEU A 212 5.197 -3.000 6.986 1.00 0.52 H new ATOM 800 N THR A 213 9.742 -1.472 8.829 1.00 0.44 N ATOM 801 CA THR A 213 10.508 -0.380 9.413 1.00 0.51 C ATOM 802 C THR A 213 11.303 0.373 8.341 1.00 0.46 C ATOM 803 O THR A 213 11.706 1.517 8.540 1.00 0.52 O ATOM 804 CB THR A 213 11.448 -0.886 10.535 1.00 0.71 C ATOM 805 OG1 THR A 213 11.891 0.210 11.349 1.00 1.56 O ATOM 806 CG2 THR A 213 12.657 -1.612 9.964 1.00 1.34 C ATOM 0 H THR A 213 10.105 -2.403 9.035 1.00 0.44 H new ATOM 0 HA THR A 213 9.796 0.315 9.859 1.00 0.51 H new ATOM 0 HB THR A 213 10.880 -1.588 11.145 1.00 0.71 H new ATOM 0 HG1 THR A 213 11.998 1.009 10.792 1.00 1.56 H new ATOM 0 HG21 THR A 213 13.295 -1.953 10.779 1.00 1.34 H new ATOM 0 HG22 THR A 213 12.324 -2.470 9.380 1.00 1.34 H new ATOM 0 HG23 THR A 213 13.220 -0.933 9.323 1.00 1.34 H new ATOM 814 N THR A 214 11.511 -0.263 7.196 1.00 0.45 N ATOM 815 CA THR A 214 12.214 0.374 6.094 1.00 0.47 C ATOM 816 C THR A 214 11.273 1.306 5.330 1.00 0.42 C ATOM 817 O THR A 214 11.705 2.181 4.572 1.00 0.60 O ATOM 818 CB THR A 214 12.807 -0.676 5.143 1.00 0.57 C ATOM 819 OG1 THR A 214 13.421 -1.715 5.918 1.00 1.18 O ATOM 820 CG2 THR A 214 13.846 -0.048 4.233 1.00 0.40 C ATOM 0 H THR A 214 11.203 -1.217 7.008 1.00 0.45 H new ATOM 0 HA THR A 214 13.033 0.962 6.509 1.00 0.47 H new ATOM 0 HB THR A 214 12.007 -1.087 4.527 1.00 0.57 H new ATOM 0 HG1 THR A 214 13.653 -2.466 5.333 1.00 1.18 H new ATOM 0 HG21 THR A 214 14.254 -0.809 3.567 1.00 0.40 H new ATOM 0 HG22 THR A 214 13.382 0.741 3.641 1.00 0.40 H new ATOM 0 HG23 THR A 214 14.650 0.375 4.836 1.00 0.40 H new ATOM 828 N LEU A 215 9.981 1.121 5.550 1.00 0.30 N ATOM 829 CA LEU A 215 8.970 1.985 4.967 1.00 0.27 C ATOM 830 C LEU A 215 8.391 2.893 6.041 1.00 0.25 C ATOM 831 O LEU A 215 7.259 3.367 5.933 1.00 0.29 O ATOM 832 CB LEU A 215 7.866 1.155 4.312 1.00 0.25 C ATOM 833 CG LEU A 215 8.313 0.297 3.131 1.00 0.23 C ATOM 834 CD1 LEU A 215 7.148 -0.521 2.602 1.00 0.25 C ATOM 835 CD2 LEU A 215 8.894 1.172 2.031 1.00 0.24 C ATOM 0 H LEU A 215 9.607 0.373 6.134 1.00 0.30 H new ATOM 0 HA LEU A 215 9.432 2.600 4.195 1.00 0.27 H new ATOM 0 HB2 LEU A 215 7.426 0.504 5.067 1.00 0.25 H new ATOM 0 HB3 LEU A 215 7.079 1.829 3.974 1.00 0.25 H new ATOM 0 HG LEU A 215 9.089 -0.388 3.472 1.00 0.23 H new ATOM 0 HD11 LEU A 215 7.482 -1.128 1.760 1.00 0.25 H new ATOM 0 HD12 LEU A 215 6.772 -1.172 3.392 1.00 0.25 H new ATOM 0 HD13 LEU A 215 6.353 0.148 2.274 1.00 0.25 H new ATOM 0 HD21 LEU A 215 9.208 0.546 1.196 1.00 0.24 H new ATOM 0 HD22 LEU A 215 8.137 1.879 1.690 1.00 0.24 H new ATOM 0 HD23 LEU A 215 9.754 1.720 2.417 1.00 0.24 H new ATOM 847 N ASN A 216 9.185 3.132 7.080 1.00 0.24 N ATOM 848 CA ASN A 216 8.807 4.042 8.155 1.00 0.26 C ATOM 849 C ASN A 216 8.967 5.483 7.677 1.00 0.22 C ATOM 850 O ASN A 216 9.822 6.232 8.150 1.00 0.29 O ATOM 851 CB ASN A 216 9.664 3.778 9.399 1.00 0.34 C ATOM 852 CG ASN A 216 9.185 4.530 10.631 1.00 0.69 C ATOM 853 OD1 ASN A 216 9.620 5.649 10.903 1.00 1.34 O ATOM 854 ND2 ASN A 216 8.301 3.911 11.401 1.00 0.64 N ATOM 0 H ASN A 216 10.103 2.703 7.200 1.00 0.24 H new ATOM 0 HA ASN A 216 7.764 3.875 8.425 1.00 0.26 H new ATOM 0 HB2 ASN A 216 9.664 2.709 9.612 1.00 0.34 H new ATOM 0 HB3 ASN A 216 10.695 4.061 9.188 1.00 0.34 H new ATOM 0 HD21 ASN A 216 7.960 4.362 12.250 1.00 0.64 H new ATOM 0 HD22 ASN A 216 7.962 2.984 11.145 1.00 0.64 H new ATOM 861 N ILE A 217 8.154 5.837 6.700 1.00 0.19 N ATOM 862 CA ILE A 217 8.176 7.150 6.086 1.00 0.19 C ATOM 863 C ILE A 217 6.751 7.610 5.847 1.00 0.18 C ATOM 864 O ILE A 217 5.811 6.849 6.074 1.00 0.19 O ATOM 865 CB ILE A 217 8.944 7.136 4.743 1.00 0.20 C ATOM 866 CG1 ILE A 217 8.522 5.925 3.899 1.00 0.27 C ATOM 867 CG2 ILE A 217 10.448 7.134 4.981 1.00 0.32 C ATOM 868 CD1 ILE A 217 9.145 5.895 2.522 1.00 0.89 C ATOM 0 H ILE A 217 7.451 5.212 6.306 1.00 0.19 H new ATOM 0 HA ILE A 217 8.690 7.835 6.761 1.00 0.19 H new ATOM 0 HB ILE A 217 8.693 8.042 4.192 1.00 0.20 H new ATOM 0 HG12 ILE A 217 8.792 5.012 4.430 1.00 0.27 H new ATOM 0 HG13 ILE A 217 7.437 5.925 3.797 1.00 0.27 H new ATOM 0 HG21 ILE A 217 10.968 7.124 4.023 1.00 0.32 H new ATOM 0 HG22 ILE A 217 10.730 8.028 5.537 1.00 0.32 H new ATOM 0 HG23 ILE A 217 10.725 6.248 5.553 1.00 0.32 H new ATOM 0 HD11 ILE A 217 8.800 5.011 1.986 1.00 0.89 H new ATOM 0 HD12 ILE A 217 8.855 6.790 1.972 1.00 0.89 H new ATOM 0 HD13 ILE A 217 10.231 5.862 2.614 1.00 0.89 H new ATOM 880 N SER A 218 6.577 8.841 5.401 1.00 0.19 N ATOM 881 CA SER A 218 5.241 9.339 5.131 1.00 0.20 C ATOM 882 C SER A 218 4.832 9.053 3.687 1.00 0.20 C ATOM 883 O SER A 218 5.675 8.681 2.865 1.00 0.21 O ATOM 884 CB SER A 218 5.142 10.831 5.456 1.00 0.23 C ATOM 885 OG SER A 218 6.191 11.559 4.829 1.00 1.10 O ATOM 0 H SER A 218 7.330 9.505 5.221 1.00 0.19 H new ATOM 0 HA SER A 218 4.542 8.811 5.780 1.00 0.20 H new ATOM 0 HB2 SER A 218 4.178 11.216 5.124 1.00 0.23 H new ATOM 0 HB3 SER A 218 5.188 10.976 6.535 1.00 0.23 H new ATOM 0 HG SER A 218 7.055 11.169 5.079 1.00 1.10 H new ATOM 891 N GLY A 219 3.550 9.217 3.380 1.00 0.21 N ATOM 892 CA GLY A 219 3.036 8.838 2.076 1.00 0.23 C ATOM 893 C GLY A 219 3.740 9.540 0.933 1.00 0.22 C ATOM 894 O GLY A 219 4.053 8.919 -0.087 1.00 0.22 O ATOM 0 H GLY A 219 2.854 9.608 4.015 1.00 0.21 H new ATOM 0 HA2 GLY A 219 3.139 7.760 1.951 1.00 0.23 H new ATOM 0 HA3 GLY A 219 1.971 9.064 2.032 1.00 0.23 H new ATOM 898 N ARG A 220 4.002 10.829 1.105 1.00 0.24 N ATOM 899 CA ARG A 220 4.676 11.618 0.082 1.00 0.25 C ATOM 900 C ARG A 220 6.044 11.026 -0.223 1.00 0.25 C ATOM 901 O ARG A 220 6.493 11.049 -1.362 1.00 0.32 O ATOM 902 CB ARG A 220 4.796 13.075 0.541 1.00 0.26 C ATOM 903 CG ARG A 220 5.279 14.046 -0.530 1.00 1.23 C ATOM 904 CD ARG A 220 6.797 14.079 -0.626 1.00 2.30 C ATOM 905 NE ARG A 220 7.272 14.918 -1.727 1.00 3.08 N ATOM 906 CZ ARG A 220 8.409 15.615 -1.691 1.00 4.20 C ATOM 907 NH1 ARG A 220 9.125 15.658 -0.574 1.00 4.78 N ATOM 908 NH2 ARG A 220 8.816 16.285 -2.762 1.00 5.01 N ATOM 0 H ARG A 220 3.757 11.352 1.946 1.00 0.24 H new ATOM 0 HA ARG A 220 4.087 11.595 -0.835 1.00 0.25 H new ATOM 0 HB2 ARG A 220 3.823 13.409 0.902 1.00 0.26 H new ATOM 0 HB3 ARG A 220 5.482 13.119 1.387 1.00 0.26 H new ATOM 0 HG2 ARG A 220 4.861 13.759 -1.495 1.00 1.23 H new ATOM 0 HG3 ARG A 220 4.908 15.046 -0.307 1.00 1.23 H new ATOM 0 HD2 ARG A 220 7.209 14.450 0.313 1.00 2.30 H new ATOM 0 HD3 ARG A 220 7.171 13.064 -0.760 1.00 2.30 H new ATOM 0 HE ARG A 220 6.701 14.973 -2.570 1.00 3.08 H new ATOM 0 HH11 ARG A 220 8.806 15.158 0.256 1.00 4.78 H new ATOM 0 HH12 ARG A 220 9.994 16.191 -0.546 1.00 4.78 H new ATOM 0 HH21 ARG A 220 8.259 16.268 -3.616 1.00 5.01 H new ATOM 0 HH22 ARG A 220 9.686 16.817 -2.731 1.00 5.01 H new ATOM 922 N GLU A 221 6.681 10.471 0.793 1.00 0.24 N ATOM 923 CA GLU A 221 7.979 9.841 0.637 1.00 0.27 C ATOM 924 C GLU A 221 7.828 8.472 -0.021 1.00 0.23 C ATOM 925 O GLU A 221 8.620 8.099 -0.885 1.00 0.23 O ATOM 926 CB GLU A 221 8.642 9.708 2.004 1.00 0.34 C ATOM 927 CG GLU A 221 8.907 11.041 2.679 1.00 0.84 C ATOM 928 CD GLU A 221 9.468 10.882 4.076 1.00 1.60 C ATOM 929 OE1 GLU A 221 8.697 10.527 4.994 1.00 2.45 O ATOM 930 OE2 GLU A 221 10.683 11.108 4.262 1.00 2.07 O ATOM 0 H GLU A 221 6.315 10.444 1.745 1.00 0.24 H new ATOM 0 HA GLU A 221 8.606 10.458 -0.006 1.00 0.27 H new ATOM 0 HB2 GLU A 221 8.007 9.102 2.650 1.00 0.34 H new ATOM 0 HB3 GLU A 221 9.585 9.173 1.892 1.00 0.34 H new ATOM 0 HG2 GLU A 221 9.606 11.618 2.074 1.00 0.84 H new ATOM 0 HG3 GLU A 221 7.979 11.611 2.726 1.00 0.84 H new ATOM 937 N LEU A 222 6.807 7.736 0.403 1.00 0.21 N ATOM 938 CA LEU A 222 6.481 6.434 -0.178 1.00 0.20 C ATOM 939 C LEU A 222 6.201 6.570 -1.679 1.00 0.18 C ATOM 940 O LEU A 222 6.764 5.840 -2.490 1.00 0.20 O ATOM 941 CB LEU A 222 5.269 5.836 0.561 1.00 0.21 C ATOM 942 CG LEU A 222 4.931 4.363 0.266 1.00 0.21 C ATOM 943 CD1 LEU A 222 4.199 4.214 -1.059 1.00 0.19 C ATOM 944 CD2 LEU A 222 6.193 3.512 0.275 1.00 0.26 C ATOM 0 H LEU A 222 6.182 8.022 1.157 1.00 0.21 H new ATOM 0 HA LEU A 222 7.331 5.762 -0.062 1.00 0.20 H new ATOM 0 HB2 LEU A 222 5.442 5.936 1.633 1.00 0.21 H new ATOM 0 HB3 LEU A 222 4.394 6.440 0.321 1.00 0.21 H new ATOM 0 HG LEU A 222 4.266 4.012 1.055 1.00 0.21 H new ATOM 0 HD11 LEU A 222 3.976 3.162 -1.235 1.00 0.19 H new ATOM 0 HD12 LEU A 222 3.269 4.781 -1.027 1.00 0.19 H new ATOM 0 HD13 LEU A 222 4.827 4.592 -1.866 1.00 0.19 H new ATOM 0 HD21 LEU A 222 5.934 2.474 0.065 1.00 0.26 H new ATOM 0 HD22 LEU A 222 6.882 3.875 -0.487 1.00 0.26 H new ATOM 0 HD23 LEU A 222 6.668 3.576 1.254 1.00 0.26 H new ATOM 956 N CYS A 223 5.343 7.513 -2.046 1.00 0.18 N ATOM 957 CA CYS A 223 4.979 7.705 -3.447 1.00 0.18 C ATOM 958 C CYS A 223 6.125 8.357 -4.226 1.00 0.18 C ATOM 959 O CYS A 223 6.212 8.227 -5.447 1.00 0.21 O ATOM 960 CB CYS A 223 3.705 8.549 -3.554 1.00 0.21 C ATOM 961 SG CYS A 223 3.011 8.650 -5.222 1.00 0.71 S ATOM 0 H CYS A 223 4.887 8.155 -1.398 1.00 0.18 H new ATOM 0 HA CYS A 223 4.787 6.727 -3.888 1.00 0.18 H new ATOM 0 HB2 CYS A 223 2.951 8.133 -2.885 1.00 0.21 H new ATOM 0 HB3 CYS A 223 3.922 9.558 -3.202 1.00 0.21 H new ATOM 0 HG CYS A 223 3.965 8.530 -6.097 1.00 0.71 H new ATOM 967 N SER A 224 7.002 9.047 -3.509 1.00 0.17 N ATOM 968 CA SER A 224 8.164 9.701 -4.099 1.00 0.21 C ATOM 969 C SER A 224 9.187 8.705 -4.643 1.00 0.17 C ATOM 970 O SER A 224 9.963 9.045 -5.538 1.00 0.19 O ATOM 971 CB SER A 224 8.832 10.591 -3.043 1.00 0.30 C ATOM 972 OG SER A 224 9.951 11.292 -3.562 1.00 1.10 O ATOM 0 H SER A 224 6.928 9.170 -2.499 1.00 0.17 H new ATOM 0 HA SER A 224 7.812 10.296 -4.942 1.00 0.21 H new ATOM 0 HB2 SER A 224 8.104 11.306 -2.660 1.00 0.30 H new ATOM 0 HB3 SER A 224 9.149 9.976 -2.201 1.00 0.30 H new ATOM 0 HG SER A 224 10.345 11.847 -2.857 1.00 1.10 H new ATOM 978 N LEU A 225 9.200 7.478 -4.139 1.00 0.17 N ATOM 979 CA LEU A 225 10.233 6.547 -4.551 1.00 0.18 C ATOM 980 C LEU A 225 9.728 5.621 -5.656 1.00 0.19 C ATOM 981 O LEU A 225 8.595 5.136 -5.612 1.00 0.19 O ATOM 982 CB LEU A 225 10.766 5.762 -3.342 1.00 0.19 C ATOM 983 CG LEU A 225 9.723 5.063 -2.464 1.00 0.16 C ATOM 984 CD1 LEU A 225 9.441 3.654 -2.961 1.00 0.39 C ATOM 985 CD2 LEU A 225 10.184 5.032 -1.015 1.00 0.27 C ATOM 0 H LEU A 225 8.527 7.115 -3.464 1.00 0.17 H new ATOM 0 HA LEU A 225 11.065 7.115 -4.966 1.00 0.18 H new ATOM 0 HB2 LEU A 225 11.465 5.009 -3.706 1.00 0.19 H new ATOM 0 HB3 LEU A 225 11.335 6.448 -2.714 1.00 0.19 H new ATOM 0 HG LEU A 225 8.796 5.633 -2.525 1.00 0.16 H new ATOM 0 HD11 LEU A 225 8.697 3.183 -2.318 1.00 0.39 H new ATOM 0 HD12 LEU A 225 9.063 3.697 -3.982 1.00 0.39 H new ATOM 0 HD13 LEU A 225 10.361 3.070 -2.940 1.00 0.39 H new ATOM 0 HD21 LEU A 225 9.432 4.532 -0.405 1.00 0.27 H new ATOM 0 HD22 LEU A 225 11.127 4.490 -0.945 1.00 0.27 H new ATOM 0 HD23 LEU A 225 10.324 6.052 -0.656 1.00 0.27 H new ATOM 997 N ASN A 226 10.569 5.397 -6.653 1.00 0.22 N ATOM 998 CA ASN A 226 10.239 4.492 -7.749 1.00 0.25 C ATOM 999 C ASN A 226 10.441 3.051 -7.309 1.00 0.21 C ATOM 1000 O ASN A 226 11.091 2.801 -6.292 1.00 0.23 O ATOM 1001 CB ASN A 226 11.103 4.773 -8.984 1.00 0.40 C ATOM 1002 CG ASN A 226 12.580 4.503 -8.758 1.00 1.04 C ATOM 1003 OD1 ASN A 226 13.105 4.705 -7.662 1.00 2.01 O ATOM 1004 ND2 ASN A 226 13.258 4.028 -9.788 1.00 1.31 N ATOM 0 H ASN A 226 11.489 5.830 -6.728 1.00 0.22 H new ATOM 0 HA ASN A 226 9.195 4.655 -8.015 1.00 0.25 H new ATOM 0 HB2 ASN A 226 10.751 4.158 -9.812 1.00 0.40 H new ATOM 0 HB3 ASN A 226 10.972 5.814 -9.281 1.00 0.40 H new ATOM 0 HD21 ASN A 226 14.251 3.816 -9.691 1.00 1.31 H new ATOM 0 HD22 ASN A 226 12.788 3.874 -10.680 1.00 1.31 H new ATOM 1011 N GLN A 227 9.842 2.109 -8.054 1.00 0.20 N ATOM 1012 CA GLN A 227 9.805 0.694 -7.677 1.00 0.19 C ATOM 1013 C GLN A 227 11.137 0.178 -7.135 1.00 0.18 C ATOM 1014 O GLN A 227 11.173 -0.624 -6.208 1.00 0.19 O ATOM 1015 CB GLN A 227 9.365 -0.168 -8.860 1.00 0.22 C ATOM 1016 CG GLN A 227 8.608 -1.419 -8.430 1.00 0.29 C ATOM 1017 CD GLN A 227 7.278 -1.100 -7.763 1.00 0.52 C ATOM 1018 OE1 GLN A 227 7.114 -0.048 -7.146 1.00 1.30 O ATOM 1019 NE2 GLN A 227 6.317 -2.005 -7.875 1.00 1.13 N ATOM 0 H GLN A 227 9.370 2.311 -8.935 1.00 0.20 H new ATOM 0 HA GLN A 227 9.077 0.617 -6.869 1.00 0.19 H new ATOM 0 HB2 GLN A 227 8.732 0.425 -9.520 1.00 0.22 H new ATOM 0 HB3 GLN A 227 10.242 -0.460 -9.437 1.00 0.22 H new ATOM 0 HG2 GLN A 227 8.431 -2.049 -9.302 1.00 0.29 H new ATOM 0 HG3 GLN A 227 9.227 -1.994 -7.741 1.00 0.29 H new ATOM 0 HE21 GLN A 227 6.486 -2.867 -8.394 1.00 1.13 H new ATOM 0 HE22 GLN A 227 5.408 -1.840 -7.443 1.00 1.13 H new ATOM 1028 N GLU A 228 12.233 0.687 -7.696 1.00 0.20 N ATOM 1029 CA GLU A 228 13.577 0.235 -7.355 1.00 0.23 C ATOM 1030 C GLU A 228 13.941 0.661 -5.941 1.00 0.18 C ATOM 1031 O GLU A 228 14.402 -0.157 -5.149 1.00 0.19 O ATOM 1032 CB GLU A 228 14.589 0.822 -8.340 1.00 0.34 C ATOM 1033 CG GLU A 228 15.988 0.243 -8.194 1.00 1.14 C ATOM 1034 CD GLU A 228 16.993 0.917 -9.104 1.00 1.66 C ATOM 1035 OE1 GLU A 228 17.113 0.505 -10.276 1.00 1.83 O ATOM 1036 OE2 GLU A 228 17.666 1.869 -8.650 1.00 2.29 O ATOM 0 H GLU A 228 12.212 1.425 -8.400 1.00 0.20 H new ATOM 0 HA GLU A 228 13.600 -0.853 -7.413 1.00 0.23 H new ATOM 0 HB2 GLU A 228 14.237 0.647 -9.357 1.00 0.34 H new ATOM 0 HB3 GLU A 228 14.635 1.902 -8.200 1.00 0.34 H new ATOM 0 HG2 GLU A 228 16.314 0.346 -7.159 1.00 1.14 H new ATOM 0 HG3 GLU A 228 15.961 -0.824 -8.415 1.00 1.14 H new ATOM 1043 N ASP A 229 13.722 1.930 -5.628 1.00 0.18 N ATOM 1044 CA ASP A 229 14.000 2.419 -4.277 1.00 0.20 C ATOM 1045 C ASP A 229 13.207 1.625 -3.243 1.00 0.19 C ATOM 1046 O ASP A 229 13.671 1.408 -2.127 1.00 0.22 O ATOM 1047 CB ASP A 229 13.710 3.918 -4.160 1.00 0.25 C ATOM 1048 CG ASP A 229 14.247 4.521 -2.873 1.00 0.37 C ATOM 1049 OD1 ASP A 229 15.418 4.267 -2.528 1.00 0.71 O ATOM 1050 OD2 ASP A 229 13.486 5.221 -2.178 1.00 0.54 O ATOM 0 H ASP A 229 13.360 2.631 -6.274 1.00 0.18 H new ATOM 0 HA ASP A 229 15.061 2.272 -4.077 1.00 0.20 H new ATOM 0 HB2 ASP A 229 14.151 4.437 -5.011 1.00 0.25 H new ATOM 0 HB3 ASP A 229 12.633 4.081 -4.211 1.00 0.25 H new ATOM 1055 N PHE A 230 12.025 1.160 -3.624 1.00 0.17 N ATOM 1056 CA PHE A 230 11.266 0.262 -2.764 1.00 0.17 C ATOM 1057 C PHE A 230 11.891 -1.122 -2.774 1.00 0.18 C ATOM 1058 O PHE A 230 12.119 -1.706 -1.727 1.00 0.21 O ATOM 1059 CB PHE A 230 9.812 0.147 -3.208 1.00 0.17 C ATOM 1060 CG PHE A 230 9.030 -0.906 -2.459 1.00 0.17 C ATOM 1061 CD1 PHE A 230 8.489 -0.631 -1.211 1.00 0.19 C ATOM 1062 CD2 PHE A 230 8.859 -2.180 -2.985 1.00 0.19 C ATOM 1063 CE1 PHE A 230 7.804 -1.601 -0.504 1.00 0.23 C ATOM 1064 CE2 PHE A 230 8.167 -3.149 -2.281 1.00 0.21 C ATOM 1065 CZ PHE A 230 7.534 -2.836 -1.120 1.00 0.22 C ATOM 0 H PHE A 230 11.575 1.386 -4.511 1.00 0.17 H new ATOM 0 HA PHE A 230 11.290 0.681 -1.758 1.00 0.17 H new ATOM 0 HB2 PHE A 230 9.324 1.112 -3.076 1.00 0.17 H new ATOM 0 HB3 PHE A 230 9.784 -0.081 -4.273 1.00 0.17 H new ATOM 0 HD1 PHE A 230 8.605 0.355 -0.786 1.00 0.19 H new ATOM 0 HD2 PHE A 230 9.271 -2.417 -3.955 1.00 0.19 H new ATOM 0 HE1 PHE A 230 7.480 -1.413 0.509 1.00 0.23 H new ATOM 0 HE2 PHE A 230 8.130 -4.161 -2.657 1.00 0.21 H new ATOM 0 HZ PHE A 230 6.833 -3.527 -0.676 1.00 0.22 H new ATOM 1075 N PHE A 231 12.187 -1.631 -3.965 1.00 0.17 N ATOM 1076 CA PHE A 231 12.611 -3.014 -4.133 1.00 0.20 C ATOM 1077 C PHE A 231 13.962 -3.271 -3.485 1.00 0.25 C ATOM 1078 O PHE A 231 14.281 -4.399 -3.143 1.00 0.41 O ATOM 1079 CB PHE A 231 12.655 -3.390 -5.617 1.00 0.21 C ATOM 1080 CG PHE A 231 11.391 -4.029 -6.126 1.00 0.20 C ATOM 1081 CD1 PHE A 231 10.154 -3.523 -5.767 1.00 0.33 C ATOM 1082 CD2 PHE A 231 11.441 -5.129 -6.966 1.00 0.44 C ATOM 1083 CE1 PHE A 231 8.990 -4.102 -6.237 1.00 0.36 C ATOM 1084 CE2 PHE A 231 10.282 -5.712 -7.438 1.00 0.45 C ATOM 1085 CZ PHE A 231 9.062 -5.222 -7.059 1.00 0.27 C ATOM 0 H PHE A 231 12.140 -1.100 -4.835 1.00 0.17 H new ATOM 0 HA PHE A 231 11.875 -3.643 -3.631 1.00 0.20 H new ATOM 0 HB2 PHE A 231 12.857 -2.493 -6.202 1.00 0.21 H new ATOM 0 HB3 PHE A 231 13.488 -4.074 -5.783 1.00 0.21 H new ATOM 0 HD1 PHE A 231 10.097 -2.666 -5.112 1.00 0.33 H new ATOM 0 HD2 PHE A 231 12.399 -5.536 -7.255 1.00 0.44 H new ATOM 0 HE1 PHE A 231 8.030 -3.687 -5.968 1.00 0.36 H new ATOM 0 HE2 PHE A 231 10.338 -6.557 -8.108 1.00 0.45 H new ATOM 0 HZ PHE A 231 8.157 -5.704 -7.397 1.00 0.27 H new ATOM 1095 N GLN A 232 14.768 -2.239 -3.317 1.00 0.20 N ATOM 1096 CA GLN A 232 16.036 -2.422 -2.629 1.00 0.23 C ATOM 1097 C GLN A 232 15.771 -2.515 -1.135 1.00 0.25 C ATOM 1098 O GLN A 232 16.299 -3.391 -0.445 1.00 0.28 O ATOM 1099 CB GLN A 232 17.017 -1.288 -2.942 1.00 0.24 C ATOM 1100 CG GLN A 232 17.212 -1.039 -4.432 1.00 0.28 C ATOM 1101 CD GLN A 232 17.519 -2.309 -5.202 1.00 0.33 C ATOM 1102 OE1 GLN A 232 18.678 -2.686 -5.371 1.00 0.37 O ATOM 1103 NE2 GLN A 232 16.476 -2.977 -5.679 1.00 0.36 N ATOM 0 H GLN A 232 14.577 -1.289 -3.637 1.00 0.20 H new ATOM 0 HA GLN A 232 16.501 -3.344 -2.979 1.00 0.23 H new ATOM 0 HB2 GLN A 232 16.660 -0.371 -2.473 1.00 0.24 H new ATOM 0 HB3 GLN A 232 17.982 -1.520 -2.492 1.00 0.24 H new ATOM 0 HG2 GLN A 232 16.312 -0.580 -4.840 1.00 0.28 H new ATOM 0 HG3 GLN A 232 18.025 -0.327 -4.574 1.00 0.28 H new ATOM 0 HE21 GLN A 232 15.531 -2.630 -5.517 1.00 0.36 H new ATOM 0 HE22 GLN A 232 16.620 -3.837 -6.208 1.00 0.36 H new ATOM 1112 N ARG A 233 14.930 -1.607 -0.652 1.00 0.24 N ATOM 1113 CA ARG A 233 14.472 -1.610 0.729 1.00 0.27 C ATOM 1114 C ARG A 233 13.712 -2.900 1.052 1.00 0.29 C ATOM 1115 O ARG A 233 13.770 -3.405 2.168 1.00 0.33 O ATOM 1116 CB ARG A 233 13.531 -0.421 0.937 1.00 0.27 C ATOM 1117 CG ARG A 233 14.219 0.927 0.802 1.00 0.27 C ATOM 1118 CD ARG A 233 13.263 2.073 1.085 1.00 0.40 C ATOM 1119 NE ARG A 233 13.897 3.376 0.893 1.00 0.69 N ATOM 1120 CZ ARG A 233 13.424 4.518 1.391 1.00 0.67 C ATOM 1121 NH1 ARG A 233 12.350 4.514 2.173 1.00 0.93 N ATOM 1122 NH2 ARG A 233 14.032 5.663 1.122 1.00 1.39 N ATOM 0 H ARG A 233 14.546 -0.845 -1.212 1.00 0.24 H new ATOM 0 HA ARG A 233 15.340 -1.541 1.385 1.00 0.27 H new ATOM 0 HB2 ARG A 233 12.719 -0.480 0.213 1.00 0.27 H new ATOM 0 HB3 ARG A 233 13.081 -0.493 1.927 1.00 0.27 H new ATOM 0 HG2 ARG A 233 15.062 0.977 1.491 1.00 0.27 H new ATOM 0 HG3 ARG A 233 14.624 1.030 -0.205 1.00 0.27 H new ATOM 0 HD2 ARG A 233 12.396 1.992 0.430 1.00 0.40 H new ATOM 0 HD3 ARG A 233 12.897 1.995 2.109 1.00 0.40 H new ATOM 0 HE ARG A 233 14.755 3.414 0.343 1.00 0.69 H new ATOM 0 HH11 ARG A 233 11.884 3.634 2.395 1.00 0.93 H new ATOM 0 HH12 ARG A 233 11.992 5.391 2.552 1.00 0.93 H new ATOM 0 HH21 ARG A 233 14.864 5.672 0.532 1.00 1.39 H new ATOM 0 HH22 ARG A 233 13.668 6.536 1.504 1.00 1.39 H new ATOM 1136 N VAL A 234 13.021 -3.429 0.033 1.00 0.27 N ATOM 1137 CA VAL A 234 12.067 -4.535 0.152 1.00 0.27 C ATOM 1138 C VAL A 234 11.567 -4.912 -1.256 1.00 0.25 C ATOM 1139 O VAL A 234 10.718 -4.240 -1.828 1.00 0.24 O ATOM 1140 CB VAL A 234 10.863 -4.170 1.080 1.00 0.27 C ATOM 1141 CG1 VAL A 234 10.508 -2.692 0.976 1.00 0.28 C ATOM 1142 CG2 VAL A 234 9.629 -5.012 0.774 1.00 0.26 C ATOM 0 H VAL A 234 13.115 -3.088 -0.924 1.00 0.27 H new ATOM 0 HA VAL A 234 12.574 -5.384 0.610 1.00 0.27 H new ATOM 0 HB VAL A 234 11.184 -4.388 2.099 1.00 0.27 H new ATOM 0 HG11 VAL A 234 9.667 -2.473 1.634 1.00 0.28 H new ATOM 0 HG12 VAL A 234 11.367 -2.090 1.272 1.00 0.28 H new ATOM 0 HG13 VAL A 234 10.236 -2.455 -0.052 1.00 0.28 H new ATOM 0 HG21 VAL A 234 8.817 -4.724 1.442 1.00 0.26 H new ATOM 0 HG22 VAL A 234 9.323 -4.848 -0.259 1.00 0.26 H new ATOM 0 HG23 VAL A 234 9.863 -6.067 0.920 1.00 0.26 H new ATOM 1152 N PRO A 235 12.115 -5.976 -1.849 1.00 0.27 N ATOM 1153 CA PRO A 235 11.842 -6.344 -3.242 1.00 0.27 C ATOM 1154 C PRO A 235 10.573 -7.162 -3.437 1.00 0.30 C ATOM 1155 O PRO A 235 10.020 -7.197 -4.533 1.00 0.32 O ATOM 1156 CB PRO A 235 13.065 -7.182 -3.643 1.00 0.30 C ATOM 1157 CG PRO A 235 13.907 -7.329 -2.409 1.00 0.34 C ATOM 1158 CD PRO A 235 13.065 -6.900 -1.240 1.00 0.33 C ATOM 0 HA PRO A 235 11.682 -5.450 -3.845 1.00 0.27 H new ATOM 0 HB2 PRO A 235 12.759 -8.157 -4.022 1.00 0.30 H new ATOM 0 HB3 PRO A 235 13.626 -6.692 -4.439 1.00 0.30 H new ATOM 0 HG2 PRO A 235 14.235 -8.361 -2.288 1.00 0.34 H new ATOM 0 HG3 PRO A 235 14.805 -6.716 -2.481 1.00 0.34 H new ATOM 0 HD2 PRO A 235 12.563 -7.746 -0.771 1.00 0.33 H new ATOM 0 HD3 PRO A 235 13.662 -6.416 -0.467 1.00 0.33 H new ATOM 1166 N ARG A 236 10.092 -7.803 -2.392 1.00 0.31 N ATOM 1167 CA ARG A 236 8.946 -8.691 -2.533 1.00 0.31 C ATOM 1168 C ARG A 236 7.616 -7.968 -2.299 1.00 0.28 C ATOM 1169 O ARG A 236 6.677 -8.557 -1.769 1.00 0.32 O ATOM 1170 CB ARG A 236 9.065 -9.915 -1.604 1.00 0.39 C ATOM 1171 CG ARG A 236 8.992 -9.625 -0.106 1.00 0.67 C ATOM 1172 CD ARG A 236 10.210 -8.871 0.406 1.00 1.04 C ATOM 1173 NE ARG A 236 10.344 -8.990 1.858 1.00 1.78 N ATOM 1174 CZ ARG A 236 11.376 -8.523 2.562 1.00 2.75 C ATOM 1175 NH1 ARG A 236 12.408 -7.958 1.946 1.00 3.36 N ATOM 1176 NH2 ARG A 236 11.388 -8.654 3.879 1.00 3.49 N ATOM 0 H ARG A 236 10.467 -7.731 -1.446 1.00 0.31 H new ATOM 0 HA ARG A 236 8.951 -9.039 -3.566 1.00 0.31 H new ATOM 0 HB2 ARG A 236 8.271 -10.618 -1.857 1.00 0.39 H new ATOM 0 HB3 ARG A 236 10.011 -10.414 -1.812 1.00 0.39 H new ATOM 0 HG2 ARG A 236 8.095 -9.043 0.104 1.00 0.67 H new ATOM 0 HG3 ARG A 236 8.897 -10.565 0.438 1.00 0.67 H new ATOM 0 HD2 ARG A 236 11.108 -9.258 -0.076 1.00 1.04 H new ATOM 0 HD3 ARG A 236 10.129 -7.819 0.132 1.00 1.04 H new ATOM 0 HE ARG A 236 9.597 -9.463 2.367 1.00 1.78 H new ATOM 0 HH11 ARG A 236 12.414 -7.879 0.929 1.00 3.36 H new ATOM 0 HH12 ARG A 236 13.194 -7.603 2.490 1.00 3.36 H new ATOM 0 HH21 ARG A 236 10.609 -9.111 4.353 1.00 3.49 H new ATOM 0 HH22 ARG A 236 12.176 -8.298 4.420 1.00 3.49 H new ATOM 1190 N GLY A 237 7.521 -6.697 -2.692 1.00 0.23 N ATOM 1191 CA GLY A 237 6.255 -5.995 -2.568 1.00 0.20 C ATOM 1192 C GLY A 237 5.659 -5.549 -3.897 1.00 0.15 C ATOM 1193 O GLY A 237 4.906 -4.583 -3.935 1.00 0.15 O ATOM 0 H GLY A 237 8.286 -6.150 -3.088 1.00 0.23 H new ATOM 0 HA2 GLY A 237 5.540 -6.643 -2.061 1.00 0.20 H new ATOM 0 HA3 GLY A 237 6.397 -5.120 -1.934 1.00 0.20 H new ATOM 1197 N GLU A 238 5.975 -6.256 -4.984 1.00 0.16 N ATOM 1198 CA GLU A 238 5.387 -5.977 -6.304 1.00 0.15 C ATOM 1199 C GLU A 238 3.858 -6.002 -6.258 1.00 0.13 C ATOM 1200 O GLU A 238 3.180 -5.148 -6.834 1.00 0.13 O ATOM 1201 CB GLU A 238 5.884 -7.011 -7.316 1.00 0.19 C ATOM 1202 CG GLU A 238 5.397 -6.770 -8.737 1.00 1.06 C ATOM 1203 CD GLU A 238 5.896 -5.463 -9.323 1.00 1.37 C ATOM 1204 OE1 GLU A 238 5.205 -4.432 -9.176 1.00 1.55 O ATOM 1205 OE2 GLU A 238 6.971 -5.467 -9.958 1.00 1.74 O ATOM 0 H GLU A 238 6.638 -7.031 -4.980 1.00 0.16 H new ATOM 0 HA GLU A 238 5.699 -4.977 -6.605 1.00 0.15 H new ATOM 0 HB2 GLU A 238 6.974 -7.013 -7.312 1.00 0.19 H new ATOM 0 HB3 GLU A 238 5.562 -8.002 -6.996 1.00 0.19 H new ATOM 0 HG2 GLU A 238 5.724 -7.594 -9.371 1.00 1.06 H new ATOM 0 HG3 GLU A 238 4.307 -6.773 -8.747 1.00 1.06 H new ATOM 1212 N ILE A 239 3.336 -6.984 -5.552 1.00 0.12 N ATOM 1213 CA ILE A 239 1.895 -7.177 -5.454 1.00 0.12 C ATOM 1214 C ILE A 239 1.254 -6.002 -4.690 1.00 0.12 C ATOM 1215 O ILE A 239 0.111 -5.619 -4.955 1.00 0.12 O ATOM 1216 CB ILE A 239 1.580 -8.544 -4.791 1.00 0.13 C ATOM 1217 CG1 ILE A 239 0.393 -9.228 -5.474 1.00 0.18 C ATOM 1218 CG2 ILE A 239 1.308 -8.384 -3.309 1.00 0.25 C ATOM 1219 CD1 ILE A 239 -0.928 -8.541 -5.235 1.00 0.26 C ATOM 0 H ILE A 239 3.888 -7.667 -5.033 1.00 0.12 H new ATOM 0 HA ILE A 239 1.463 -7.193 -6.454 1.00 0.12 H new ATOM 0 HB ILE A 239 2.460 -9.176 -4.913 1.00 0.13 H new ATOM 0 HG12 ILE A 239 0.580 -9.272 -6.547 1.00 0.18 H new ATOM 0 HG13 ILE A 239 0.326 -10.257 -5.120 1.00 0.18 H new ATOM 0 HG21 ILE A 239 1.090 -9.358 -2.872 1.00 0.25 H new ATOM 0 HG22 ILE A 239 2.184 -7.955 -2.822 1.00 0.25 H new ATOM 0 HG23 ILE A 239 0.453 -7.723 -3.165 1.00 0.25 H new ATOM 0 HD11 ILE A 239 -1.719 -9.085 -5.751 1.00 0.26 H new ATOM 0 HD12 ILE A 239 -1.139 -8.520 -4.166 1.00 0.26 H new ATOM 0 HD13 ILE A 239 -0.881 -7.521 -5.615 1.00 0.26 H new ATOM 1231 N LEU A 240 2.027 -5.410 -3.781 1.00 0.13 N ATOM 1232 CA LEU A 240 1.586 -4.240 -3.020 1.00 0.14 C ATOM 1233 C LEU A 240 1.252 -3.089 -3.958 1.00 0.14 C ATOM 1234 O LEU A 240 0.132 -2.586 -3.979 1.00 0.14 O ATOM 1235 CB LEU A 240 2.681 -3.791 -2.047 1.00 0.18 C ATOM 1236 CG LEU A 240 2.605 -4.373 -0.643 1.00 0.24 C ATOM 1237 CD1 LEU A 240 3.759 -3.858 0.185 1.00 0.45 C ATOM 1238 CD2 LEU A 240 1.291 -4.006 0.021 1.00 0.25 C ATOM 0 H LEU A 240 2.970 -5.724 -3.552 1.00 0.13 H new ATOM 0 HA LEU A 240 0.694 -4.520 -2.459 1.00 0.14 H new ATOM 0 HB2 LEU A 240 3.649 -4.052 -2.475 1.00 0.18 H new ATOM 0 HB3 LEU A 240 2.648 -2.704 -1.971 1.00 0.18 H new ATOM 0 HG LEU A 240 2.664 -5.459 -0.714 1.00 0.24 H new ATOM 0 HD11 LEU A 240 3.701 -4.277 1.190 1.00 0.45 H new ATOM 0 HD12 LEU A 240 4.700 -4.154 -0.278 1.00 0.45 H new ATOM 0 HD13 LEU A 240 3.709 -2.771 0.242 1.00 0.45 H new ATOM 0 HD21 LEU A 240 1.258 -4.432 1.024 1.00 0.25 H new ATOM 0 HD22 LEU A 240 1.206 -2.921 0.085 1.00 0.25 H new ATOM 0 HD23 LEU A 240 0.463 -4.400 -0.568 1.00 0.25 H new ATOM 1250 N TRP A 241 2.243 -2.704 -4.737 1.00 0.14 N ATOM 1251 CA TRP A 241 2.139 -1.592 -5.671 1.00 0.15 C ATOM 1252 C TRP A 241 0.998 -1.749 -6.658 1.00 0.15 C ATOM 1253 O TRP A 241 0.370 -0.778 -7.070 1.00 0.16 O ATOM 1254 CB TRP A 241 3.461 -1.486 -6.397 1.00 0.17 C ATOM 1255 CG TRP A 241 4.504 -1.062 -5.423 1.00 0.16 C ATOM 1256 CD1 TRP A 241 5.380 -1.867 -4.766 1.00 0.17 C ATOM 1257 CD2 TRP A 241 4.734 0.266 -4.936 1.00 0.16 C ATOM 1258 NE1 TRP A 241 6.137 -1.128 -3.902 1.00 0.17 N ATOM 1259 CE2 TRP A 241 5.773 0.183 -3.995 1.00 0.17 C ATOM 1260 CE3 TRP A 241 4.173 1.518 -5.211 1.00 0.18 C ATOM 1261 CZ2 TRP A 241 6.260 1.294 -3.322 1.00 0.18 C ATOM 1262 CZ3 TRP A 241 4.663 2.625 -4.545 1.00 0.19 C ATOM 1263 CH2 TRP A 241 5.699 2.507 -3.611 1.00 0.19 C ATOM 0 H TRP A 241 3.156 -3.158 -4.742 1.00 0.14 H new ATOM 0 HA TRP A 241 1.918 -0.682 -5.113 1.00 0.15 H new ATOM 0 HB2 TRP A 241 3.726 -2.445 -6.842 1.00 0.17 H new ATOM 0 HB3 TRP A 241 3.389 -0.766 -7.212 1.00 0.17 H new ATOM 0 HD1 TRP A 241 5.465 -2.934 -4.906 1.00 0.17 H new ATOM 0 HE1 TRP A 241 6.860 -1.498 -3.285 1.00 0.17 H new ATOM 0 HE3 TRP A 241 3.373 1.617 -5.930 1.00 0.18 H new ATOM 0 HZ2 TRP A 241 7.054 1.204 -2.596 1.00 0.18 H new ATOM 0 HZ3 TRP A 241 4.240 3.598 -4.748 1.00 0.19 H new ATOM 0 HH2 TRP A 241 6.062 3.391 -3.109 1.00 0.19 H new ATOM 1274 N SER A 242 0.755 -2.996 -7.031 1.00 0.15 N ATOM 1275 CA SER A 242 -0.314 -3.336 -7.953 1.00 0.15 C ATOM 1276 C SER A 242 -1.653 -2.898 -7.377 1.00 0.14 C ATOM 1277 O SER A 242 -2.453 -2.243 -8.047 1.00 0.14 O ATOM 1278 CB SER A 242 -0.311 -4.844 -8.195 1.00 0.16 C ATOM 1279 OG SER A 242 -1.280 -5.222 -9.160 1.00 0.24 O ATOM 0 H SER A 242 1.293 -3.798 -6.703 1.00 0.15 H new ATOM 0 HA SER A 242 -0.157 -2.820 -8.900 1.00 0.15 H new ATOM 0 HB2 SER A 242 0.678 -5.157 -8.530 1.00 0.16 H new ATOM 0 HB3 SER A 242 -0.509 -5.364 -7.257 1.00 0.16 H new ATOM 0 HG SER A 242 -1.250 -6.193 -9.291 1.00 0.24 H new ATOM 1285 N HIS A 243 -1.872 -3.249 -6.118 1.00 0.13 N ATOM 1286 CA HIS A 243 -3.069 -2.839 -5.405 1.00 0.13 C ATOM 1287 C HIS A 243 -3.049 -1.327 -5.195 1.00 0.13 C ATOM 1288 O HIS A 243 -4.082 -0.665 -5.223 1.00 0.13 O ATOM 1289 CB HIS A 243 -3.150 -3.573 -4.059 1.00 0.15 C ATOM 1290 CG HIS A 243 -4.254 -3.094 -3.165 1.00 0.15 C ATOM 1291 ND1 HIS A 243 -4.081 -3.021 -1.808 1.00 0.17 N ATOM 1292 CD2 HIS A 243 -5.509 -2.676 -3.472 1.00 0.15 C ATOM 1293 CE1 HIS A 243 -5.216 -2.568 -1.321 1.00 0.17 C ATOM 1294 NE2 HIS A 243 -6.115 -2.342 -2.289 1.00 0.17 N ATOM 0 H HIS A 243 -1.231 -3.820 -5.568 1.00 0.13 H new ATOM 0 HA HIS A 243 -3.950 -3.097 -5.993 1.00 0.13 H new ATOM 0 HB2 HIS A 243 -3.285 -4.638 -4.246 1.00 0.15 H new ATOM 0 HB3 HIS A 243 -2.200 -3.459 -3.538 1.00 0.15 H new ATOM 0 HD1 HIS A 243 -3.243 -3.268 -1.282 1.00 0.17 H new ATOM 0 HD2 HIS A 243 -5.945 -2.618 -4.458 1.00 0.15 H new ATOM 0 HE1 HIS A 243 -5.401 -2.399 -0.270 1.00 0.17 H new ATOM 1302 N LEU A 244 -1.852 -0.798 -5.019 1.00 0.13 N ATOM 1303 CA LEU A 244 -1.682 0.617 -4.732 1.00 0.12 C ATOM 1304 C LEU A 244 -2.051 1.475 -5.939 1.00 0.13 C ATOM 1305 O LEU A 244 -2.722 2.499 -5.798 1.00 0.12 O ATOM 1306 CB LEU A 244 -0.261 0.918 -4.255 1.00 0.13 C ATOM 1307 CG LEU A 244 0.027 2.396 -4.029 1.00 0.15 C ATOM 1308 CD1 LEU A 244 -1.084 3.015 -3.202 1.00 0.17 C ATOM 1309 CD2 LEU A 244 1.370 2.584 -3.346 1.00 0.17 C ATOM 0 H LEU A 244 -0.981 -1.327 -5.070 1.00 0.13 H new ATOM 0 HA LEU A 244 -2.365 0.873 -3.922 1.00 0.12 H new ATOM 0 HB2 LEU A 244 -0.081 0.379 -3.325 1.00 0.13 H new ATOM 0 HB3 LEU A 244 0.445 0.531 -4.989 1.00 0.13 H new ATOM 0 HG LEU A 244 0.069 2.897 -4.996 1.00 0.15 H new ATOM 0 HD11 LEU A 244 -0.873 4.073 -3.043 1.00 0.17 H new ATOM 0 HD12 LEU A 244 -2.032 2.909 -3.729 1.00 0.17 H new ATOM 0 HD13 LEU A 244 -1.146 2.509 -2.239 1.00 0.17 H new ATOM 0 HD21 LEU A 244 1.555 3.647 -3.194 1.00 0.17 H new ATOM 0 HD22 LEU A 244 1.362 2.076 -2.382 1.00 0.17 H new ATOM 0 HD23 LEU A 244 2.158 2.164 -3.971 1.00 0.17 H new ATOM 1321 N GLU A 245 -1.613 1.074 -7.119 1.00 0.15 N ATOM 1322 CA GLU A 245 -2.057 1.734 -8.333 1.00 0.18 C ATOM 1323 C GLU A 245 -3.577 1.680 -8.438 1.00 0.17 C ATOM 1324 O GLU A 245 -4.219 2.678 -8.738 1.00 0.21 O ATOM 1325 CB GLU A 245 -1.400 1.112 -9.560 1.00 0.25 C ATOM 1326 CG GLU A 245 0.108 1.293 -9.575 1.00 0.34 C ATOM 1327 CD GLU A 245 0.734 0.872 -10.884 1.00 0.59 C ATOM 1328 OE1 GLU A 245 0.692 1.656 -11.850 1.00 0.83 O ATOM 1329 OE2 GLU A 245 1.264 -0.259 -10.954 1.00 0.76 O ATOM 0 H GLU A 245 -0.959 0.305 -7.262 1.00 0.15 H new ATOM 0 HA GLU A 245 -1.754 2.780 -8.290 1.00 0.18 H new ATOM 0 HB2 GLU A 245 -1.634 0.048 -9.592 1.00 0.25 H new ATOM 0 HB3 GLU A 245 -1.824 1.559 -10.459 1.00 0.25 H new ATOM 0 HG2 GLU A 245 0.346 2.339 -9.383 1.00 0.34 H new ATOM 0 HG3 GLU A 245 0.547 0.712 -8.764 1.00 0.34 H new ATOM 1336 N LEU A 246 -4.137 0.523 -8.125 1.00 0.16 N ATOM 1337 CA LEU A 246 -5.585 0.329 -8.153 1.00 0.16 C ATOM 1338 C LEU A 246 -6.270 1.203 -7.097 1.00 0.16 C ATOM 1339 O LEU A 246 -7.396 1.657 -7.293 1.00 0.17 O ATOM 1340 CB LEU A 246 -5.919 -1.152 -7.941 1.00 0.17 C ATOM 1341 CG LEU A 246 -7.374 -1.551 -8.177 1.00 0.21 C ATOM 1342 CD1 LEU A 246 -7.706 -1.493 -9.657 1.00 0.30 C ATOM 1343 CD2 LEU A 246 -7.634 -2.947 -7.627 1.00 0.22 C ATOM 0 H LEU A 246 -3.610 -0.304 -7.846 1.00 0.16 H new ATOM 0 HA LEU A 246 -5.961 0.633 -9.130 1.00 0.16 H new ATOM 0 HB2 LEU A 246 -5.289 -1.745 -8.604 1.00 0.17 H new ATOM 0 HB3 LEU A 246 -5.650 -1.422 -6.920 1.00 0.17 H new ATOM 0 HG LEU A 246 -8.018 -0.845 -7.652 1.00 0.21 H new ATOM 0 HD11 LEU A 246 -8.747 -1.780 -9.808 1.00 0.30 H new ATOM 0 HD12 LEU A 246 -7.553 -0.478 -10.025 1.00 0.30 H new ATOM 0 HD13 LEU A 246 -7.058 -2.179 -10.202 1.00 0.30 H new ATOM 0 HD21 LEU A 246 -8.675 -3.219 -7.802 1.00 0.22 H new ATOM 0 HD22 LEU A 246 -6.983 -3.663 -8.129 1.00 0.22 H new ATOM 0 HD23 LEU A 246 -7.431 -2.960 -6.556 1.00 0.22 H new ATOM 1355 N LEU A 247 -5.586 1.444 -5.993 1.00 0.17 N ATOM 1356 CA LEU A 247 -6.042 2.409 -4.996 1.00 0.16 C ATOM 1357 C LEU A 247 -6.157 3.816 -5.592 1.00 0.17 C ATOM 1358 O LEU A 247 -7.252 4.373 -5.673 1.00 0.19 O ATOM 1359 CB LEU A 247 -5.095 2.433 -3.788 1.00 0.15 C ATOM 1360 CG LEU A 247 -5.126 1.189 -2.895 1.00 0.15 C ATOM 1361 CD1 LEU A 247 -4.031 1.260 -1.844 1.00 0.15 C ATOM 1362 CD2 LEU A 247 -6.480 1.051 -2.223 1.00 0.19 C ATOM 0 H LEU A 247 -4.706 0.984 -5.759 1.00 0.17 H new ATOM 0 HA LEU A 247 -7.032 2.093 -4.666 1.00 0.16 H new ATOM 0 HB2 LEU A 247 -4.077 2.572 -4.151 1.00 0.15 H new ATOM 0 HB3 LEU A 247 -5.337 3.302 -3.177 1.00 0.15 H new ATOM 0 HG LEU A 247 -4.954 0.315 -3.523 1.00 0.15 H new ATOM 0 HD11 LEU A 247 -4.068 0.368 -1.219 1.00 0.15 H new ATOM 0 HD12 LEU A 247 -3.059 1.319 -2.334 1.00 0.15 H new ATOM 0 HD13 LEU A 247 -4.179 2.144 -1.224 1.00 0.15 H new ATOM 0 HD21 LEU A 247 -6.484 0.162 -1.592 1.00 0.19 H new ATOM 0 HD22 LEU A 247 -6.674 1.931 -1.610 1.00 0.19 H new ATOM 0 HD23 LEU A 247 -7.256 0.960 -2.983 1.00 0.19 H new ATOM 1374 N ARG A 248 -5.053 4.382 -6.041 1.00 0.18 N ATOM 1375 CA ARG A 248 -5.079 5.778 -6.480 1.00 0.22 C ATOM 1376 C ARG A 248 -5.819 5.945 -7.813 1.00 0.23 C ATOM 1377 O ARG A 248 -6.231 7.053 -8.166 1.00 0.36 O ATOM 1378 CB ARG A 248 -3.672 6.370 -6.560 1.00 0.25 C ATOM 1379 CG ARG A 248 -2.760 5.667 -7.553 1.00 0.28 C ATOM 1380 CD ARG A 248 -1.428 6.383 -7.677 1.00 0.27 C ATOM 1381 NE ARG A 248 -1.596 7.771 -8.104 1.00 1.21 N ATOM 1382 CZ ARG A 248 -0.842 8.781 -7.668 1.00 1.50 C ATOM 1383 NH1 ARG A 248 0.144 8.556 -6.808 1.00 1.09 N ATOM 1384 NH2 ARG A 248 -1.071 10.016 -8.091 1.00 2.49 N ATOM 0 H ARG A 248 -4.147 3.919 -6.114 1.00 0.18 H new ATOM 0 HA ARG A 248 -5.633 6.334 -5.724 1.00 0.22 H new ATOM 0 HB2 ARG A 248 -3.747 7.422 -6.833 1.00 0.25 H new ATOM 0 HB3 ARG A 248 -3.215 6.329 -5.571 1.00 0.25 H new ATOM 0 HG2 ARG A 248 -2.594 4.638 -7.233 1.00 0.28 H new ATOM 0 HG3 ARG A 248 -3.245 5.624 -8.528 1.00 0.28 H new ATOM 0 HD2 ARG A 248 -0.911 6.358 -6.718 1.00 0.27 H new ATOM 0 HD3 ARG A 248 -0.797 5.856 -8.393 1.00 0.27 H new ATOM 0 HE ARG A 248 -2.334 7.980 -8.776 1.00 1.21 H new ATOM 0 HH11 ARG A 248 0.327 7.608 -6.479 1.00 1.09 H new ATOM 0 HH12 ARG A 248 0.719 9.331 -6.477 1.00 1.09 H new ATOM 0 HH21 ARG A 248 -1.826 10.197 -8.752 1.00 2.49 H new ATOM 0 HH22 ARG A 248 -0.492 10.786 -7.755 1.00 2.49 H new ATOM 1398 N LYS A 249 -5.994 4.851 -8.537 1.00 0.21 N ATOM 1399 CA LYS A 249 -6.788 4.861 -9.767 1.00 0.25 C ATOM 1400 C LYS A 249 -8.284 4.889 -9.471 1.00 0.20 C ATOM 1401 O LYS A 249 -9.058 5.545 -10.169 1.00 0.25 O ATOM 1402 CB LYS A 249 -6.482 3.628 -10.621 1.00 0.33 C ATOM 1403 CG LYS A 249 -5.135 3.682 -11.331 1.00 0.44 C ATOM 1404 CD LYS A 249 -5.005 4.920 -12.204 1.00 1.04 C ATOM 1405 CE LYS A 249 -6.053 4.954 -13.307 1.00 1.12 C ATOM 1406 NZ LYS A 249 -5.914 3.813 -14.250 1.00 1.32 N ATOM 0 H LYS A 249 -5.599 3.941 -8.298 1.00 0.21 H new ATOM 0 HA LYS A 249 -6.516 5.766 -10.310 1.00 0.25 H new ATOM 0 HB2 LYS A 249 -6.510 2.743 -9.985 1.00 0.33 H new ATOM 0 HB3 LYS A 249 -7.269 3.511 -11.366 1.00 0.33 H new ATOM 0 HG2 LYS A 249 -4.334 3.673 -10.592 1.00 0.44 H new ATOM 0 HG3 LYS A 249 -5.012 2.790 -11.945 1.00 0.44 H new ATOM 0 HD2 LYS A 249 -5.102 5.812 -11.585 1.00 1.04 H new ATOM 0 HD3 LYS A 249 -4.010 4.947 -12.649 1.00 1.04 H new ATOM 0 HE2 LYS A 249 -7.048 4.936 -12.861 1.00 1.12 H new ATOM 0 HE3 LYS A 249 -5.968 5.891 -13.858 1.00 1.12 H new ATOM 0 HZ1 LYS A 249 -6.532 3.965 -15.073 1.00 1.32 H new ATOM 0 HZ2 LYS A 249 -4.926 3.743 -14.567 1.00 1.32 H new ATOM 0 HZ3 LYS A 249 -6.187 2.931 -13.771 1.00 1.32 H new