USER MOD reduce.3.24.130724 H: found=0, std=0, add=816, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 820 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: B 168 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 170 ASN : amide:sc= -1.91! X(o=-1.9!,f=-1.8) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0.549 USER MOD Single : A 65 SER OG : rot -40:sc= 0.0147 USER MOD Single : A 68 SER OG : rot 180:sc= 0.311 USER MOD Single : A 69 LYS NZ :NH3+ 169:sc= 1.43 (180deg=1.4) USER MOD Single : A 70 ASN : amide:sc= -1.57! K(o=-1.6!,f=-0.003) USER MOD Single : A 71 GLN : amide:sc= 1.91 K(o=1.9,f=-4.2!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= 0.25 K(o=0.25,f=-0.51) USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 119 GLN : amide:sc= 1.04 K(o=1,f=-0.0031) USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 TYR OH : rot 180:sc= 0 USER MOD Single : B 162 SER OG : rot 180:sc= 0 USER MOD Single : B 165 SER OG : rot 180:sc= 0 USER MOD Single : B 169 LYS NZ :NH3+ 148:sc= 1.93 (180deg=0.849) USER MOD Single : B 171 GLN : amide:sc= 0.807 K(o=0.81,f=-4.3!) USER MOD Single : B 173 MET CE :methyl -169:sc= -0.194 (180deg=-0.416) USER MOD Single : B 178 LYS NZ :NH3+ 173:sc= 1.27 (180deg=1.18) USER MOD Single : B 180 LYS NZ :NH3+ -153:sc= 1.18 (180deg=0.772) USER MOD Single : B 181 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 182 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 132 N GLU A 11 -7.232 -7.769 7.206 1.00 0.00 N ATOM 133 CA GLU A 11 -7.372 -6.863 6.059 1.00 0.00 C ATOM 134 C GLU A 11 -6.992 -7.527 4.725 1.00 0.00 C ATOM 135 O GLU A 11 -7.663 -7.318 3.717 1.00 0.00 O ATOM 136 CB GLU A 11 -6.511 -5.599 6.259 1.00 0.00 C ATOM 137 CG GLU A 11 -7.004 -4.633 7.351 1.00 0.00 C ATOM 138 CD GLU A 11 -6.931 -5.158 8.800 1.00 0.00 C ATOM 139 OE1 GLU A 11 -6.079 -6.019 9.123 1.00 0.00 O ATOM 140 OE2 GLU A 11 -7.739 -4.688 9.643 1.00 0.00 O1- ATOM 0 HA GLU A 11 -8.427 -6.594 6.008 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.494 -5.907 6.502 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.463 -5.059 5.314 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.419 -3.715 7.288 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.038 -4.367 7.133 1.00 0.00 H new ATOM 147 N LEU A 12 -5.961 -8.380 4.713 1.00 0.00 N ATOM 148 CA LEU A 12 -5.488 -9.068 3.505 1.00 0.00 C ATOM 149 C LEU A 12 -6.521 -10.076 2.951 1.00 0.00 C ATOM 150 O LEU A 12 -6.526 -10.348 1.748 1.00 0.00 O ATOM 151 CB LEU A 12 -4.138 -9.753 3.790 1.00 0.00 C ATOM 152 CG LEU A 12 -2.900 -8.839 3.954 1.00 0.00 C ATOM 153 CD1 LEU A 12 -2.630 -7.995 2.713 1.00 0.00 C ATOM 154 CD2 LEU A 12 -2.956 -7.914 5.175 1.00 0.00 C ATOM 0 H LEU A 12 -5.426 -8.615 5.549 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.352 -8.316 2.728 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.245 -10.343 4.700 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -3.936 -10.452 2.978 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.081 -9.542 4.107 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.751 -7.372 2.881 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.453 -8.649 1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.492 -7.359 2.511 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.050 -7.309 5.215 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.826 -7.261 5.098 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.032 -8.513 6.082 1.00 0.00 H new ATOM 166 N SER A 13 -7.398 -10.608 3.812 1.00 0.00 N ATOM 167 CA SER A 13 -8.552 -11.434 3.421 1.00 0.00 C ATOM 168 C SER A 13 -9.770 -10.573 3.065 1.00 0.00 C ATOM 169 O SER A 13 -10.411 -10.790 2.034 1.00 0.00 O ATOM 170 CB SER A 13 -8.885 -12.412 4.554 1.00 0.00 C ATOM 171 OG SER A 13 -9.960 -13.262 4.197 1.00 0.00 O ATOM 0 H SER A 13 -7.325 -10.475 4.821 1.00 0.00 H new ATOM 0 HA SER A 13 -8.288 -11.996 2.525 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.006 -13.012 4.790 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.142 -11.855 5.455 1.00 0.00 H new ATOM 0 HG SER A 13 -10.151 -13.876 4.936 1.00 0.00 H new ATOM 177 N GLU A 14 -10.065 -9.549 3.874 1.00 0.00 N ATOM 178 CA GLU A 14 -11.239 -8.674 3.717 1.00 0.00 C ATOM 179 C GLU A 14 -11.205 -7.848 2.417 1.00 0.00 C ATOM 180 O GLU A 14 -12.190 -7.832 1.671 1.00 0.00 O ATOM 181 CB GLU A 14 -11.350 -7.767 4.958 1.00 0.00 C ATOM 182 CG GLU A 14 -12.544 -6.797 4.956 1.00 0.00 C ATOM 183 CD GLU A 14 -13.921 -7.489 4.875 1.00 0.00 C ATOM 184 OE1 GLU A 14 -14.873 -6.874 4.332 1.00 0.00 O ATOM 185 OE2 GLU A 14 -14.084 -8.630 5.374 1.00 0.00 O1- ATOM 0 H GLU A 14 -9.484 -9.298 4.674 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.125 -9.303 3.636 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.416 -8.398 5.844 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.431 -7.187 5.048 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -12.507 -6.191 5.861 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.442 -6.115 4.112 1.00 0.00 H new ATOM 192 N ILE A 15 -10.073 -7.204 2.112 1.00 0.00 N ATOM 193 CA ILE A 15 -9.866 -6.351 0.925 1.00 0.00 C ATOM 194 C ILE A 15 -9.872 -7.162 -0.387 1.00 0.00 C ATOM 195 O ILE A 15 -10.192 -6.624 -1.450 1.00 0.00 O ATOM 196 CB ILE A 15 -8.575 -5.518 1.131 1.00 0.00 C ATOM 197 CG1 ILE A 15 -8.672 -4.527 2.322 1.00 0.00 C ATOM 198 CG2 ILE A 15 -8.166 -4.743 -0.133 1.00 0.00 C ATOM 199 CD1 ILE A 15 -9.848 -3.551 2.282 1.00 0.00 C ATOM 0 H ILE A 15 -9.243 -7.261 2.703 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.704 -5.662 0.820 1.00 0.00 H new ATOM 0 HB ILE A 15 -7.807 -6.256 1.360 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -8.734 -5.103 3.245 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -7.748 -3.951 2.367 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.256 -4.177 0.066 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.986 -5.445 -0.948 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.966 -4.058 -0.414 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -9.817 -2.907 3.161 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -9.783 -2.939 1.382 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -10.784 -4.109 2.274 1.00 0.00 H new ATOM 211 N GLU A 16 -9.564 -8.457 -0.333 1.00 0.00 N ATOM 212 CA GLU A 16 -9.729 -9.394 -1.458 1.00 0.00 C ATOM 213 C GLU A 16 -11.164 -9.950 -1.592 1.00 0.00 C ATOM 214 O GLU A 16 -11.557 -10.377 -2.680 1.00 0.00 O ATOM 215 CB GLU A 16 -8.725 -10.557 -1.308 1.00 0.00 C ATOM 216 CG GLU A 16 -7.287 -10.181 -1.688 1.00 0.00 C ATOM 217 CD GLU A 16 -7.062 -10.247 -3.212 1.00 0.00 C ATOM 218 OE1 GLU A 16 -7.620 -9.401 -3.953 1.00 0.00 O ATOM 219 OE2 GLU A 16 -6.325 -11.151 -3.678 1.00 0.00 O1- ATOM 0 H GLU A 16 -9.186 -8.898 0.505 1.00 0.00 H new ATOM 0 HA GLU A 16 -9.533 -8.831 -2.371 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.739 -10.907 -0.276 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -9.051 -11.390 -1.932 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -7.068 -9.174 -1.331 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.591 -10.855 -1.188 1.00 0.00 H new ATOM 226 N GLY A 17 -11.949 -9.961 -0.504 1.00 0.00 N ATOM 227 CA GLY A 17 -13.342 -10.441 -0.483 1.00 0.00 C ATOM 228 C GLY A 17 -14.363 -9.434 -1.036 1.00 0.00 C ATOM 229 O GLY A 17 -15.317 -9.822 -1.716 1.00 0.00 O ATOM 0 H GLY A 17 -11.628 -9.630 0.406 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.406 -11.362 -1.063 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -13.613 -10.690 0.543 1.00 0.00 H new ATOM 233 N LEU A 18 -14.156 -8.137 -0.769 1.00 0.00 N ATOM 234 CA LEU A 18 -14.949 -7.022 -1.316 1.00 0.00 C ATOM 235 C LEU A 18 -14.637 -6.718 -2.801 1.00 0.00 C ATOM 236 O LEU A 18 -13.761 -7.345 -3.405 1.00 0.00 O ATOM 237 CB LEU A 18 -14.794 -5.803 -0.381 1.00 0.00 C ATOM 238 CG LEU A 18 -13.380 -5.211 -0.206 1.00 0.00 C ATOM 239 CD1 LEU A 18 -12.883 -4.400 -1.399 1.00 0.00 C ATOM 240 CD2 LEU A 18 -13.381 -4.283 1.012 1.00 0.00 C ATOM 0 H LEU A 18 -13.410 -7.823 -0.148 1.00 0.00 H new ATOM 0 HA LEU A 18 -16.000 -7.309 -1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -15.446 -5.011 -0.750 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -15.164 -6.087 0.604 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.711 -6.064 -0.093 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -11.882 -4.022 -1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.853 -5.036 -2.284 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -13.558 -3.562 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -12.386 -3.858 1.146 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -14.101 -3.480 0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -13.656 -4.850 1.901 1.00 0.00 H new ATOM 252 N GLN A 19 -15.357 -5.753 -3.392 1.00 0.00 N ATOM 253 CA GLN A 19 -15.214 -5.343 -4.799 1.00 0.00 C ATOM 254 C GLN A 19 -14.989 -3.827 -4.987 1.00 0.00 C ATOM 255 O GLN A 19 -15.019 -3.050 -4.030 1.00 0.00 O ATOM 256 CB GLN A 19 -16.397 -5.881 -5.619 1.00 0.00 C ATOM 257 CG GLN A 19 -17.726 -5.141 -5.379 1.00 0.00 C ATOM 258 CD GLN A 19 -18.882 -6.117 -5.158 1.00 0.00 C ATOM 259 OE1 GLN A 19 -19.710 -6.363 -6.028 1.00 0.00 O ATOM 260 NE2 GLN A 19 -18.956 -6.735 -3.994 1.00 0.00 N ATOM 0 H GLN A 19 -16.072 -5.223 -2.894 1.00 0.00 H new ATOM 0 HA GLN A 19 -14.297 -5.792 -5.181 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -16.147 -5.819 -6.678 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -16.535 -6.937 -5.385 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -17.628 -4.489 -4.511 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -17.947 -4.502 -6.234 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -18.270 -6.535 -3.266 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -19.699 -7.413 -3.823 1.00 0.00 H new ATOM 269 N ASP A 20 -14.775 -3.396 -6.236 1.00 0.00 N ATOM 270 CA ASP A 20 -14.416 -2.013 -6.608 1.00 0.00 C ATOM 271 C ASP A 20 -15.453 -0.957 -6.191 1.00 0.00 C ATOM 272 O ASP A 20 -15.092 0.187 -5.912 1.00 0.00 O ATOM 273 CB ASP A 20 -14.182 -1.910 -8.129 1.00 0.00 C ATOM 274 CG ASP A 20 -13.094 -2.834 -8.709 1.00 0.00 C ATOM 275 OD1 ASP A 20 -13.040 -2.954 -9.957 1.00 0.00 O ATOM 276 OD2 ASP A 20 -12.281 -3.428 -7.956 1.00 0.00 O1- ATOM 0 H ASP A 20 -14.848 -4.015 -7.043 1.00 0.00 H new ATOM 0 HA ASP A 20 -13.502 -1.794 -6.056 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -15.122 -2.126 -8.637 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.920 -0.879 -8.367 1.00 0.00 H new ATOM 281 N ASP A 21 -16.736 -1.325 -6.101 1.00 0.00 N ATOM 282 CA ASP A 21 -17.800 -0.445 -5.589 1.00 0.00 C ATOM 283 C ASP A 21 -17.604 -0.101 -4.095 1.00 0.00 C ATOM 284 O ASP A 21 -17.816 1.037 -3.675 1.00 0.00 O ATOM 285 CB ASP A 21 -19.149 -1.143 -5.816 1.00 0.00 C ATOM 286 CG ASP A 21 -20.372 -0.258 -5.504 1.00 0.00 C ATOM 287 OD1 ASP A 21 -20.340 0.972 -5.746 1.00 0.00 O ATOM 288 OD2 ASP A 21 -21.406 -0.811 -5.054 1.00 0.00 O1- ATOM 0 H ASP A 21 -17.070 -2.247 -6.382 1.00 0.00 H new ATOM 0 HA ASP A 21 -17.767 0.502 -6.127 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -19.206 -1.472 -6.854 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -19.193 -2.038 -5.195 1.00 0.00 H new ATOM 293 N ASP A 22 -17.127 -1.064 -3.297 1.00 0.00 N ATOM 294 CA ASP A 22 -16.770 -0.863 -1.890 1.00 0.00 C ATOM 295 C ASP A 22 -15.457 -0.070 -1.744 1.00 0.00 C ATOM 296 O ASP A 22 -15.362 0.804 -0.878 1.00 0.00 O ATOM 297 CB ASP A 22 -16.680 -2.218 -1.170 1.00 0.00 C ATOM 298 CG ASP A 22 -17.937 -3.090 -1.336 1.00 0.00 C ATOM 299 OD1 ASP A 22 -19.059 -2.593 -1.063 1.00 0.00 O ATOM 300 OD2 ASP A 22 -17.806 -4.280 -1.717 1.00 0.00 O1- ATOM 0 H ASP A 22 -16.976 -2.020 -3.618 1.00 0.00 H new ATOM 0 HA ASP A 22 -17.556 -0.269 -1.423 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -15.817 -2.765 -1.549 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -16.506 -2.045 -0.108 1.00 0.00 H new ATOM 305 N LEU A 23 -14.468 -0.314 -2.617 1.00 0.00 N ATOM 306 CA LEU A 23 -13.227 0.470 -2.669 1.00 0.00 C ATOM 307 C LEU A 23 -13.518 1.945 -2.985 1.00 0.00 C ATOM 308 O LEU A 23 -13.052 2.819 -2.263 1.00 0.00 O ATOM 309 CB LEU A 23 -12.247 -0.128 -3.695 1.00 0.00 C ATOM 310 CG LEU A 23 -11.703 -1.523 -3.329 1.00 0.00 C ATOM 311 CD1 LEU A 23 -10.858 -2.109 -4.458 1.00 0.00 C ATOM 312 CD2 LEU A 23 -10.807 -1.464 -2.090 1.00 0.00 C ATOM 0 H LEU A 23 -14.508 -1.063 -3.308 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.759 0.425 -1.685 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -12.747 -0.190 -4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.406 0.555 -3.815 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.578 -2.146 -3.143 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.491 -3.093 -4.165 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.467 -2.202 -5.357 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.012 -1.451 -4.658 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.440 -2.464 -1.859 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.962 -0.803 -2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.380 -1.083 -1.244 1.00 0.00 H new ATOM 324 N ALA A 24 -14.332 2.239 -4.001 1.00 0.00 N ATOM 325 CA ALA A 24 -14.724 3.606 -4.343 1.00 0.00 C ATOM 326 C ALA A 24 -15.507 4.306 -3.214 1.00 0.00 C ATOM 327 O ALA A 24 -15.317 5.503 -2.994 1.00 0.00 O ATOM 328 CB ALA A 24 -15.530 3.580 -5.647 1.00 0.00 C ATOM 0 H ALA A 24 -14.739 1.531 -4.612 1.00 0.00 H new ATOM 0 HA ALA A 24 -13.817 4.195 -4.480 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -15.827 4.595 -5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -14.917 3.162 -6.445 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -16.420 2.965 -5.513 1.00 0.00 H new ATOM 334 N ALA A 25 -16.336 3.576 -2.460 1.00 0.00 N ATOM 335 CA ALA A 25 -17.062 4.126 -1.315 1.00 0.00 C ATOM 336 C ALA A 25 -16.127 4.547 -0.156 1.00 0.00 C ATOM 337 O ALA A 25 -16.360 5.588 0.469 1.00 0.00 O ATOM 338 CB ALA A 25 -18.104 3.096 -0.862 1.00 0.00 C ATOM 0 H ALA A 25 -16.521 2.587 -2.628 1.00 0.00 H new ATOM 0 HA ALA A 25 -17.561 5.044 -1.625 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -18.656 3.488 -0.008 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -18.796 2.894 -1.680 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -17.602 2.172 -0.576 1.00 0.00 H new ATOM 344 N LEU A 26 -15.064 3.774 0.129 1.00 0.00 N ATOM 345 CA LEU A 26 -14.126 4.063 1.228 1.00 0.00 C ATOM 346 C LEU A 26 -12.933 4.965 0.829 1.00 0.00 C ATOM 347 O LEU A 26 -12.467 5.749 1.662 1.00 0.00 O ATOM 348 CB LEU A 26 -13.754 2.749 1.953 1.00 0.00 C ATOM 349 CG LEU A 26 -12.565 1.952 1.376 1.00 0.00 C ATOM 350 CD1 LEU A 26 -11.260 2.302 2.095 1.00 0.00 C ATOM 351 CD2 LEU A 26 -12.769 0.447 1.555 1.00 0.00 C ATOM 0 H LEU A 26 -14.831 2.931 -0.396 1.00 0.00 H new ATOM 0 HA LEU A 26 -14.636 4.694 1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.532 2.986 2.994 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -14.630 2.101 1.953 1.00 0.00 H new ATOM 0 HG LEU A 26 -12.509 2.215 0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.442 1.724 1.666 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -11.054 3.366 1.977 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -11.354 2.066 3.155 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -11.915 -0.088 1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -12.860 0.216 2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -13.678 0.139 1.038 1.00 0.00 H new ATOM 363 N LEU A 27 -12.465 4.915 -0.427 1.00 0.00 N ATOM 364 CA LEU A 27 -11.459 5.845 -0.973 1.00 0.00 C ATOM 365 C LEU A 27 -12.049 7.227 -1.308 1.00 0.00 C ATOM 366 O LEU A 27 -11.387 8.247 -1.105 1.00 0.00 O ATOM 367 CB LEU A 27 -10.794 5.261 -2.234 1.00 0.00 C ATOM 368 CG LEU A 27 -9.552 4.388 -1.963 1.00 0.00 C ATOM 369 CD1 LEU A 27 -9.791 3.192 -1.048 1.00 0.00 C ATOM 370 CD2 LEU A 27 -8.998 3.854 -3.282 1.00 0.00 C ATOM 0 H LEU A 27 -12.778 4.218 -1.103 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.713 5.977 -0.189 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.530 4.664 -2.773 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.507 6.083 -2.890 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.854 5.050 -1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.859 2.641 -0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.144 3.541 -0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.541 2.538 -1.493 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.121 3.238 -3.085 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.759 3.253 -3.780 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.718 4.689 -3.924 1.00 0.00 H new ATOM 382 N GLY A 28 -13.281 7.279 -1.822 1.00 0.00 N ATOM 383 CA GLY A 28 -13.975 8.526 -2.158 1.00 0.00 C ATOM 384 C GLY A 28 -13.237 9.338 -3.226 1.00 0.00 C ATOM 385 O GLY A 28 -12.934 8.825 -4.308 1.00 0.00 O ATOM 0 H GLY A 28 -13.833 6.444 -2.019 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -14.980 8.295 -2.512 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -14.085 9.131 -1.258 1.00 0.00 H new ATOM 389 N LYS A 29 -12.914 10.604 -2.918 1.00 0.00 N ATOM 390 CA LYS A 29 -12.180 11.513 -3.820 1.00 0.00 C ATOM 391 C LYS A 29 -10.808 10.953 -4.238 1.00 0.00 C ATOM 392 O LYS A 29 -10.377 11.158 -5.374 1.00 0.00 O ATOM 393 CB LYS A 29 -12.023 12.874 -3.114 1.00 0.00 C ATOM 394 CG LYS A 29 -11.677 14.027 -4.074 1.00 0.00 C ATOM 395 CD LYS A 29 -12.903 14.582 -4.813 1.00 0.00 C ATOM 396 CE LYS A 29 -12.510 15.828 -5.617 1.00 0.00 C ATOM 397 NZ LYS A 29 -13.686 16.478 -6.252 1.00 0.00 N1+ ATOM 0 H LYS A 29 -13.157 11.033 -2.025 1.00 0.00 H new ATOM 0 HA LYS A 29 -12.752 11.624 -4.741 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -12.949 13.112 -2.591 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -11.242 12.794 -2.358 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.204 14.832 -3.511 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -10.947 13.678 -4.804 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -13.311 13.822 -5.480 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -13.687 14.832 -4.098 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -12.013 16.541 -4.959 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -11.790 15.550 -6.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -13.374 17.315 -6.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -14.146 15.807 -6.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.362 16.768 -5.516 1.00 0.00 H new ATOM 411 N GLU A 30 -10.143 10.213 -3.347 1.00 0.00 N ATOM 412 CA GLU A 30 -8.808 9.627 -3.573 1.00 0.00 C ATOM 413 C GLU A 30 -8.813 8.352 -4.445 1.00 0.00 C ATOM 414 O GLU A 30 -7.757 7.757 -4.669 1.00 0.00 O ATOM 415 CB GLU A 30 -8.104 9.347 -2.230 1.00 0.00 C ATOM 416 CG GLU A 30 -8.076 10.534 -1.246 1.00 0.00 C ATOM 417 CD GLU A 30 -7.680 11.879 -1.884 1.00 0.00 C ATOM 418 OE1 GLU A 30 -8.259 12.910 -1.469 1.00 0.00 O ATOM 419 OE2 GLU A 30 -6.763 11.920 -2.735 1.00 0.00 O1- ATOM 0 H GLU A 30 -10.522 9.996 -2.425 1.00 0.00 H new ATOM 0 HA GLU A 30 -8.253 10.376 -4.138 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -8.600 8.506 -1.746 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -7.078 9.039 -2.433 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.061 10.637 -0.792 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.376 10.307 -0.442 1.00 0.00 H new ATOM 426 N PHE A 31 -9.975 7.913 -4.950 1.00 0.00 N ATOM 427 CA PHE A 31 -10.054 6.814 -5.912 1.00 0.00 C ATOM 428 C PHE A 31 -9.252 7.134 -7.192 1.00 0.00 C ATOM 429 O PHE A 31 -9.249 8.272 -7.670 1.00 0.00 O ATOM 430 CB PHE A 31 -11.519 6.464 -6.207 1.00 0.00 C ATOM 431 CG PHE A 31 -11.688 5.211 -7.045 1.00 0.00 C ATOM 432 CD1 PHE A 31 -11.803 3.950 -6.424 1.00 0.00 C ATOM 433 CD2 PHE A 31 -11.706 5.300 -8.450 1.00 0.00 C ATOM 434 CE1 PHE A 31 -11.949 2.789 -7.209 1.00 0.00 C ATOM 435 CE2 PHE A 31 -11.799 4.138 -9.231 1.00 0.00 C ATOM 436 CZ PHE A 31 -11.935 2.881 -8.614 1.00 0.00 C ATOM 0 H PHE A 31 -10.881 8.311 -4.702 1.00 0.00 H new ATOM 0 HA PHE A 31 -9.593 5.930 -5.472 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -12.050 6.334 -5.264 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -11.987 7.302 -6.723 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -11.779 3.874 -5.347 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -11.648 6.266 -8.929 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -12.072 1.828 -6.733 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -11.766 4.209 -10.308 1.00 0.00 H new ATOM 0 HZ PHE A 31 -12.028 1.989 -9.216 1.00 0.00 H new ATOM 446 N ILE A 32 -8.550 6.132 -7.724 1.00 0.00 N ATOM 447 CA ILE A 32 -7.581 6.291 -8.823 1.00 0.00 C ATOM 448 C ILE A 32 -8.234 6.751 -10.141 1.00 0.00 C ATOM 449 O ILE A 32 -9.384 6.421 -10.435 1.00 0.00 O ATOM 450 CB ILE A 32 -6.744 4.995 -8.964 1.00 0.00 C ATOM 451 CG1 ILE A 32 -5.366 5.210 -9.624 1.00 0.00 C ATOM 452 CG2 ILE A 32 -7.491 3.920 -9.781 1.00 0.00 C ATOM 453 CD1 ILE A 32 -4.425 6.105 -8.805 1.00 0.00 C ATOM 0 H ILE A 32 -8.636 5.168 -7.401 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.900 7.104 -8.571 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.588 4.664 -7.937 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.891 4.241 -9.777 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.510 5.654 -10.609 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.872 3.026 -9.858 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.428 3.671 -9.283 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -7.701 4.303 -10.780 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.476 6.212 -9.330 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.879 7.087 -8.674 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.251 5.653 -7.829 1.00 0.00 H new ATOM 722 N TRP A 56 6.727 -13.223 8.002 1.00 0.00 N ATOM 723 CA TRP A 56 5.718 -12.156 8.157 1.00 0.00 C ATOM 724 C TRP A 56 5.905 -10.975 7.193 1.00 0.00 C ATOM 725 O TRP A 56 4.947 -10.249 6.908 1.00 0.00 O ATOM 726 CB TRP A 56 5.771 -11.655 9.609 1.00 0.00 C ATOM 727 CG TRP A 56 7.100 -11.073 10.028 1.00 0.00 C ATOM 728 CD1 TRP A 56 8.069 -11.742 10.703 1.00 0.00 C ATOM 729 CD2 TRP A 56 7.650 -9.741 9.772 1.00 0.00 C ATOM 730 NE1 TRP A 56 9.189 -10.946 10.820 1.00 0.00 N ATOM 731 CE2 TRP A 56 9.006 -9.714 10.229 1.00 0.00 C ATOM 732 CE3 TRP A 56 7.156 -8.559 9.173 1.00 0.00 C ATOM 733 CZ2 TRP A 56 9.840 -8.603 10.049 1.00 0.00 C ATOM 734 CZ3 TRP A 56 7.986 -7.435 8.988 1.00 0.00 C ATOM 735 CH2 TRP A 56 9.328 -7.459 9.405 1.00 0.00 C ATOM 0 HA TRP A 56 4.747 -12.587 7.912 1.00 0.00 H new ATOM 0 HB2 TRP A 56 4.999 -10.898 9.746 1.00 0.00 H new ATOM 0 HB3 TRP A 56 5.527 -12.483 10.274 1.00 0.00 H new ATOM 0 HD1 TRP A 56 7.977 -12.746 11.090 1.00 0.00 H new ATOM 0 HE1 TRP A 56 10.049 -11.234 11.287 1.00 0.00 H new ATOM 0 HE3 TRP A 56 6.126 -8.517 8.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 10.862 -8.623 10.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 7.587 -6.547 8.521 1.00 0.00 H new ATOM 0 HH2 TRP A 56 9.964 -6.604 9.232 1.00 0.00 H new ATOM 746 N LYS A 57 7.137 -10.757 6.716 1.00 0.00 N ATOM 747 CA LYS A 57 7.499 -9.794 5.666 1.00 0.00 C ATOM 748 C LYS A 57 7.314 -10.370 4.261 1.00 0.00 C ATOM 749 O LYS A 57 6.842 -9.682 3.362 1.00 0.00 O ATOM 750 CB LYS A 57 8.937 -9.290 5.911 1.00 0.00 C ATOM 751 CG LYS A 57 10.047 -10.359 5.829 1.00 0.00 C ATOM 752 CD LYS A 57 11.370 -9.878 6.455 1.00 0.00 C ATOM 753 CE LYS A 57 11.953 -8.593 5.836 1.00 0.00 C ATOM 754 NZ LYS A 57 12.454 -8.799 4.450 1.00 0.00 N1+ ATOM 0 H LYS A 57 7.946 -11.270 7.067 1.00 0.00 H new ATOM 0 HA LYS A 57 6.819 -8.944 5.721 1.00 0.00 H new ATOM 0 HB2 LYS A 57 9.157 -8.509 5.183 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.977 -8.827 6.897 1.00 0.00 H new ATOM 0 HG2 LYS A 57 9.715 -11.264 6.338 1.00 0.00 H new ATOM 0 HG3 LYS A 57 10.217 -10.624 4.785 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.211 -9.711 7.520 1.00 0.00 H new ATOM 0 HD3 LYS A 57 12.108 -10.675 6.364 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.187 -7.818 5.829 1.00 0.00 H new ATOM 0 HE3 LYS A 57 12.768 -8.230 6.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 12.835 -7.904 4.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 13.205 -9.519 4.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 11.673 -9.119 3.842 1.00 0.00 H new ATOM 768 N ASP A 58 7.656 -11.645 4.087 1.00 0.00 N ATOM 769 CA ASP A 58 7.736 -12.351 2.806 1.00 0.00 C ATOM 770 C ASP A 58 6.348 -12.667 2.202 1.00 0.00 C ATOM 771 O ASP A 58 6.083 -12.354 1.037 1.00 0.00 O ATOM 772 CB ASP A 58 8.564 -13.628 3.043 1.00 0.00 C ATOM 773 CG ASP A 58 9.024 -14.348 1.763 1.00 0.00 C ATOM 774 OD1 ASP A 58 9.475 -15.511 1.878 1.00 0.00 O ATOM 775 OD2 ASP A 58 8.963 -13.774 0.652 1.00 0.00 O1- ATOM 0 H ASP A 58 7.898 -12.246 4.875 1.00 0.00 H new ATOM 0 HA ASP A 58 8.217 -11.711 2.066 1.00 0.00 H new ATOM 0 HB2 ASP A 58 9.443 -13.369 3.633 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.972 -14.322 3.640 1.00 0.00 H new ATOM 780 N ASP A 59 5.428 -13.227 3.001 1.00 0.00 N ATOM 781 CA ASP A 59 4.056 -13.523 2.552 1.00 0.00 C ATOM 782 C ASP A 59 3.189 -12.253 2.397 1.00 0.00 C ATOM 783 O ASP A 59 2.321 -12.190 1.520 1.00 0.00 O ATOM 784 CB ASP A 59 3.395 -14.597 3.442 1.00 0.00 C ATOM 785 CG ASP A 59 3.146 -14.263 4.929 1.00 0.00 C ATOM 786 OD1 ASP A 59 3.267 -13.094 5.363 1.00 0.00 O ATOM 787 OD2 ASP A 59 2.764 -15.198 5.677 1.00 0.00 O1- ATOM 0 H ASP A 59 5.610 -13.487 3.970 1.00 0.00 H new ATOM 0 HA ASP A 59 4.131 -13.943 1.549 1.00 0.00 H new ATOM 0 HB2 ASP A 59 2.436 -14.856 2.994 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.017 -15.491 3.402 1.00 0.00 H new ATOM 792 N TYR A 60 3.471 -11.212 3.183 1.00 0.00 N ATOM 793 CA TYR A 60 2.818 -9.904 3.140 1.00 0.00 C ATOM 794 C TYR A 60 3.214 -9.128 1.878 1.00 0.00 C ATOM 795 O TYR A 60 2.343 -8.738 1.096 1.00 0.00 O ATOM 796 CB TYR A 60 3.203 -9.174 4.430 1.00 0.00 C ATOM 797 CG TYR A 60 2.688 -7.759 4.600 1.00 0.00 C ATOM 798 CD1 TYR A 60 3.599 -6.684 4.659 1.00 0.00 C ATOM 799 CD2 TYR A 60 1.313 -7.525 4.786 1.00 0.00 C ATOM 800 CE1 TYR A 60 3.140 -5.381 4.926 1.00 0.00 C ATOM 801 CE2 TYR A 60 0.849 -6.218 5.051 1.00 0.00 C ATOM 802 CZ TYR A 60 1.762 -5.144 5.140 1.00 0.00 C ATOM 803 OH TYR A 60 1.316 -3.907 5.475 1.00 0.00 O ATOM 0 H TYR A 60 4.195 -11.261 3.900 1.00 0.00 H new ATOM 0 HA TYR A 60 1.734 -10.004 3.085 1.00 0.00 H new ATOM 0 HB2 TYR A 60 2.849 -9.767 5.273 1.00 0.00 H new ATOM 0 HB3 TYR A 60 4.291 -9.148 4.493 1.00 0.00 H new ATOM 0 HD1 TYR A 60 4.652 -6.861 4.499 1.00 0.00 H new ATOM 0 HD2 TYR A 60 0.613 -8.345 4.726 1.00 0.00 H new ATOM 0 HE1 TYR A 60 3.841 -4.560 4.968 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -0.207 -6.039 5.186 1.00 0.00 H new ATOM 0 HH TYR A 60 0.342 -3.928 5.582 1.00 0.00 H new ATOM 813 N LEU A 61 4.512 -8.976 1.609 1.00 0.00 N ATOM 814 CA LEU A 61 5.009 -8.303 0.406 1.00 0.00 C ATOM 815 C LEU A 61 4.591 -9.029 -0.887 1.00 0.00 C ATOM 816 O LEU A 61 4.252 -8.383 -1.881 1.00 0.00 O ATOM 817 CB LEU A 61 6.537 -8.167 0.532 1.00 0.00 C ATOM 818 CG LEU A 61 7.202 -7.365 -0.594 1.00 0.00 C ATOM 819 CD1 LEU A 61 6.731 -5.913 -0.643 1.00 0.00 C ATOM 820 CD2 LEU A 61 8.718 -7.356 -0.392 1.00 0.00 C ATOM 0 H LEU A 61 5.252 -9.318 2.222 1.00 0.00 H new ATOM 0 HA LEU A 61 4.560 -7.313 0.331 1.00 0.00 H new ATOM 0 HB2 LEU A 61 6.769 -7.691 1.485 1.00 0.00 H new ATOM 0 HB3 LEU A 61 6.976 -9.164 0.558 1.00 0.00 H new ATOM 0 HG LEU A 61 6.923 -7.851 -1.529 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.235 -5.394 -1.459 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.654 -5.885 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU A 61 6.968 -5.422 0.301 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.188 -6.786 -1.193 1.00 0.00 H new ATOM 0 HD22 LEU A 61 8.954 -6.897 0.568 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.093 -8.379 -0.407 1.00 0.00 H new ATOM 832 N SER A 62 4.539 -10.369 -0.859 1.00 0.00 N ATOM 833 CA SER A 62 4.009 -11.203 -1.948 1.00 0.00 C ATOM 834 C SER A 62 2.525 -10.935 -2.250 1.00 0.00 C ATOM 835 O SER A 62 2.122 -10.986 -3.411 1.00 0.00 O ATOM 836 CB SER A 62 4.223 -12.681 -1.600 1.00 0.00 C ATOM 837 OG SER A 62 3.672 -13.549 -2.588 1.00 0.00 O ATOM 0 H SER A 62 4.871 -10.914 -0.063 1.00 0.00 H new ATOM 0 HA SER A 62 4.555 -10.942 -2.854 1.00 0.00 H new ATOM 0 HB2 SER A 62 5.290 -12.878 -1.499 1.00 0.00 H new ATOM 0 HB3 SER A 62 3.766 -12.896 -0.634 1.00 0.00 H new ATOM 0 HG SER A 62 3.831 -14.481 -2.330 1.00 0.00 H new ATOM 843 N ARG A 63 1.697 -10.606 -1.249 1.00 0.00 N ATOM 844 CA ARG A 63 0.309 -10.155 -1.463 1.00 0.00 C ATOM 845 C ARG A 63 0.245 -8.715 -1.976 1.00 0.00 C ATOM 846 O ARG A 63 -0.420 -8.461 -2.980 1.00 0.00 O ATOM 847 CB ARG A 63 -0.511 -10.319 -0.172 1.00 0.00 C ATOM 848 CG ARG A 63 -0.811 -11.798 0.110 1.00 0.00 C ATOM 849 CD ARG A 63 -1.496 -11.976 1.463 1.00 0.00 C ATOM 850 NE ARG A 63 -1.856 -13.390 1.689 1.00 0.00 N ATOM 851 CZ ARG A 63 -2.343 -13.911 2.801 1.00 0.00 C ATOM 852 NH1 ARG A 63 -2.518 -13.206 3.883 1.00 0.00 N1+ ATOM 853 NH2 ARG A 63 -2.672 -15.172 2.852 1.00 0.00 N ATOM 0 H ARG A 63 1.968 -10.644 -0.266 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.128 -10.786 -2.237 1.00 0.00 H new ATOM 0 HB2 ARG A 63 0.037 -9.890 0.667 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.446 -9.766 -0.259 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -1.448 -12.199 -0.678 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.117 -12.370 0.092 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.834 -11.634 2.258 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.392 -11.357 1.506 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.714 -14.030 0.907 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.276 -12.215 3.891 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.897 -13.645 4.722 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.554 -15.764 2.029 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.047 -15.567 3.714 1.00 0.00 H new ATOM 867 N LEU A 64 0.971 -7.779 -1.358 1.00 0.00 N ATOM 868 CA LEU A 64 0.951 -6.358 -1.742 1.00 0.00 C ATOM 869 C LEU A 64 1.424 -6.112 -3.190 1.00 0.00 C ATOM 870 O LEU A 64 0.926 -5.187 -3.834 1.00 0.00 O ATOM 871 CB LEU A 64 1.773 -5.534 -0.730 1.00 0.00 C ATOM 872 CG LEU A 64 0.957 -5.027 0.475 1.00 0.00 C ATOM 873 CD1 LEU A 64 0.581 -6.101 1.492 1.00 0.00 C ATOM 874 CD2 LEU A 64 1.742 -3.944 1.224 1.00 0.00 C ATOM 0 H LEU A 64 1.592 -7.982 -0.575 1.00 0.00 H new ATOM 0 HA LEU A 64 -0.087 -6.027 -1.716 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.599 -6.145 -0.365 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.212 -4.679 -1.244 1.00 0.00 H new ATOM 0 HG LEU A 64 0.032 -4.647 0.041 1.00 0.00 H new ATOM 0 HD11 LEU A 64 0.009 -5.650 2.303 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.022 -6.868 1.005 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.487 -6.554 1.895 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.157 -3.592 2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.685 -4.359 1.580 1.00 0.00 H new ATOM 0 HD23 LEU A 64 1.943 -3.110 0.552 1.00 0.00 H new ATOM 886 N SER A 65 2.315 -6.935 -3.747 1.00 0.00 N ATOM 887 CA SER A 65 2.699 -6.855 -5.171 1.00 0.00 C ATOM 888 C SER A 65 1.576 -7.293 -6.131 1.00 0.00 C ATOM 889 O SER A 65 1.506 -6.787 -7.254 1.00 0.00 O ATOM 890 CB SER A 65 3.975 -7.670 -5.433 1.00 0.00 C ATOM 891 OG SER A 65 3.742 -9.063 -5.295 1.00 0.00 O ATOM 0 H SER A 65 2.793 -7.675 -3.232 1.00 0.00 H new ATOM 0 HA SER A 65 2.891 -5.802 -5.378 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.342 -7.460 -6.438 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.755 -7.360 -4.737 1.00 0.00 H new ATOM 0 HG SER A 65 3.146 -9.221 -4.534 1.00 0.00 H new ATOM 897 N ARG A 66 0.662 -8.179 -5.709 1.00 0.00 N ATOM 898 CA ARG A 66 -0.476 -8.684 -6.505 1.00 0.00 C ATOM 899 C ARG A 66 -1.727 -7.807 -6.407 1.00 0.00 C ATOM 900 O ARG A 66 -2.436 -7.643 -7.404 1.00 0.00 O ATOM 901 CB ARG A 66 -0.820 -10.114 -6.051 1.00 0.00 C ATOM 902 CG ARG A 66 0.352 -11.091 -6.226 1.00 0.00 C ATOM 903 CD ARG A 66 0.084 -12.403 -5.485 1.00 0.00 C ATOM 904 NE ARG A 66 1.350 -13.079 -5.155 1.00 0.00 N ATOM 905 CZ ARG A 66 1.947 -14.080 -5.766 1.00 0.00 C ATOM 906 NH1 ARG A 66 1.449 -14.665 -6.817 1.00 0.00 N1+ ATOM 907 NH2 ARG A 66 3.083 -14.516 -5.304 1.00 0.00 N ATOM 0 H ARG A 66 0.692 -8.580 -4.772 1.00 0.00 H new ATOM 0 HA ARG A 66 -0.161 -8.667 -7.549 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -1.119 -10.096 -5.003 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -1.676 -10.475 -6.620 1.00 0.00 H new ATOM 0 HG2 ARG A 66 0.508 -11.292 -7.286 1.00 0.00 H new ATOM 0 HG3 ARG A 66 1.269 -10.637 -5.850 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -0.477 -12.203 -4.572 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -0.533 -13.056 -6.102 1.00 0.00 H new ATOM 0 HE ARG A 66 1.835 -12.719 -4.333 1.00 0.00 H new ATOM 0 HH11 ARG A 66 0.558 -14.351 -7.202 1.00 0.00 H new ATOM 0 HH12 ARG A 66 1.950 -15.438 -7.256 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.498 -14.083 -4.479 1.00 0.00 H new ATOM 0 HH22 ARG A 66 3.558 -15.291 -5.767 1.00 0.00 H new ATOM 921 N LEU A 67 -2.005 -7.237 -5.232 1.00 0.00 N ATOM 922 CA LEU A 67 -3.155 -6.355 -4.975 1.00 0.00 C ATOM 923 C LEU A 67 -3.079 -5.052 -5.798 1.00 0.00 C ATOM 924 O LEU A 67 -1.995 -4.570 -6.143 1.00 0.00 O ATOM 925 CB LEU A 67 -3.275 -6.067 -3.461 1.00 0.00 C ATOM 926 CG LEU A 67 -4.210 -7.039 -2.703 1.00 0.00 C ATOM 927 CD1 LEU A 67 -3.750 -8.495 -2.695 1.00 0.00 C ATOM 928 CD2 LEU A 67 -4.326 -6.593 -1.246 1.00 0.00 C ATOM 0 H LEU A 67 -1.422 -7.378 -4.407 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.058 -6.872 -5.300 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.282 -6.113 -3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.639 -5.049 -3.324 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.158 -7.001 -3.239 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.468 -9.100 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.682 -8.861 -3.720 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.772 -8.565 -2.219 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.984 -7.275 -0.708 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.339 -6.601 -0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.738 -5.585 -1.206 1.00 0.00 H new ATOM 940 N SER A 68 -4.240 -4.481 -6.124 1.00 0.00 N ATOM 941 CA SER A 68 -4.355 -3.247 -6.921 1.00 0.00 C ATOM 942 C SER A 68 -3.955 -1.984 -6.148 1.00 0.00 C ATOM 943 O SER A 68 -3.889 -1.979 -4.917 1.00 0.00 O ATOM 944 CB SER A 68 -5.780 -3.091 -7.467 1.00 0.00 C ATOM 945 OG SER A 68 -6.676 -2.599 -6.485 1.00 0.00 O ATOM 0 H SER A 68 -5.142 -4.864 -5.841 1.00 0.00 H new ATOM 0 HA SER A 68 -3.649 -3.352 -7.745 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.769 -2.412 -8.320 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.136 -4.055 -7.831 1.00 0.00 H new ATOM 0 HG SER A 68 -7.572 -2.513 -6.873 1.00 0.00 H new ATOM 951 N LYS A 69 -3.748 -0.877 -6.871 1.00 0.00 N ATOM 952 CA LYS A 69 -3.532 0.475 -6.318 1.00 0.00 C ATOM 953 C LYS A 69 -4.653 0.913 -5.359 1.00 0.00 C ATOM 954 O LYS A 69 -4.382 1.531 -4.331 1.00 0.00 O ATOM 955 CB LYS A 69 -3.389 1.430 -7.517 1.00 0.00 C ATOM 956 CG LYS A 69 -3.230 2.923 -7.203 1.00 0.00 C ATOM 957 CD LYS A 69 -2.004 3.256 -6.348 1.00 0.00 C ATOM 958 CE LYS A 69 -1.815 4.778 -6.374 1.00 0.00 C ATOM 959 NZ LYS A 69 -0.657 5.227 -5.569 1.00 0.00 N1+ ATOM 0 H LYS A 69 -3.725 -0.893 -7.891 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.630 0.487 -5.706 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -2.525 1.113 -8.101 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.266 1.309 -8.153 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.167 3.475 -8.140 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -4.125 3.272 -6.687 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.145 2.906 -5.325 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.118 2.754 -6.738 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.683 5.105 -7.405 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.719 5.258 -6.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -0.463 6.229 -5.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -0.871 5.110 -4.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 0.178 4.658 -5.814 1.00 0.00 H new ATOM 973 N ASN A 70 -5.900 0.550 -5.665 1.00 0.00 N ATOM 974 CA ASN A 70 -7.058 0.815 -4.804 1.00 0.00 C ATOM 975 C ASN A 70 -7.054 -0.054 -3.525 1.00 0.00 C ATOM 976 O ASN A 70 -7.262 0.455 -2.422 1.00 0.00 O ATOM 977 CB ASN A 70 -8.346 0.584 -5.618 1.00 0.00 C ATOM 978 CG ASN A 70 -8.409 1.385 -6.900 1.00 0.00 C ATOM 979 OD1 ASN A 70 -8.136 0.896 -7.988 1.00 0.00 O ATOM 980 ND2 ASN A 70 -8.762 2.645 -6.821 1.00 0.00 N ATOM 0 H ASN A 70 -6.139 0.058 -6.526 1.00 0.00 H new ATOM 0 HA ASN A 70 -7.007 1.851 -4.470 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -8.428 -0.476 -5.858 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -9.207 0.838 -4.999 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -8.809 3.215 -7.665 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -8.990 3.055 -5.915 1.00 0.00 H new ATOM 987 N GLN A 71 -6.766 -1.352 -3.663 1.00 0.00 N ATOM 988 CA GLN A 71 -6.680 -2.303 -2.543 1.00 0.00 C ATOM 989 C GLN A 71 -5.518 -1.964 -1.591 1.00 0.00 C ATOM 990 O GLN A 71 -5.677 -2.041 -0.374 1.00 0.00 O ATOM 991 CB GLN A 71 -6.526 -3.722 -3.099 1.00 0.00 C ATOM 992 CG GLN A 71 -7.812 -4.281 -3.729 1.00 0.00 C ATOM 993 CD GLN A 71 -7.588 -5.699 -4.247 1.00 0.00 C ATOM 994 OE1 GLN A 71 -6.722 -5.955 -5.082 1.00 0.00 O ATOM 995 NE2 GLN A 71 -8.317 -6.674 -3.750 1.00 0.00 N ATOM 0 H GLN A 71 -6.583 -1.781 -4.570 1.00 0.00 H new ATOM 0 HA GLN A 71 -7.598 -2.234 -1.960 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -5.734 -3.726 -3.848 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -6.208 -4.385 -2.295 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -8.614 -4.281 -2.991 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -8.132 -3.636 -4.547 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -9.037 -6.470 -3.057 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -8.162 -7.634 -4.057 1.00 0.00 H new ATOM 1004 N LEU A 72 -4.374 -1.533 -2.120 1.00 0.00 N ATOM 1005 CA LEU A 72 -3.228 -1.053 -1.336 1.00 0.00 C ATOM 1006 C LEU A 72 -3.589 0.152 -0.456 1.00 0.00 C ATOM 1007 O LEU A 72 -3.253 0.152 0.731 1.00 0.00 O ATOM 1008 CB LEU A 72 -2.066 -0.702 -2.286 1.00 0.00 C ATOM 1009 CG LEU A 72 -1.313 -1.931 -2.822 1.00 0.00 C ATOM 1010 CD1 LEU A 72 -0.506 -1.574 -4.069 1.00 0.00 C ATOM 1011 CD2 LEU A 72 -0.323 -2.459 -1.776 1.00 0.00 C ATOM 0 H LEU A 72 -4.211 -1.506 -3.126 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.923 -1.854 -0.663 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.457 -0.131 -3.128 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.362 -0.056 -1.762 1.00 0.00 H new ATOM 0 HG LEU A 72 -2.063 -2.686 -3.057 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.018 -2.459 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.178 -1.209 -4.845 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.219 -0.798 -3.823 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.199 -3.328 -2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.401 -1.681 -1.534 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.864 -2.744 -0.874 1.00 0.00 H new ATOM 1023 N MET A 73 -4.316 1.140 -0.988 1.00 0.00 N ATOM 1024 CA MET A 73 -4.841 2.255 -0.185 1.00 0.00 C ATOM 1025 C MET A 73 -5.826 1.774 0.898 1.00 0.00 C ATOM 1026 O MET A 73 -5.732 2.210 2.049 1.00 0.00 O ATOM 1027 CB MET A 73 -5.504 3.299 -1.100 1.00 0.00 C ATOM 1028 CG MET A 73 -4.476 4.282 -1.673 1.00 0.00 C ATOM 1029 SD MET A 73 -5.181 5.658 -2.628 1.00 0.00 S ATOM 1030 CE MET A 73 -5.473 4.848 -4.221 1.00 0.00 C ATOM 0 H MET A 73 -4.557 1.192 -1.978 1.00 0.00 H new ATOM 0 HA MET A 73 -4.000 2.717 0.332 1.00 0.00 H new ATOM 0 HB2 MET A 73 -6.019 2.793 -1.917 1.00 0.00 H new ATOM 0 HB3 MET A 73 -6.260 3.848 -0.538 1.00 0.00 H new ATOM 0 HG2 MET A 73 -3.890 4.693 -0.851 1.00 0.00 H new ATOM 0 HG3 MET A 73 -3.786 3.731 -2.312 1.00 0.00 H new ATOM 0 HE1 MET A 73 -5.906 5.564 -4.919 1.00 0.00 H new ATOM 0 HE2 MET A 73 -4.528 4.478 -4.620 1.00 0.00 H new ATOM 0 HE3 MET A 73 -6.161 4.013 -4.084 1.00 0.00 H new ATOM 1040 N ALA A 74 -6.735 0.854 0.562 1.00 0.00 N ATOM 1041 CA ALA A 74 -7.750 0.339 1.485 1.00 0.00 C ATOM 1042 C ALA A 74 -7.164 -0.487 2.650 1.00 0.00 C ATOM 1043 O ALA A 74 -7.516 -0.235 3.805 1.00 0.00 O ATOM 1044 CB ALA A 74 -8.773 -0.461 0.673 1.00 0.00 C ATOM 0 H ALA A 74 -6.787 0.441 -0.369 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.235 1.186 1.971 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.540 -0.855 1.340 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.237 0.189 -0.069 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.272 -1.287 0.169 1.00 0.00 H new ATOM 1050 N LEU A 75 -6.260 -1.443 2.383 1.00 0.00 N ATOM 1051 CA LEU A 75 -5.638 -2.265 3.433 1.00 0.00 C ATOM 1052 C LEU A 75 -4.775 -1.406 4.369 1.00 0.00 C ATOM 1053 O LEU A 75 -4.836 -1.566 5.591 1.00 0.00 O ATOM 1054 CB LEU A 75 -4.889 -3.476 2.814 1.00 0.00 C ATOM 1055 CG LEU A 75 -3.485 -3.216 2.225 1.00 0.00 C ATOM 1056 CD1 LEU A 75 -2.363 -3.433 3.241 1.00 0.00 C ATOM 1057 CD2 LEU A 75 -3.199 -4.163 1.065 1.00 0.00 C ATOM 0 H LEU A 75 -5.942 -1.667 1.440 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.419 -2.689 4.064 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.795 -4.243 3.583 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.515 -3.891 2.024 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.499 -2.174 1.906 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.401 -3.235 2.768 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.499 -2.756 4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.388 -4.463 3.596 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.205 -3.961 0.667 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.246 -5.194 1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.941 -4.013 0.281 1.00 0.00 H new ATOM 1069 N ALA A 76 -4.033 -0.439 3.811 1.00 0.00 N ATOM 1070 CA ALA A 76 -3.183 0.479 4.554 1.00 0.00 C ATOM 1071 C ALA A 76 -3.991 1.407 5.482 1.00 0.00 C ATOM 1072 O ALA A 76 -3.623 1.570 6.648 1.00 0.00 O ATOM 1073 CB ALA A 76 -2.330 1.268 3.561 1.00 0.00 C ATOM 0 H ALA A 76 -4.013 -0.276 2.804 1.00 0.00 H new ATOM 0 HA ALA A 76 -2.533 -0.097 5.213 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.687 1.961 4.104 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.714 0.579 2.982 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -2.979 1.827 2.888 1.00 0.00 H new ATOM 1079 N LEU A 77 -5.103 1.992 5.004 1.00 0.00 N ATOM 1080 CA LEU A 77 -5.962 2.868 5.812 1.00 0.00 C ATOM 1081 C LEU A 77 -6.538 2.111 7.020 1.00 0.00 C ATOM 1082 O LEU A 77 -6.429 2.586 8.152 1.00 0.00 O ATOM 1083 CB LEU A 77 -7.044 3.477 4.893 1.00 0.00 C ATOM 1084 CG LEU A 77 -7.939 4.607 5.458 1.00 0.00 C ATOM 1085 CD1 LEU A 77 -8.959 4.150 6.503 1.00 0.00 C ATOM 1086 CD2 LEU A 77 -7.126 5.775 6.018 1.00 0.00 C ATOM 0 H LEU A 77 -5.430 1.869 4.046 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.383 3.688 6.236 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.546 3.862 4.003 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.697 2.667 4.568 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.502 4.944 4.588 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.541 5.007 6.842 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.626 3.410 6.061 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -8.437 3.707 7.351 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.803 6.539 6.401 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.486 5.419 6.826 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.509 6.201 5.227 1.00 0.00 H new ATOM 1098 N LYS A 78 -7.065 0.893 6.806 1.00 0.00 N ATOM 1099 CA LYS A 78 -7.614 0.046 7.878 1.00 0.00 C ATOM 1100 C LYS A 78 -6.569 -0.309 8.943 1.00 0.00 C ATOM 1101 O LYS A 78 -6.820 -0.100 10.132 1.00 0.00 O ATOM 1102 CB LYS A 78 -8.249 -1.220 7.281 1.00 0.00 C ATOM 1103 CG LYS A 78 -9.559 -0.912 6.545 1.00 0.00 C ATOM 1104 CD LYS A 78 -10.180 -2.193 5.968 1.00 0.00 C ATOM 1105 CE LYS A 78 -11.461 -1.917 5.165 1.00 0.00 C ATOM 1106 NZ LYS A 78 -12.595 -1.490 6.026 1.00 0.00 N1+ ATOM 0 H LYS A 78 -7.122 0.467 5.881 1.00 0.00 H new ATOM 0 HA LYS A 78 -8.386 0.624 8.386 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.546 -1.687 6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.441 -1.940 8.077 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -10.263 -0.439 7.230 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.370 -0.201 5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -9.452 -2.688 5.325 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -10.407 -2.881 6.782 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.261 -1.143 4.424 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -11.744 -2.817 4.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -13.433 -1.317 5.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.807 -2.238 6.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.339 -0.616 6.529 1.00 0.00 H new ATOM 1120 N LEU A 79 -5.387 -0.792 8.548 1.00 0.00 N ATOM 1121 CA LEU A 79 -4.339 -1.178 9.508 1.00 0.00 C ATOM 1122 C LEU A 79 -3.675 0.027 10.205 1.00 0.00 C ATOM 1123 O LEU A 79 -3.193 -0.119 11.334 1.00 0.00 O ATOM 1124 CB LEU A 79 -3.344 -2.170 8.872 1.00 0.00 C ATOM 1125 CG LEU A 79 -2.386 -1.639 7.792 1.00 0.00 C ATOM 1126 CD1 LEU A 79 -1.150 -0.933 8.350 1.00 0.00 C ATOM 1127 CD2 LEU A 79 -1.886 -2.805 6.938 1.00 0.00 C ATOM 0 H LEU A 79 -5.128 -0.926 7.571 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.825 -1.712 10.325 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.741 -2.597 9.673 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.919 -2.987 8.436 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.963 -0.912 7.220 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.525 -0.588 7.526 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.460 -0.079 8.953 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.583 -1.628 8.969 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.207 -2.430 6.172 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.360 -3.520 7.571 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.734 -3.297 6.462 1.00 0.00 H new ATOM 1139 N LYS A 80 -3.693 1.221 9.590 1.00 0.00 N ATOM 1140 CA LYS A 80 -3.252 2.488 10.202 1.00 0.00 C ATOM 1141 C LYS A 80 -4.263 3.030 11.223 1.00 0.00 C ATOM 1142 O LYS A 80 -3.875 3.508 12.288 1.00 0.00 O ATOM 1143 CB LYS A 80 -2.979 3.514 9.086 1.00 0.00 C ATOM 1144 CG LYS A 80 -2.389 4.855 9.565 1.00 0.00 C ATOM 1145 CD LYS A 80 -0.999 4.698 10.211 1.00 0.00 C ATOM 1146 CE LYS A 80 -0.423 6.077 10.539 1.00 0.00 C ATOM 1147 NZ LYS A 80 0.937 5.963 11.123 1.00 0.00 N1+ ATOM 0 H LYS A 80 -4.022 1.336 8.631 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.335 2.300 10.760 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.294 3.070 8.364 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -3.912 3.712 8.559 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.316 5.538 8.719 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -3.070 5.310 10.284 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -1.075 4.100 11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.331 4.166 9.534 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.384 6.683 9.634 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.081 6.592 11.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 1.304 6.912 11.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.893 5.404 11.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.568 5.492 10.444 1.00 0.00 H new ATOM 1161 N GLN A 81 -5.557 2.896 10.941 1.00 0.00 N ATOM 1162 CA GLN A 81 -6.648 3.386 11.793 1.00 0.00 C ATOM 1163 C GLN A 81 -6.738 2.643 13.133 1.00 0.00 C ATOM 1164 O GLN A 81 -7.015 3.247 14.168 1.00 0.00 O ATOM 1165 CB GLN A 81 -7.955 3.297 10.987 1.00 0.00 C ATOM 1166 CG GLN A 81 -9.190 3.792 11.763 1.00 0.00 C ATOM 1167 CD GLN A 81 -10.359 4.140 10.840 1.00 0.00 C ATOM 1168 OE1 GLN A 81 -10.968 5.202 10.939 1.00 0.00 O ATOM 1169 NE2 GLN A 81 -10.716 3.292 9.897 1.00 0.00 N ATOM 0 H GLN A 81 -5.888 2.433 10.094 1.00 0.00 H new ATOM 0 HA GLN A 81 -6.452 4.423 12.067 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -7.850 3.883 10.074 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -8.116 2.262 10.685 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -9.504 3.023 12.469 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -8.919 4.670 12.349 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -10.224 2.404 9.797 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -11.484 3.523 9.267 1.00 0.00 H new ATOM 1178 N GLN A 82 -6.466 1.332 13.131 1.00 0.00 N ATOM 1179 CA GLN A 82 -6.477 0.488 14.330 1.00 0.00 C ATOM 1180 C GLN A 82 -5.171 0.551 15.154 1.00 0.00 C ATOM 1181 O GLN A 82 -5.234 0.407 16.373 1.00 0.00 O ATOM 1182 CB GLN A 82 -6.875 -0.946 13.944 1.00 0.00 C ATOM 1183 CG GLN A 82 -5.864 -1.685 13.049 1.00 0.00 C ATOM 1184 CD GLN A 82 -4.731 -2.371 13.816 1.00 0.00 C ATOM 1185 OE1 GLN A 82 -4.916 -3.011 14.847 1.00 0.00 O ATOM 1186 NE2 GLN A 82 -3.509 -2.279 13.344 1.00 0.00 N ATOM 0 H GLN A 82 -6.228 0.820 12.281 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.230 0.889 15.009 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -7.020 -1.524 14.856 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -7.836 -0.914 13.431 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -6.395 -2.434 12.462 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -5.432 -0.974 12.344 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -3.331 -1.752 12.489 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -2.738 -2.734 13.833 1.00 0.00 H new ATOM 1403 N GLU B 111 8.661 6.782 8.304 1.00 0.00 N ATOM 1404 CA GLU B 111 8.666 5.839 7.182 1.00 0.00 C ATOM 1405 C GLU B 111 8.295 6.538 5.864 1.00 0.00 C ATOM 1406 O GLU B 111 8.949 6.324 4.843 1.00 0.00 O ATOM 1407 CB GLU B 111 7.683 4.679 7.457 1.00 0.00 C ATOM 1408 CG GLU B 111 7.884 3.947 8.797 1.00 0.00 C ATOM 1409 CD GLU B 111 7.010 4.485 9.953 1.00 0.00 C ATOM 1410 OE1 GLU B 111 6.847 5.722 10.107 1.00 0.00 O ATOM 1411 OE2 GLU B 111 6.483 3.663 10.735 1.00 0.00 O1- ATOM 0 HA GLU B 111 9.676 5.441 7.083 1.00 0.00 H new ATOM 0 HB2 GLU B 111 6.667 5.071 7.426 1.00 0.00 H new ATOM 0 HB3 GLU B 111 7.769 3.953 6.649 1.00 0.00 H new ATOM 0 HG2 GLU B 111 7.667 2.888 8.655 1.00 0.00 H new ATOM 0 HG3 GLU B 111 8.933 4.022 9.085 1.00 0.00 H new ATOM 1418 N LEU B 112 7.298 7.429 5.888 1.00 0.00 N ATOM 1419 CA LEU B 112 6.881 8.227 4.733 1.00 0.00 C ATOM 1420 C LEU B 112 7.987 9.203 4.289 1.00 0.00 C ATOM 1421 O LEU B 112 8.269 9.314 3.094 1.00 0.00 O ATOM 1422 CB LEU B 112 5.584 8.991 5.056 1.00 0.00 C ATOM 1423 CG LEU B 112 4.279 8.179 5.197 1.00 0.00 C ATOM 1424 CD1 LEU B 112 3.971 7.338 3.961 1.00 0.00 C ATOM 1425 CD2 LEU B 112 4.229 7.267 6.422 1.00 0.00 C ATOM 0 H LEU B 112 6.749 7.618 6.727 1.00 0.00 H new ATOM 0 HA LEU B 112 6.694 7.544 3.904 1.00 0.00 H new ATOM 0 HB2 LEU B 112 5.741 9.535 5.987 1.00 0.00 H new ATOM 0 HB3 LEU B 112 5.431 9.735 4.274 1.00 0.00 H new ATOM 0 HG LEU B 112 3.520 8.951 5.321 1.00 0.00 H new ATOM 0 HD11 LEU B 112 3.043 6.789 4.117 1.00 0.00 H new ATOM 0 HD12 LEU B 112 3.866 7.990 3.094 1.00 0.00 H new ATOM 0 HD13 LEU B 112 4.785 6.634 3.788 1.00 0.00 H new ATOM 0 HD21 LEU B 112 3.278 6.735 6.441 1.00 0.00 H new ATOM 0 HD22 LEU B 112 5.046 6.547 6.373 1.00 0.00 H new ATOM 0 HD23 LEU B 112 4.328 7.867 7.327 1.00 0.00 H new ATOM 1437 N SER B 113 8.649 9.871 5.240 1.00 0.00 N ATOM 1438 CA SER B 113 9.786 10.763 4.981 1.00 0.00 C ATOM 1439 C SER B 113 10.973 10.016 4.357 1.00 0.00 C ATOM 1440 O SER B 113 11.579 10.499 3.397 1.00 0.00 O ATOM 1441 CB SER B 113 10.198 11.445 6.293 1.00 0.00 C ATOM 1442 OG SER B 113 11.268 12.358 6.086 1.00 0.00 O ATOM 0 H SER B 113 8.406 9.806 6.229 1.00 0.00 H new ATOM 0 HA SER B 113 9.476 11.516 4.257 1.00 0.00 H new ATOM 0 HB2 SER B 113 9.343 11.973 6.715 1.00 0.00 H new ATOM 0 HB3 SER B 113 10.497 10.690 7.020 1.00 0.00 H new ATOM 0 HG SER B 113 11.509 12.779 6.938 1.00 0.00 H new ATOM 1448 N GLU B 114 11.279 8.808 4.842 1.00 0.00 N ATOM 1449 CA GLU B 114 12.361 7.965 4.312 1.00 0.00 C ATOM 1450 C GLU B 114 12.061 7.451 2.888 1.00 0.00 C ATOM 1451 O GLU B 114 12.900 7.606 2.000 1.00 0.00 O ATOM 1452 CB GLU B 114 12.642 6.820 5.300 1.00 0.00 C ATOM 1453 CG GLU B 114 13.775 5.901 4.826 1.00 0.00 C ATOM 1454 CD GLU B 114 14.389 5.094 5.988 1.00 0.00 C ATOM 1455 OE1 GLU B 114 15.041 5.685 6.882 1.00 0.00 O ATOM 1456 OE2 GLU B 114 14.256 3.846 5.991 1.00 0.00 O1- ATOM 0 H GLU B 114 10.778 8.382 5.622 1.00 0.00 H new ATOM 0 HA GLU B 114 13.261 8.572 4.216 1.00 0.00 H new ATOM 0 HB2 GLU B 114 12.901 7.239 6.273 1.00 0.00 H new ATOM 0 HB3 GLU B 114 11.735 6.232 5.437 1.00 0.00 H new ATOM 0 HG2 GLU B 114 13.393 5.215 4.070 1.00 0.00 H new ATOM 0 HG3 GLU B 114 14.552 6.499 4.350 1.00 0.00 H new ATOM 1463 N ILE B 115 10.861 6.910 2.648 1.00 0.00 N ATOM 1464 CA ILE B 115 10.416 6.398 1.334 1.00 0.00 C ATOM 1465 C ILE B 115 10.309 7.502 0.260 1.00 0.00 C ATOM 1466 O ILE B 115 10.530 7.235 -0.924 1.00 0.00 O ATOM 1467 CB ILE B 115 9.097 5.608 1.518 1.00 0.00 C ATOM 1468 CG1 ILE B 115 9.316 4.289 2.303 1.00 0.00 C ATOM 1469 CG2 ILE B 115 8.398 5.280 0.188 1.00 0.00 C ATOM 1470 CD1 ILE B 115 10.390 3.350 1.748 1.00 0.00 C ATOM 0 H ILE B 115 10.152 6.811 3.374 1.00 0.00 H new ATOM 0 HA ILE B 115 11.179 5.720 0.951 1.00 0.00 H new ATOM 0 HB ILE B 115 8.451 6.273 2.091 1.00 0.00 H new ATOM 0 HG12 ILE B 115 9.577 4.540 3.331 1.00 0.00 H new ATOM 0 HG13 ILE B 115 8.370 3.748 2.337 1.00 0.00 H new ATOM 0 HG21 ILE B 115 7.480 4.726 0.386 1.00 0.00 H new ATOM 0 HG22 ILE B 115 8.157 6.206 -0.334 1.00 0.00 H new ATOM 0 HG23 ILE B 115 9.060 4.675 -0.432 1.00 0.00 H new ATOM 0 HD11 ILE B 115 10.456 2.461 2.376 1.00 0.00 H new ATOM 0 HD12 ILE B 115 10.127 3.057 0.731 1.00 0.00 H new ATOM 0 HD13 ILE B 115 11.352 3.862 1.741 1.00 0.00 H new ATOM 1482 N GLU B 116 10.017 8.745 0.645 1.00 0.00 N ATOM 1483 CA GLU B 116 10.071 9.907 -0.262 1.00 0.00 C ATOM 1484 C GLU B 116 11.496 10.438 -0.508 1.00 0.00 C ATOM 1485 O GLU B 116 11.736 11.103 -1.523 1.00 0.00 O ATOM 1486 CB GLU B 116 9.171 11.028 0.278 1.00 0.00 C ATOM 1487 CG GLU B 116 7.679 10.692 0.130 1.00 0.00 C ATOM 1488 CD GLU B 116 6.759 11.715 0.827 1.00 0.00 C ATOM 1489 OE1 GLU B 116 7.134 12.906 0.964 1.00 0.00 O ATOM 1490 OE2 GLU B 116 5.631 11.334 1.227 1.00 0.00 O1- ATOM 0 H GLU B 116 9.735 8.982 1.596 1.00 0.00 H new ATOM 0 HA GLU B 116 9.708 9.563 -1.230 1.00 0.00 H new ATOM 0 HB2 GLU B 116 9.401 11.202 1.329 1.00 0.00 H new ATOM 0 HB3 GLU B 116 9.388 11.955 -0.253 1.00 0.00 H new ATOM 0 HG2 GLU B 116 7.426 10.646 -0.929 1.00 0.00 H new ATOM 0 HG3 GLU B 116 7.492 9.702 0.545 1.00 0.00 H new ATOM 1497 N GLY B 117 12.451 10.163 0.392 1.00 0.00 N ATOM 1498 CA GLY B 117 13.847 10.620 0.299 1.00 0.00 C ATOM 1499 C GLY B 117 14.752 9.715 -0.556 1.00 0.00 C ATOM 1500 O GLY B 117 15.622 10.217 -1.274 1.00 0.00 O ATOM 0 H GLY B 117 12.271 9.603 1.225 1.00 0.00 H new ATOM 0 HA2 GLY B 117 13.861 11.627 -0.118 1.00 0.00 H new ATOM 0 HA3 GLY B 117 14.264 10.686 1.304 1.00 0.00 H new ATOM 1504 N LEU B 118 14.539 8.395 -0.505 1.00 0.00 N ATOM 1505 CA LEU B 118 15.264 7.386 -1.295 1.00 0.00 C ATOM 1506 C LEU B 118 14.829 7.334 -2.776 1.00 0.00 C ATOM 1507 O LEU B 118 13.910 8.048 -3.195 1.00 0.00 O ATOM 1508 CB LEU B 118 15.180 6.035 -0.552 1.00 0.00 C ATOM 1509 CG LEU B 118 13.797 5.386 -0.375 1.00 0.00 C ATOM 1510 CD1 LEU B 118 13.164 4.839 -1.654 1.00 0.00 C ATOM 1511 CD2 LEU B 118 13.939 4.209 0.595 1.00 0.00 C ATOM 0 H LEU B 118 13.834 7.983 0.107 1.00 0.00 H new ATOM 0 HA LEU B 118 16.314 7.669 -1.370 1.00 0.00 H new ATOM 0 HB2 LEU B 118 15.816 5.325 -1.081 1.00 0.00 H new ATOM 0 HB3 LEU B 118 15.612 6.173 0.439 1.00 0.00 H new ATOM 0 HG LEU B 118 13.144 6.181 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU B 118 12.192 4.403 -1.421 1.00 0.00 H new ATOM 0 HD12 LEU B 118 13.036 5.649 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU B 118 13.812 4.074 -2.082 1.00 0.00 H new ATOM 0 HD21 LEU B 118 12.968 3.734 0.735 1.00 0.00 H new ATOM 0 HD22 LEU B 118 14.643 3.484 0.186 1.00 0.00 H new ATOM 0 HD23 LEU B 118 14.307 4.571 1.555 1.00 0.00 H new ATOM 1523 N GLN B 119 15.499 6.494 -3.578 1.00 0.00 N ATOM 1524 CA GLN B 119 15.238 6.312 -5.018 1.00 0.00 C ATOM 1525 C GLN B 119 14.966 4.846 -5.413 1.00 0.00 C ATOM 1526 O GLN B 119 15.080 3.933 -4.589 1.00 0.00 O ATOM 1527 CB GLN B 119 16.360 6.971 -5.846 1.00 0.00 C ATOM 1528 CG GLN B 119 17.744 6.303 -5.730 1.00 0.00 C ATOM 1529 CD GLN B 119 18.757 7.244 -5.090 1.00 0.00 C ATOM 1530 OE1 GLN B 119 19.454 8.007 -5.748 1.00 0.00 O ATOM 1531 NE2 GLN B 119 18.860 7.231 -3.781 1.00 0.00 N ATOM 0 H GLN B 119 16.259 5.905 -3.236 1.00 0.00 H new ATOM 0 HA GLN B 119 14.305 6.824 -5.253 1.00 0.00 H new ATOM 0 HB2 GLN B 119 16.062 6.972 -6.895 1.00 0.00 H new ATOM 0 HB3 GLN B 119 16.451 8.013 -5.539 1.00 0.00 H new ATOM 0 HG2 GLN B 119 17.663 5.393 -5.136 1.00 0.00 H new ATOM 0 HG3 GLN B 119 18.092 6.008 -6.720 1.00 0.00 H new ATOM 0 HE21 GLN B 119 18.281 6.597 -3.230 1.00 0.00 H new ATOM 0 HE22 GLN B 119 19.519 7.855 -3.315 1.00 0.00 H new ATOM 1540 N ASP B 120 14.607 4.613 -6.678 1.00 0.00 N ATOM 1541 CA ASP B 120 14.149 3.304 -7.181 1.00 0.00 C ATOM 1542 C ASP B 120 15.182 2.168 -7.011 1.00 0.00 C ATOM 1543 O ASP B 120 14.807 1.010 -6.823 1.00 0.00 O ATOM 1544 CB ASP B 120 13.754 3.405 -8.664 1.00 0.00 C ATOM 1545 CG ASP B 120 12.633 4.415 -8.987 1.00 0.00 C ATOM 1546 OD1 ASP B 120 11.916 4.889 -8.071 1.00 0.00 O ATOM 1547 OD2 ASP B 120 12.448 4.730 -10.187 1.00 0.00 O1- ATOM 0 H ASP B 120 14.625 5.336 -7.397 1.00 0.00 H new ATOM 0 HA ASP B 120 13.286 3.044 -6.568 1.00 0.00 H new ATOM 0 HB2 ASP B 120 14.639 3.675 -9.240 1.00 0.00 H new ATOM 0 HB3 ASP B 120 13.440 2.419 -9.006 1.00 0.00 H new ATOM 1552 N ASP B 121 16.477 2.490 -7.022 1.00 0.00 N ATOM 1553 CA ASP B 121 17.567 1.548 -6.724 1.00 0.00 C ATOM 1554 C ASP B 121 17.541 1.041 -5.264 1.00 0.00 C ATOM 1555 O ASP B 121 17.829 -0.127 -4.993 1.00 0.00 O ATOM 1556 CB ASP B 121 18.903 2.251 -7.017 1.00 0.00 C ATOM 1557 CG ASP B 121 20.125 1.314 -6.952 1.00 0.00 C ATOM 1558 OD1 ASP B 121 21.213 1.772 -6.525 1.00 0.00 O ATOM 1559 OD2 ASP B 121 20.032 0.134 -7.379 1.00 0.00 O1- ATOM 0 H ASP B 121 16.808 3.430 -7.242 1.00 0.00 H new ATOM 0 HA ASP B 121 17.440 0.668 -7.355 1.00 0.00 H new ATOM 0 HB2 ASP B 121 18.856 2.703 -8.008 1.00 0.00 H new ATOM 0 HB3 ASP B 121 19.040 3.063 -6.302 1.00 0.00 H new ATOM 1564 N ASP B 122 17.136 1.898 -4.319 1.00 0.00 N ATOM 1565 CA ASP B 122 16.937 1.534 -2.907 1.00 0.00 C ATOM 1566 C ASP B 122 15.646 0.719 -2.700 1.00 0.00 C ATOM 1567 O ASP B 122 15.643 -0.232 -1.917 1.00 0.00 O ATOM 1568 CB ASP B 122 16.909 2.788 -2.023 1.00 0.00 C ATOM 1569 CG ASP B 122 18.069 3.758 -2.289 1.00 0.00 C ATOM 1570 OD1 ASP B 122 19.248 3.345 -2.196 1.00 0.00 O ATOM 1571 OD2 ASP B 122 17.805 4.953 -2.566 1.00 0.00 O1- ATOM 0 H ASP B 122 16.934 2.878 -4.514 1.00 0.00 H new ATOM 0 HA ASP B 122 17.780 0.908 -2.616 1.00 0.00 H new ATOM 0 HB2 ASP B 122 15.966 3.312 -2.181 1.00 0.00 H new ATOM 0 HB3 ASP B 122 16.934 2.484 -0.976 1.00 0.00 H new ATOM 1576 N LEU B 123 14.570 1.038 -3.443 1.00 0.00 N ATOM 1577 CA LEU B 123 13.344 0.231 -3.463 1.00 0.00 C ATOM 1578 C LEU B 123 13.639 -1.190 -3.959 1.00 0.00 C ATOM 1579 O LEU B 123 13.280 -2.158 -3.292 1.00 0.00 O ATOM 1580 CB LEU B 123 12.246 0.890 -4.323 1.00 0.00 C ATOM 1581 CG LEU B 123 11.723 2.239 -3.791 1.00 0.00 C ATOM 1582 CD1 LEU B 123 10.748 2.881 -4.780 1.00 0.00 C ATOM 1583 CD2 LEU B 123 10.963 2.068 -2.471 1.00 0.00 C ATOM 0 H LEU B 123 14.530 1.861 -4.044 1.00 0.00 H new ATOM 0 HA LEU B 123 12.972 0.171 -2.440 1.00 0.00 H new ATOM 0 HB2 LEU B 123 12.636 1.040 -5.330 1.00 0.00 H new ATOM 0 HB3 LEU B 123 11.407 0.199 -4.406 1.00 0.00 H new ATOM 0 HG LEU B 123 12.602 2.867 -3.647 1.00 0.00 H new ATOM 0 HD11 LEU B 123 10.395 3.831 -4.379 1.00 0.00 H new ATOM 0 HD12 LEU B 123 11.254 3.054 -5.730 1.00 0.00 H new ATOM 0 HD13 LEU B 123 9.899 2.216 -4.937 1.00 0.00 H new ATOM 0 HD21 LEU B 123 10.609 3.040 -2.126 1.00 0.00 H new ATOM 0 HD22 LEU B 123 10.111 1.405 -2.625 1.00 0.00 H new ATOM 0 HD23 LEU B 123 11.627 1.637 -1.722 1.00 0.00 H new ATOM 1595 N ALA B 124 14.369 -1.334 -5.070 1.00 0.00 N ATOM 1596 CA ALA B 124 14.782 -2.634 -5.597 1.00 0.00 C ATOM 1597 C ALA B 124 15.668 -3.431 -4.620 1.00 0.00 C ATOM 1598 O ALA B 124 15.518 -4.646 -4.525 1.00 0.00 O ATOM 1599 CB ALA B 124 15.484 -2.413 -6.942 1.00 0.00 C ATOM 0 H ALA B 124 14.691 -0.545 -5.631 1.00 0.00 H new ATOM 0 HA ALA B 124 13.891 -3.247 -5.736 1.00 0.00 H new ATOM 0 HB1 ALA B 124 15.799 -3.373 -7.350 1.00 0.00 H new ATOM 0 HB2 ALA B 124 14.796 -1.932 -7.637 1.00 0.00 H new ATOM 0 HB3 ALA B 124 16.357 -1.777 -6.797 1.00 0.00 H new ATOM 1605 N ALA B 125 16.524 -2.757 -3.843 1.00 0.00 N ATOM 1606 CA ALA B 125 17.364 -3.396 -2.827 1.00 0.00 C ATOM 1607 C ALA B 125 16.578 -3.985 -1.633 1.00 0.00 C ATOM 1608 O ALA B 125 17.052 -4.948 -1.026 1.00 0.00 O ATOM 1609 CB ALA B 125 18.413 -2.377 -2.359 1.00 0.00 C ATOM 0 H ALA B 125 16.653 -1.747 -3.903 1.00 0.00 H new ATOM 0 HA ALA B 125 17.843 -4.260 -3.288 1.00 0.00 H new ATOM 0 HB1 ALA B 125 19.050 -2.833 -1.601 1.00 0.00 H new ATOM 0 HB2 ALA B 125 19.023 -2.067 -3.207 1.00 0.00 H new ATOM 0 HB3 ALA B 125 17.911 -1.507 -1.936 1.00 0.00 H new ATOM 1615 N LEU B 126 15.386 -3.452 -1.305 1.00 0.00 N ATOM 1616 CA LEU B 126 14.562 -3.909 -0.163 1.00 0.00 C ATOM 1617 C LEU B 126 13.328 -4.744 -0.578 1.00 0.00 C ATOM 1618 O LEU B 126 12.914 -5.620 0.184 1.00 0.00 O ATOM 1619 CB LEU B 126 14.275 -2.713 0.776 1.00 0.00 C ATOM 1620 CG LEU B 126 13.063 -1.826 0.431 1.00 0.00 C ATOM 1621 CD1 LEU B 126 11.819 -2.255 1.212 1.00 0.00 C ATOM 1622 CD2 LEU B 126 13.326 -0.365 0.805 1.00 0.00 C ATOM 0 H LEU B 126 14.962 -2.686 -1.828 1.00 0.00 H new ATOM 0 HA LEU B 126 15.133 -4.634 0.416 1.00 0.00 H new ATOM 0 HB2 LEU B 126 14.134 -3.101 1.785 1.00 0.00 H new ATOM 0 HB3 LEU B 126 15.162 -2.080 0.799 1.00 0.00 H new ATOM 0 HG LEU B 126 12.904 -1.934 -0.642 1.00 0.00 H new ATOM 0 HD11 LEU B 126 10.982 -1.610 0.946 1.00 0.00 H new ATOM 0 HD12 LEU B 126 11.573 -3.288 0.966 1.00 0.00 H new ATOM 0 HD13 LEU B 126 12.015 -2.173 2.281 1.00 0.00 H new ATOM 0 HD21 LEU B 126 12.455 0.238 0.551 1.00 0.00 H new ATOM 0 HD22 LEU B 126 13.518 -0.292 1.876 1.00 0.00 H new ATOM 0 HD23 LEU B 126 14.193 0.001 0.255 1.00 0.00 H new ATOM 1634 N LEU B 127 12.768 -4.534 -1.775 1.00 0.00 N ATOM 1635 CA LEU B 127 11.708 -5.372 -2.369 1.00 0.00 C ATOM 1636 C LEU B 127 12.258 -6.674 -2.975 1.00 0.00 C ATOM 1637 O LEU B 127 11.626 -7.728 -2.856 1.00 0.00 O ATOM 1638 CB LEU B 127 10.967 -4.571 -3.461 1.00 0.00 C ATOM 1639 CG LEU B 127 9.782 -3.716 -2.981 1.00 0.00 C ATOM 1640 CD1 LEU B 127 10.060 -2.826 -1.773 1.00 0.00 C ATOM 1641 CD2 LEU B 127 9.312 -2.798 -4.110 1.00 0.00 C ATOM 0 H LEU B 127 13.043 -3.758 -2.377 1.00 0.00 H new ATOM 0 HA LEU B 127 11.024 -5.648 -1.566 1.00 0.00 H new ATOM 0 HB2 LEU B 127 11.685 -3.917 -3.955 1.00 0.00 H new ATOM 0 HB3 LEU B 127 10.604 -5.271 -4.214 1.00 0.00 H new ATOM 0 HG LEU B 127 9.031 -4.446 -2.680 1.00 0.00 H new ATOM 0 HD11 LEU B 127 9.160 -2.267 -1.518 1.00 0.00 H new ATOM 0 HD12 LEU B 127 10.355 -3.445 -0.926 1.00 0.00 H new ATOM 0 HD13 LEU B 127 10.864 -2.130 -2.011 1.00 0.00 H new ATOM 0 HD21 LEU B 127 8.473 -2.195 -3.763 1.00 0.00 H new ATOM 0 HD22 LEU B 127 10.130 -2.143 -4.410 1.00 0.00 H new ATOM 0 HD23 LEU B 127 8.998 -3.401 -4.962 1.00 0.00 H new ATOM 1653 N GLY B 128 13.427 -6.614 -3.623 1.00 0.00 N ATOM 1654 CA GLY B 128 14.168 -7.773 -4.134 1.00 0.00 C ATOM 1655 C GLY B 128 13.368 -8.601 -5.146 1.00 0.00 C ATOM 1656 O GLY B 128 12.946 -8.090 -6.193 1.00 0.00 O ATOM 0 H GLY B 128 13.898 -5.729 -3.812 1.00 0.00 H new ATOM 0 HA2 GLY B 128 15.090 -7.429 -4.603 1.00 0.00 H new ATOM 0 HA3 GLY B 128 14.455 -8.411 -3.298 1.00 0.00 H new ATOM 1660 N LYS B 129 13.145 -9.884 -4.838 1.00 0.00 N ATOM 1661 CA LYS B 129 12.390 -10.825 -5.691 1.00 0.00 C ATOM 1662 C LYS B 129 10.935 -10.389 -5.938 1.00 0.00 C ATOM 1663 O LYS B 129 10.391 -10.650 -7.012 1.00 0.00 O ATOM 1664 CB LYS B 129 12.405 -12.232 -5.064 1.00 0.00 C ATOM 1665 CG LYS B 129 13.801 -12.832 -4.813 1.00 0.00 C ATOM 1666 CD LYS B 129 14.674 -12.922 -6.079 1.00 0.00 C ATOM 1667 CE LYS B 129 15.975 -13.663 -5.758 1.00 0.00 C ATOM 1668 NZ LYS B 129 16.858 -13.765 -6.948 1.00 0.00 N1+ ATOM 0 H LYS B 129 13.487 -10.310 -3.977 1.00 0.00 H new ATOM 0 HA LYS B 129 12.890 -10.833 -6.660 1.00 0.00 H new ATOM 0 HB2 LYS B 129 11.869 -12.194 -4.115 1.00 0.00 H new ATOM 0 HB3 LYS B 129 11.851 -12.907 -5.716 1.00 0.00 H new ATOM 0 HG2 LYS B 129 14.318 -12.227 -4.068 1.00 0.00 H new ATOM 0 HG3 LYS B 129 13.687 -13.830 -4.390 1.00 0.00 H new ATOM 0 HD2 LYS B 129 14.133 -13.443 -6.869 1.00 0.00 H new ATOM 0 HD3 LYS B 129 14.896 -11.922 -6.451 1.00 0.00 H new ATOM 0 HE2 LYS B 129 16.502 -13.143 -4.958 1.00 0.00 H new ATOM 0 HE3 LYS B 129 15.743 -14.663 -5.390 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 17.729 -14.273 -6.692 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 16.365 -14.283 -7.703 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 17.100 -12.811 -7.284 1.00 0.00 H new ATOM 1682 N GLU B 130 10.327 -9.676 -4.987 1.00 0.00 N ATOM 1683 CA GLU B 130 8.955 -9.151 -5.079 1.00 0.00 C ATOM 1684 C GLU B 130 8.840 -7.748 -5.716 1.00 0.00 C ATOM 1685 O GLU B 130 7.745 -7.181 -5.754 1.00 0.00 O ATOM 1686 CB GLU B 130 8.297 -9.160 -3.687 1.00 0.00 C ATOM 1687 CG GLU B 130 8.286 -10.513 -2.953 1.00 0.00 C ATOM 1688 CD GLU B 130 7.614 -11.669 -3.724 1.00 0.00 C ATOM 1689 OE1 GLU B 130 7.902 -12.845 -3.385 1.00 0.00 O ATOM 1690 OE2 GLU B 130 6.789 -11.436 -4.642 1.00 0.00 O1- ATOM 0 H GLU B 130 10.784 -9.439 -4.107 1.00 0.00 H new ATOM 0 HA GLU B 130 8.427 -9.820 -5.759 1.00 0.00 H new ATOM 0 HB2 GLU B 130 8.812 -8.433 -3.059 1.00 0.00 H new ATOM 0 HB3 GLU B 130 7.267 -8.818 -3.792 1.00 0.00 H new ATOM 0 HG2 GLU B 130 9.315 -10.796 -2.729 1.00 0.00 H new ATOM 0 HG3 GLU B 130 7.775 -10.387 -1.999 1.00 0.00 H new ATOM 1697 N PHE B 131 9.937 -7.168 -6.224 1.00 0.00 N ATOM 1698 CA PHE B 131 9.902 -5.898 -6.972 1.00 0.00 C ATOM 1699 C PHE B 131 9.015 -5.998 -8.233 1.00 0.00 C ATOM 1700 O PHE B 131 8.862 -7.077 -8.814 1.00 0.00 O ATOM 1701 CB PHE B 131 11.339 -5.458 -7.290 1.00 0.00 C ATOM 1702 CG PHE B 131 11.474 -4.085 -7.931 1.00 0.00 C ATOM 1703 CD1 PHE B 131 11.611 -2.929 -7.138 1.00 0.00 C ATOM 1704 CD2 PHE B 131 11.512 -3.963 -9.332 1.00 0.00 C ATOM 1705 CE1 PHE B 131 11.790 -1.665 -7.729 1.00 0.00 C ATOM 1706 CE2 PHE B 131 11.680 -2.699 -9.933 1.00 0.00 C ATOM 1707 CZ PHE B 131 11.818 -1.553 -9.129 1.00 0.00 C ATOM 0 H PHE B 131 10.873 -7.563 -6.130 1.00 0.00 H new ATOM 0 HA PHE B 131 9.439 -5.130 -6.352 1.00 0.00 H new ATOM 0 HB2 PHE B 131 11.917 -5.467 -6.366 1.00 0.00 H new ATOM 0 HB3 PHE B 131 11.788 -6.196 -7.954 1.00 0.00 H new ATOM 0 HD1 PHE B 131 11.578 -3.014 -6.062 1.00 0.00 H new ATOM 0 HD2 PHE B 131 11.412 -4.843 -9.951 1.00 0.00 H new ATOM 0 HE1 PHE B 131 11.905 -0.787 -7.111 1.00 0.00 H new ATOM 0 HE2 PHE B 131 11.703 -2.611 -11.009 1.00 0.00 H new ATOM 0 HZ PHE B 131 11.946 -0.584 -9.589 1.00 0.00 H new ATOM 1717 N ILE B 132 8.400 -4.884 -8.644 1.00 0.00 N ATOM 1718 CA ILE B 132 7.403 -4.864 -9.731 1.00 0.00 C ATOM 1719 C ILE B 132 8.003 -5.295 -11.087 1.00 0.00 C ATOM 1720 O ILE B 132 9.154 -4.977 -11.408 1.00 0.00 O ATOM 1721 CB ILE B 132 6.691 -3.489 -9.787 1.00 0.00 C ATOM 1722 CG1 ILE B 132 5.248 -3.586 -10.332 1.00 0.00 C ATOM 1723 CG2 ILE B 132 7.453 -2.450 -10.627 1.00 0.00 C ATOM 1724 CD1 ILE B 132 4.276 -4.252 -9.349 1.00 0.00 C ATOM 0 H ILE B 132 8.577 -3.967 -8.234 1.00 0.00 H new ATOM 0 HA ILE B 132 6.642 -5.612 -9.508 1.00 0.00 H new ATOM 0 HB ILE B 132 6.665 -3.158 -8.749 1.00 0.00 H new ATOM 0 HG12 ILE B 132 4.887 -2.585 -10.568 1.00 0.00 H new ATOM 0 HG13 ILE B 132 5.256 -4.150 -11.265 1.00 0.00 H new ATOM 0 HG21 ILE B 132 6.904 -1.509 -10.627 1.00 0.00 H new ATOM 0 HG22 ILE B 132 8.443 -2.292 -10.200 1.00 0.00 H new ATOM 0 HG23 ILE B 132 7.553 -2.812 -11.650 1.00 0.00 H new ATOM 0 HD11 ILE B 132 3.280 -4.290 -9.791 1.00 0.00 H new ATOM 0 HD12 ILE B 132 4.615 -5.265 -9.132 1.00 0.00 H new ATOM 0 HD13 ILE B 132 4.241 -3.675 -8.425 1.00 0.00 H new ATOM 1993 N TRP B 156 -5.816 13.466 9.500 1.00 0.00 N ATOM 1994 CA TRP B 156 -4.805 12.419 9.254 1.00 0.00 C ATOM 1995 C TRP B 156 -5.291 11.368 8.243 1.00 0.00 C ATOM 1996 O TRP B 156 -4.481 10.834 7.480 1.00 0.00 O ATOM 1997 CB TRP B 156 -4.395 11.755 10.581 1.00 0.00 C ATOM 1998 CG TRP B 156 -5.441 10.914 11.260 1.00 0.00 C ATOM 1999 CD1 TRP B 156 -6.241 11.330 12.267 1.00 0.00 C ATOM 2000 CD2 TRP B 156 -5.844 9.531 10.978 1.00 0.00 C ATOM 2001 NE1 TRP B 156 -7.121 10.323 12.610 1.00 0.00 N ATOM 2002 CE2 TRP B 156 -6.928 9.197 11.846 1.00 0.00 C ATOM 2003 CE3 TRP B 156 -5.414 8.534 10.072 1.00 0.00 C ATOM 2004 CZ2 TRP B 156 -7.574 7.957 11.794 1.00 0.00 C ATOM 2005 CZ3 TRP B 156 -6.059 7.282 10.010 1.00 0.00 C ATOM 2006 CH2 TRP B 156 -7.143 7.004 10.857 1.00 0.00 C ATOM 0 HA TRP B 156 -3.932 12.901 8.813 1.00 0.00 H new ATOM 0 HB2 TRP B 156 -3.522 11.129 10.394 1.00 0.00 H new ATOM 0 HB3 TRP B 156 -4.084 12.538 11.273 1.00 0.00 H new ATOM 0 HD1 TRP B 156 -6.198 12.303 12.733 1.00 0.00 H new ATOM 0 HE1 TRP B 156 -7.828 10.405 13.341 1.00 0.00 H new ATOM 0 HE3 TRP B 156 -4.579 8.735 9.418 1.00 0.00 H new ATOM 0 HZ2 TRP B 156 -8.392 7.736 12.464 1.00 0.00 H new ATOM 0 HZ3 TRP B 156 -5.718 6.535 9.309 1.00 0.00 H new ATOM 0 HH2 TRP B 156 -7.648 6.052 10.788 1.00 0.00 H new ATOM 2017 N LYS B 157 -6.607 11.110 8.190 1.00 0.00 N ATOM 2018 CA LYS B 157 -7.244 10.180 7.242 1.00 0.00 C ATOM 2019 C LYS B 157 -7.063 10.659 5.806 1.00 0.00 C ATOM 2020 O LYS B 157 -6.557 9.926 4.955 1.00 0.00 O ATOM 2021 CB LYS B 157 -8.743 10.029 7.571 1.00 0.00 C ATOM 2022 CG LYS B 157 -8.991 9.501 8.994 1.00 0.00 C ATOM 2023 CD LYS B 157 -10.482 9.406 9.338 1.00 0.00 C ATOM 2024 CE LYS B 157 -11.142 8.240 8.593 1.00 0.00 C ATOM 2025 NZ LYS B 157 -12.616 8.270 8.759 1.00 0.00 N1+ ATOM 0 H LYS B 157 -7.275 11.553 8.821 1.00 0.00 H new ATOM 0 HA LYS B 157 -6.761 9.208 7.339 1.00 0.00 H new ATOM 0 HB2 LYS B 157 -9.235 10.995 7.456 1.00 0.00 H new ATOM 0 HB3 LYS B 157 -9.202 9.351 6.852 1.00 0.00 H new ATOM 0 HG2 LYS B 157 -8.535 8.516 9.096 1.00 0.00 H new ATOM 0 HG3 LYS B 157 -8.498 10.157 9.712 1.00 0.00 H new ATOM 0 HD2 LYS B 157 -10.603 9.271 10.413 1.00 0.00 H new ATOM 0 HD3 LYS B 157 -10.980 10.339 9.075 1.00 0.00 H new ATOM 0 HE2 LYS B 157 -10.891 8.292 7.534 1.00 0.00 H new ATOM 0 HE3 LYS B 157 -10.749 7.295 8.968 1.00 0.00 H new ATOM 0 HZ1 LYS B 157 -13.040 7.471 8.246 1.00 0.00 H new ATOM 0 HZ2 LYS B 157 -12.853 8.197 9.769 1.00 0.00 H new ATOM 0 HZ3 LYS B 157 -12.990 9.163 8.379 1.00 0.00 H new ATOM 2039 N ASP B 158 -7.436 11.912 5.563 1.00 0.00 N ATOM 2040 CA ASP B 158 -7.269 12.594 4.276 1.00 0.00 C ATOM 2041 C ASP B 158 -5.797 12.719 3.864 1.00 0.00 C ATOM 2042 O ASP B 158 -5.465 12.449 2.711 1.00 0.00 O ATOM 2043 CB ASP B 158 -7.931 13.982 4.331 1.00 0.00 C ATOM 2044 CG ASP B 158 -9.462 13.893 4.246 1.00 0.00 C ATOM 2045 OD1 ASP B 158 -10.152 14.284 5.217 1.00 0.00 O ATOM 2046 OD2 ASP B 158 -9.963 13.463 3.177 1.00 0.00 O1- ATOM 0 H ASP B 158 -7.875 12.500 6.272 1.00 0.00 H new ATOM 0 HA ASP B 158 -7.758 11.984 3.517 1.00 0.00 H new ATOM 0 HB2 ASP B 158 -7.648 14.482 5.257 1.00 0.00 H new ATOM 0 HB3 ASP B 158 -7.557 14.595 3.511 1.00 0.00 H new ATOM 2051 N ASP B 159 -4.906 13.087 4.788 1.00 0.00 N ATOM 2052 CA ASP B 159 -3.470 13.261 4.510 1.00 0.00 C ATOM 2053 C ASP B 159 -2.780 11.939 4.130 1.00 0.00 C ATOM 2054 O ASP B 159 -2.084 11.877 3.112 1.00 0.00 O ATOM 2055 CB ASP B 159 -2.763 13.910 5.711 1.00 0.00 C ATOM 2056 CG ASP B 159 -3.175 15.368 6.005 1.00 0.00 C ATOM 2057 OD1 ASP B 159 -2.841 15.868 7.107 1.00 0.00 O ATOM 2058 OD2 ASP B 159 -3.767 16.048 5.126 1.00 0.00 O1- ATOM 0 H ASP B 159 -5.158 13.275 5.758 1.00 0.00 H new ATOM 0 HA ASP B 159 -3.391 13.923 3.648 1.00 0.00 H new ATOM 0 HB2 ASP B 159 -2.960 13.307 6.598 1.00 0.00 H new ATOM 0 HB3 ASP B 159 -1.687 13.881 5.539 1.00 0.00 H new ATOM 2063 N TYR B 160 -2.993 10.871 4.906 1.00 0.00 N ATOM 2064 CA TYR B 160 -2.396 9.555 4.651 1.00 0.00 C ATOM 2065 C TYR B 160 -2.939 8.919 3.358 1.00 0.00 C ATOM 2066 O TYR B 160 -2.168 8.453 2.517 1.00 0.00 O ATOM 2067 CB TYR B 160 -2.644 8.662 5.871 1.00 0.00 C ATOM 2068 CG TYR B 160 -1.999 7.287 5.812 1.00 0.00 C ATOM 2069 CD1 TYR B 160 -2.806 6.134 5.744 1.00 0.00 C ATOM 2070 CD2 TYR B 160 -0.597 7.163 5.881 1.00 0.00 C ATOM 2071 CE1 TYR B 160 -2.213 4.858 5.771 1.00 0.00 C ATOM 2072 CE2 TYR B 160 -0.003 5.888 5.906 1.00 0.00 C ATOM 2073 CZ TYR B 160 -0.809 4.729 5.862 1.00 0.00 C ATOM 2074 OH TYR B 160 -0.229 3.501 5.933 1.00 0.00 O ATOM 0 H TYR B 160 -3.588 10.895 5.734 1.00 0.00 H new ATOM 0 HA TYR B 160 -1.323 9.670 4.499 1.00 0.00 H new ATOM 0 HB2 TYR B 160 -2.279 9.178 6.759 1.00 0.00 H new ATOM 0 HB3 TYR B 160 -3.719 8.536 5.995 1.00 0.00 H new ATOM 0 HD1 TYR B 160 -3.879 6.229 5.671 1.00 0.00 H new ATOM 0 HD2 TYR B 160 0.022 8.047 5.915 1.00 0.00 H new ATOM 0 HE1 TYR B 160 -2.833 3.975 5.722 1.00 0.00 H new ATOM 0 HE2 TYR B 160 1.072 5.795 5.959 1.00 0.00 H new ATOM 0 HH TYR B 160 0.744 3.602 5.990 1.00 0.00 H new ATOM 2084 N LEU B 161 -4.261 8.966 3.151 1.00 0.00 N ATOM 2085 CA LEU B 161 -4.906 8.407 1.960 1.00 0.00 C ATOM 2086 C LEU B 161 -4.518 9.166 0.678 1.00 0.00 C ATOM 2087 O LEU B 161 -4.257 8.540 -0.349 1.00 0.00 O ATOM 2088 CB LEU B 161 -6.426 8.404 2.190 1.00 0.00 C ATOM 2089 CG LEU B 161 -7.237 7.654 1.122 1.00 0.00 C ATOM 2090 CD1 LEU B 161 -7.000 6.145 1.175 1.00 0.00 C ATOM 2091 CD2 LEU B 161 -8.722 7.924 1.350 1.00 0.00 C ATOM 0 H LEU B 161 -4.914 9.394 3.808 1.00 0.00 H new ATOM 0 HA LEU B 161 -4.559 7.385 1.808 1.00 0.00 H new ATOM 0 HB2 LEU B 161 -6.631 7.957 3.163 1.00 0.00 H new ATOM 0 HB3 LEU B 161 -6.775 9.436 2.233 1.00 0.00 H new ATOM 0 HG LEU B 161 -6.915 8.012 0.144 1.00 0.00 H new ATOM 0 HD11 LEU B 161 -7.594 5.656 0.402 1.00 0.00 H new ATOM 0 HD12 LEU B 161 -5.943 5.937 1.007 1.00 0.00 H new ATOM 0 HD13 LEU B 161 -7.294 5.765 2.153 1.00 0.00 H new ATOM 0 HD21 LEU B 161 -9.308 7.396 0.597 1.00 0.00 H new ATOM 0 HD22 LEU B 161 -9.007 7.574 2.342 1.00 0.00 H new ATOM 0 HD23 LEU B 161 -8.913 8.994 1.274 1.00 0.00 H new ATOM 2103 N SER B 162 -4.408 10.500 0.738 1.00 0.00 N ATOM 2104 CA SER B 162 -3.891 11.325 -0.368 1.00 0.00 C ATOM 2105 C SER B 162 -2.424 11.020 -0.687 1.00 0.00 C ATOM 2106 O SER B 162 -2.079 10.818 -1.853 1.00 0.00 O ATOM 2107 CB SER B 162 -4.058 12.812 -0.043 1.00 0.00 C ATOM 2108 OG SER B 162 -3.525 13.598 -1.096 1.00 0.00 O ATOM 0 H SER B 162 -4.676 11.043 1.559 1.00 0.00 H new ATOM 0 HA SER B 162 -4.475 11.076 -1.254 1.00 0.00 H new ATOM 0 HB2 SER B 162 -5.113 13.046 0.099 1.00 0.00 H new ATOM 0 HB3 SER B 162 -3.550 13.048 0.892 1.00 0.00 H new ATOM 0 HG SER B 162 -3.636 14.548 -0.883 1.00 0.00 H new ATOM 2114 N ARG B 163 -1.560 10.893 0.330 1.00 0.00 N ATOM 2115 CA ARG B 163 -0.143 10.544 0.156 1.00 0.00 C ATOM 2116 C ARG B 163 0.032 9.183 -0.519 1.00 0.00 C ATOM 2117 O ARG B 163 0.775 9.075 -1.497 1.00 0.00 O ATOM 2118 CB ARG B 163 0.545 10.617 1.527 1.00 0.00 C ATOM 2119 CG ARG B 163 2.076 10.515 1.442 1.00 0.00 C ATOM 2120 CD ARG B 163 2.717 10.667 2.830 1.00 0.00 C ATOM 2121 NE ARG B 163 2.428 11.976 3.459 1.00 0.00 N ATOM 2122 CZ ARG B 163 3.031 13.127 3.226 1.00 0.00 C ATOM 2123 NH1 ARG B 163 4.053 13.249 2.432 1.00 0.00 N1+ ATOM 2124 NH2 ARG B 163 2.597 14.211 3.808 1.00 0.00 N ATOM 0 H ARG B 163 -1.827 11.031 1.305 1.00 0.00 H new ATOM 0 HA ARG B 163 0.331 11.258 -0.517 1.00 0.00 H new ATOM 0 HB2 ARG B 163 0.276 11.556 2.012 1.00 0.00 H new ATOM 0 HB3 ARG B 163 0.168 9.813 2.159 1.00 0.00 H new ATOM 0 HG2 ARG B 163 2.356 9.554 1.012 1.00 0.00 H new ATOM 0 HG3 ARG B 163 2.459 11.287 0.774 1.00 0.00 H new ATOM 0 HD2 ARG B 163 2.356 9.870 3.480 1.00 0.00 H new ATOM 0 HD3 ARG B 163 3.796 10.543 2.742 1.00 0.00 H new ATOM 0 HE ARG B 163 1.678 11.990 4.150 1.00 0.00 H new ATOM 0 HH11 ARG B 163 4.427 12.430 1.953 1.00 0.00 H new ATOM 0 HH12 ARG B 163 4.481 14.164 2.288 1.00 0.00 H new ATOM 0 HH21 ARG B 163 1.797 14.166 4.439 1.00 0.00 H new ATOM 0 HH22 ARG B 163 3.058 15.104 3.632 1.00 0.00 H new ATOM 2138 N LEU B 164 -0.708 8.166 -0.080 1.00 0.00 N ATOM 2139 CA LEU B 164 -0.707 6.832 -0.698 1.00 0.00 C ATOM 2140 C LEU B 164 -1.376 6.809 -2.093 1.00 0.00 C ATOM 2141 O LEU B 164 -1.094 5.911 -2.885 1.00 0.00 O ATOM 2142 CB LEU B 164 -1.337 5.806 0.262 1.00 0.00 C ATOM 2143 CG LEU B 164 -0.337 5.170 1.252 1.00 0.00 C ATOM 2144 CD1 LEU B 164 0.381 6.150 2.177 1.00 0.00 C ATOM 2145 CD2 LEU B 164 -1.082 4.157 2.117 1.00 0.00 C ATOM 0 H LEU B 164 -1.333 8.241 0.723 1.00 0.00 H new ATOM 0 HA LEU B 164 0.332 6.553 -0.873 1.00 0.00 H new ATOM 0 HB2 LEU B 164 -2.131 6.294 0.828 1.00 0.00 H new ATOM 0 HB3 LEU B 164 -1.804 5.015 -0.325 1.00 0.00 H new ATOM 0 HG LEU B 164 0.437 4.716 0.634 1.00 0.00 H new ATOM 0 HD11 LEU B 164 1.059 5.602 2.831 1.00 0.00 H new ATOM 0 HD12 LEU B 164 0.949 6.864 1.580 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.352 6.685 2.781 1.00 0.00 H new ATOM 0 HD21 LEU B 164 -0.387 3.700 2.822 1.00 0.00 H new ATOM 0 HD22 LEU B 164 -1.876 4.662 2.667 1.00 0.00 H new ATOM 0 HD23 LEU B 164 -1.515 3.385 1.481 1.00 0.00 H new ATOM 2157 N SER B 165 -2.203 7.795 -2.457 1.00 0.00 N ATOM 2158 CA SER B 165 -2.633 7.986 -3.853 1.00 0.00 C ATOM 2159 C SER B 165 -1.490 8.506 -4.744 1.00 0.00 C ATOM 2160 O SER B 165 -1.288 7.986 -5.845 1.00 0.00 O ATOM 2161 CB SER B 165 -3.869 8.899 -3.917 1.00 0.00 C ATOM 2162 OG SER B 165 -4.310 9.081 -5.253 1.00 0.00 O ATOM 0 H SER B 165 -2.591 8.477 -1.805 1.00 0.00 H new ATOM 0 HA SER B 165 -2.913 7.011 -4.251 1.00 0.00 H new ATOM 0 HB2 SER B 165 -4.674 8.467 -3.322 1.00 0.00 H new ATOM 0 HB3 SER B 165 -3.631 9.867 -3.476 1.00 0.00 H new ATOM 0 HG SER B 165 -5.097 9.664 -5.261 1.00 0.00 H new ATOM 2168 N ARG B 166 -0.674 9.463 -4.265 1.00 0.00 N ATOM 2169 CA ARG B 166 0.415 10.090 -5.047 1.00 0.00 C ATOM 2170 C ARG B 166 1.692 9.232 -5.171 1.00 0.00 C ATOM 2171 O ARG B 166 2.331 9.265 -6.223 1.00 0.00 O ATOM 2172 CB ARG B 166 0.751 11.489 -4.481 1.00 0.00 C ATOM 2173 CG ARG B 166 -0.185 12.602 -4.986 1.00 0.00 C ATOM 2174 CD ARG B 166 -1.546 12.623 -4.284 1.00 0.00 C ATOM 2175 NE ARG B 166 -2.553 13.417 -5.018 1.00 0.00 N ATOM 2176 CZ ARG B 166 -3.859 13.299 -4.864 1.00 0.00 C ATOM 2177 NH1 ARG B 166 -4.354 12.680 -3.832 1.00 0.00 N1+ ATOM 2178 NH2 ARG B 166 -4.688 13.790 -5.735 1.00 0.00 N ATOM 0 H ARG B 166 -0.750 9.828 -3.316 1.00 0.00 H new ATOM 0 HA ARG B 166 0.030 10.183 -6.062 1.00 0.00 H new ATOM 0 HB2 ARG B 166 0.703 11.452 -3.393 1.00 0.00 H new ATOM 0 HB3 ARG B 166 1.778 11.742 -4.746 1.00 0.00 H new ATOM 0 HG2 ARG B 166 0.302 13.567 -4.845 1.00 0.00 H new ATOM 0 HG3 ARG B 166 -0.340 12.477 -6.058 1.00 0.00 H new ATOM 0 HD2 ARG B 166 -1.907 11.601 -4.170 1.00 0.00 H new ATOM 0 HD3 ARG B 166 -1.427 13.033 -3.281 1.00 0.00 H new ATOM 0 HE ARG B 166 -2.215 14.105 -5.691 1.00 0.00 H new ATOM 0 HH11 ARG B 166 -3.731 12.279 -3.131 1.00 0.00 H new ATOM 0 HH12 ARG B 166 -5.365 12.596 -3.724 1.00 0.00 H new ATOM 0 HH21 ARG B 166 -4.334 14.278 -6.558 1.00 0.00 H new ATOM 0 HH22 ARG B 166 -5.693 13.687 -5.596 1.00 0.00 H new ATOM 2192 N LEU B 167 2.070 8.480 -4.136 1.00 0.00 N ATOM 2193 CA LEU B 167 3.260 7.605 -4.139 1.00 0.00 C ATOM 2194 C LEU B 167 3.146 6.433 -5.149 1.00 0.00 C ATOM 2195 O LEU B 167 2.050 5.969 -5.477 1.00 0.00 O ATOM 2196 CB LEU B 167 3.518 7.091 -2.705 1.00 0.00 C ATOM 2197 CG LEU B 167 4.537 7.916 -1.894 1.00 0.00 C ATOM 2198 CD1 LEU B 167 4.187 9.392 -1.726 1.00 0.00 C ATOM 2199 CD2 LEU B 167 4.685 7.295 -0.501 1.00 0.00 C ATOM 0 H LEU B 167 1.555 8.456 -3.256 1.00 0.00 H new ATOM 0 HA LEU B 167 4.112 8.198 -4.473 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.572 7.076 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU B 167 3.869 6.061 -2.762 1.00 0.00 H new ATOM 0 HG LEU B 167 5.462 7.885 -2.469 1.00 0.00 H new ATOM 0 HD11 LEU B 167 4.964 9.886 -1.142 1.00 0.00 H new ATOM 0 HD12 LEU B 167 4.115 9.863 -2.706 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.232 9.483 -1.209 1.00 0.00 H new ATOM 0 HD21 LEU B 167 5.404 7.872 0.080 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.720 7.303 0.005 1.00 0.00 H new ATOM 0 HD23 LEU B 167 5.037 6.268 -0.596 1.00 0.00 H new ATOM 2211 N SER B 168 4.292 5.928 -5.628 1.00 0.00 N ATOM 2212 CA SER B 168 4.387 4.772 -6.539 1.00 0.00 C ATOM 2213 C SER B 168 3.954 3.462 -5.862 1.00 0.00 C ATOM 2214 O SER B 168 4.101 3.325 -4.648 1.00 0.00 O ATOM 2215 CB SER B 168 5.837 4.648 -7.023 1.00 0.00 C ATOM 2216 OG SER B 168 6.036 3.485 -7.810 1.00 0.00 O ATOM 0 H SER B 168 5.203 6.320 -5.388 1.00 0.00 H new ATOM 0 HA SER B 168 3.711 4.941 -7.377 1.00 0.00 H new ATOM 0 HB2 SER B 168 6.101 5.530 -7.606 1.00 0.00 H new ATOM 0 HB3 SER B 168 6.506 4.622 -6.163 1.00 0.00 H new ATOM 0 HG SER B 168 6.971 3.443 -8.101 1.00 0.00 H new ATOM 2222 N LYS B 169 3.493 2.450 -6.618 1.00 0.00 N ATOM 2223 CA LYS B 169 3.196 1.104 -6.079 1.00 0.00 C ATOM 2224 C LYS B 169 4.410 0.483 -5.372 1.00 0.00 C ATOM 2225 O LYS B 169 4.263 -0.171 -4.337 1.00 0.00 O ATOM 2226 CB LYS B 169 2.638 0.203 -7.197 1.00 0.00 C ATOM 2227 CG LYS B 169 2.324 -1.208 -6.678 1.00 0.00 C ATOM 2228 CD LYS B 169 1.365 -2.005 -7.574 1.00 0.00 C ATOM 2229 CE LYS B 169 1.336 -3.461 -7.095 1.00 0.00 C ATOM 2230 NZ LYS B 169 0.317 -4.268 -7.808 1.00 0.00 N1+ ATOM 0 H LYS B 169 3.315 2.538 -7.618 1.00 0.00 H new ATOM 0 HA LYS B 169 2.429 1.201 -5.311 1.00 0.00 H new ATOM 0 HB2 LYS B 169 1.733 0.650 -7.609 1.00 0.00 H new ATOM 0 HB3 LYS B 169 3.361 0.140 -8.010 1.00 0.00 H new ATOM 0 HG2 LYS B 169 3.257 -1.763 -6.578 1.00 0.00 H new ATOM 0 HG3 LYS B 169 1.892 -1.129 -5.681 1.00 0.00 H new ATOM 0 HD2 LYS B 169 0.365 -1.574 -7.533 1.00 0.00 H new ATOM 0 HD3 LYS B 169 1.691 -1.956 -8.613 1.00 0.00 H new ATOM 0 HE2 LYS B 169 2.319 -3.909 -7.242 1.00 0.00 H new ATOM 0 HE3 LYS B 169 1.131 -3.485 -6.025 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 0.648 -5.250 -7.891 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -0.577 -4.247 -7.276 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 0.164 -3.873 -8.758 1.00 0.00 H new ATOM 2244 N ASN B 170 5.623 0.737 -5.865 1.00 0.00 N ATOM 2245 CA ASN B 170 6.870 0.318 -5.216 1.00 0.00 C ATOM 2246 C ASN B 170 7.106 1.020 -3.862 1.00 0.00 C ATOM 2247 O ASN B 170 7.528 0.381 -2.900 1.00 0.00 O ATOM 2248 CB ASN B 170 8.036 0.575 -6.193 1.00 0.00 C ATOM 2249 CG ASN B 170 7.891 -0.159 -7.514 1.00 0.00 C ATOM 2250 OD1 ASN B 170 7.094 0.194 -8.373 1.00 0.00 O ATOM 2251 ND2 ASN B 170 8.649 -1.208 -7.731 1.00 0.00 N ATOM 0 H ASN B 170 5.771 1.246 -6.737 1.00 0.00 H new ATOM 0 HA ASN B 170 6.801 -0.745 -4.984 1.00 0.00 H new ATOM 0 HB2 ASN B 170 8.108 1.645 -6.387 1.00 0.00 H new ATOM 0 HB3 ASN B 170 8.970 0.273 -5.719 1.00 0.00 H new ATOM 0 HD21 ASN B 170 8.571 -1.721 -8.609 1.00 0.00 H new ATOM 0 HD22 ASN B 170 9.316 -1.510 -7.021 1.00 0.00 H new ATOM 2258 N GLN B 171 6.768 2.311 -3.762 1.00 0.00 N ATOM 2259 CA GLN B 171 6.807 3.067 -2.503 1.00 0.00 C ATOM 2260 C GLN B 171 5.718 2.606 -1.518 1.00 0.00 C ATOM 2261 O GLN B 171 6.011 2.445 -0.338 1.00 0.00 O ATOM 2262 CB GLN B 171 6.673 4.569 -2.796 1.00 0.00 C ATOM 2263 CG GLN B 171 7.925 5.137 -3.480 1.00 0.00 C ATOM 2264 CD GLN B 171 7.758 6.614 -3.811 1.00 0.00 C ATOM 2265 OE1 GLN B 171 6.875 7.003 -4.568 1.00 0.00 O ATOM 2266 NE2 GLN B 171 8.589 7.492 -3.280 1.00 0.00 N ATOM 0 H GLN B 171 6.457 2.866 -4.559 1.00 0.00 H new ATOM 0 HA GLN B 171 7.768 2.876 -2.026 1.00 0.00 H new ATOM 0 HB2 GLN B 171 5.804 4.738 -3.432 1.00 0.00 H new ATOM 0 HB3 GLN B 171 6.494 5.105 -1.864 1.00 0.00 H new ATOM 0 HG2 GLN B 171 8.789 5.004 -2.828 1.00 0.00 H new ATOM 0 HG3 GLN B 171 8.127 4.579 -4.394 1.00 0.00 H new ATOM 0 HE21 GLN B 171 9.327 7.179 -2.649 1.00 0.00 H new ATOM 0 HE22 GLN B 171 8.493 8.483 -3.501 1.00 0.00 H new ATOM 2275 N LEU B 172 4.500 2.314 -1.993 1.00 0.00 N ATOM 2276 CA LEU B 172 3.403 1.720 -1.211 1.00 0.00 C ATOM 2277 C LEU B 172 3.788 0.357 -0.620 1.00 0.00 C ATOM 2278 O LEU B 172 3.533 0.112 0.558 1.00 0.00 O ATOM 2279 CB LEU B 172 2.146 1.594 -2.099 1.00 0.00 C ATOM 2280 CG LEU B 172 1.157 2.769 -2.003 1.00 0.00 C ATOM 2281 CD1 LEU B 172 1.803 4.135 -2.221 1.00 0.00 C ATOM 2282 CD2 LEU B 172 0.055 2.604 -3.048 1.00 0.00 C ATOM 0 H LEU B 172 4.241 2.490 -2.964 1.00 0.00 H new ATOM 0 HA LEU B 172 3.191 2.380 -0.370 1.00 0.00 H new ATOM 0 HB2 LEU B 172 2.463 1.490 -3.137 1.00 0.00 H new ATOM 0 HB3 LEU B 172 1.622 0.676 -1.832 1.00 0.00 H new ATOM 0 HG LEU B 172 0.763 2.743 -0.987 1.00 0.00 H new ATOM 0 HD11 LEU B 172 1.045 4.913 -2.138 1.00 0.00 H new ATOM 0 HD12 LEU B 172 2.573 4.298 -1.467 1.00 0.00 H new ATOM 0 HD13 LEU B 172 2.253 4.171 -3.213 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -0.643 3.438 -2.976 1.00 0.00 H new ATOM 0 HD22 LEU B 172 0.498 2.586 -4.044 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -0.477 1.670 -2.871 1.00 0.00 H new ATOM 2294 N MET B 173 4.439 -0.510 -1.401 1.00 0.00 N ATOM 2295 CA MET B 173 5.017 -1.762 -0.906 1.00 0.00 C ATOM 2296 C MET B 173 6.072 -1.506 0.179 1.00 0.00 C ATOM 2297 O MET B 173 6.030 -2.137 1.236 1.00 0.00 O ATOM 2298 CB MET B 173 5.625 -2.568 -2.071 1.00 0.00 C ATOM 2299 CG MET B 173 4.546 -3.295 -2.882 1.00 0.00 C ATOM 2300 SD MET B 173 5.154 -4.548 -4.043 1.00 0.00 S ATOM 2301 CE MET B 173 5.819 -3.516 -5.377 1.00 0.00 C ATOM 0 H MET B 173 4.580 -0.362 -2.400 1.00 0.00 H new ATOM 0 HA MET B 173 4.214 -2.344 -0.454 1.00 0.00 H new ATOM 0 HB2 MET B 173 6.182 -1.898 -2.725 1.00 0.00 H new ATOM 0 HB3 MET B 173 6.336 -3.295 -1.679 1.00 0.00 H new ATOM 0 HG2 MET B 173 3.855 -3.773 -2.188 1.00 0.00 H new ATOM 0 HG3 MET B 173 3.975 -2.554 -3.441 1.00 0.00 H new ATOM 0 HE1 MET B 173 6.047 -4.140 -6.241 1.00 0.00 H new ATOM 0 HE2 MET B 173 5.081 -2.764 -5.657 1.00 0.00 H new ATOM 0 HE3 MET B 173 6.729 -3.022 -5.036 1.00 0.00 H new ATOM 2311 N ALA B 174 6.990 -0.555 -0.037 1.00 0.00 N ATOM 2312 CA ALA B 174 8.090 -0.281 0.884 1.00 0.00 C ATOM 2313 C ALA B 174 7.658 0.384 2.207 1.00 0.00 C ATOM 2314 O ALA B 174 8.108 -0.043 3.273 1.00 0.00 O ATOM 2315 CB ALA B 174 9.126 0.552 0.130 1.00 0.00 C ATOM 0 H ALA B 174 6.987 0.046 -0.861 1.00 0.00 H new ATOM 0 HA ALA B 174 8.518 -1.231 1.205 1.00 0.00 H new ATOM 0 HB1 ALA B 174 9.964 0.775 0.790 1.00 0.00 H new ATOM 0 HB2 ALA B 174 9.484 -0.008 -0.734 1.00 0.00 H new ATOM 0 HB3 ALA B 174 8.670 1.484 -0.205 1.00 0.00 H new ATOM 2321 N LEU B 175 6.765 1.387 2.183 1.00 0.00 N ATOM 2322 CA LEU B 175 6.276 2.067 3.399 1.00 0.00 C ATOM 2323 C LEU B 175 5.466 1.113 4.289 1.00 0.00 C ATOM 2324 O LEU B 175 5.631 1.117 5.511 1.00 0.00 O ATOM 2325 CB LEU B 175 5.522 3.366 3.029 1.00 0.00 C ATOM 2326 CG LEU B 175 4.085 3.224 2.471 1.00 0.00 C ATOM 2327 CD1 LEU B 175 3.018 3.297 3.566 1.00 0.00 C ATOM 2328 CD2 LEU B 175 3.777 4.352 1.483 1.00 0.00 C ATOM 0 H LEU B 175 6.360 1.751 1.321 1.00 0.00 H new ATOM 0 HA LEU B 175 7.131 2.370 4.003 1.00 0.00 H new ATOM 0 HB2 LEU B 175 5.477 3.994 3.919 1.00 0.00 H new ATOM 0 HB3 LEU B 175 6.118 3.902 2.291 1.00 0.00 H new ATOM 0 HG LEU B 175 4.052 2.246 1.991 1.00 0.00 H new ATOM 0 HD11 LEU B 175 2.030 3.192 3.119 1.00 0.00 H new ATOM 0 HD12 LEU B 175 3.178 2.493 4.285 1.00 0.00 H new ATOM 0 HD13 LEU B 175 3.085 4.258 4.076 1.00 0.00 H new ATOM 0 HD21 LEU B 175 2.763 4.235 1.102 1.00 0.00 H new ATOM 0 HD22 LEU B 175 3.866 5.313 1.989 1.00 0.00 H new ATOM 0 HD23 LEU B 175 4.483 4.312 0.654 1.00 0.00 H new ATOM 2340 N ALA B 176 4.658 0.243 3.680 1.00 0.00 N ATOM 2341 CA ALA B 176 3.880 -0.783 4.362 1.00 0.00 C ATOM 2342 C ALA B 176 4.772 -1.845 5.035 1.00 0.00 C ATOM 2343 O ALA B 176 4.484 -2.284 6.147 1.00 0.00 O ATOM 2344 CB ALA B 176 2.923 -1.400 3.339 1.00 0.00 C ATOM 0 H ALA B 176 4.526 0.236 2.669 1.00 0.00 H new ATOM 0 HA ALA B 176 3.313 -0.332 5.176 1.00 0.00 H new ATOM 0 HB1 ALA B 176 2.325 -2.174 3.821 1.00 0.00 H new ATOM 0 HB2 ALA B 176 2.265 -0.626 2.944 1.00 0.00 H new ATOM 0 HB3 ALA B 176 3.497 -1.840 2.523 1.00 0.00 H new ATOM 2350 N LEU B 177 5.883 -2.230 4.391 1.00 0.00 N ATOM 2351 CA LEU B 177 6.882 -3.142 4.958 1.00 0.00 C ATOM 2352 C LEU B 177 7.617 -2.484 6.139 1.00 0.00 C ATOM 2353 O LEU B 177 7.702 -3.074 7.220 1.00 0.00 O ATOM 2354 CB LEU B 177 7.844 -3.569 3.828 1.00 0.00 C ATOM 2355 CG LEU B 177 8.567 -4.922 3.979 1.00 0.00 C ATOM 2356 CD1 LEU B 177 9.507 -4.998 5.182 1.00 0.00 C ATOM 2357 CD2 LEU B 177 7.564 -6.081 4.037 1.00 0.00 C ATOM 0 H LEU B 177 6.114 -1.912 3.450 1.00 0.00 H new ATOM 0 HA LEU B 177 6.399 -4.032 5.362 1.00 0.00 H new ATOM 0 HB2 LEU B 177 7.278 -3.592 2.896 1.00 0.00 H new ATOM 0 HB3 LEU B 177 8.602 -2.793 3.721 1.00 0.00 H new ATOM 0 HG LEU B 177 9.189 -5.011 3.089 1.00 0.00 H new ATOM 0 HD11 LEU B 177 9.976 -5.982 5.216 1.00 0.00 H new ATOM 0 HD12 LEU B 177 10.277 -4.232 5.091 1.00 0.00 H new ATOM 0 HD13 LEU B 177 8.939 -4.835 6.098 1.00 0.00 H new ATOM 0 HD21 LEU B 177 8.102 -7.023 4.144 1.00 0.00 H new ATOM 0 HD22 LEU B 177 6.899 -5.944 4.890 1.00 0.00 H new ATOM 0 HD23 LEU B 177 6.977 -6.100 3.119 1.00 0.00 H new ATOM 2369 N LYS B 178 8.085 -1.239 5.978 1.00 0.00 N ATOM 2370 CA LYS B 178 8.810 -0.500 7.026 1.00 0.00 C ATOM 2371 C LYS B 178 7.959 -0.257 8.273 1.00 0.00 C ATOM 2372 O LYS B 178 8.434 -0.527 9.376 1.00 0.00 O ATOM 2373 CB LYS B 178 9.356 0.825 6.472 1.00 0.00 C ATOM 2374 CG LYS B 178 10.601 0.601 5.596 1.00 0.00 C ATOM 2375 CD LYS B 178 11.143 1.931 5.051 1.00 0.00 C ATOM 2376 CE LYS B 178 12.339 1.716 4.119 1.00 0.00 C ATOM 2377 NZ LYS B 178 13.586 1.406 4.863 1.00 0.00 N1+ ATOM 0 H LYS B 178 7.972 -0.711 5.113 1.00 0.00 H new ATOM 0 HA LYS B 178 9.646 -1.127 7.335 1.00 0.00 H new ATOM 0 HB2 LYS B 178 8.583 1.322 5.886 1.00 0.00 H new ATOM 0 HB3 LYS B 178 9.606 1.490 7.298 1.00 0.00 H new ATOM 0 HG2 LYS B 178 11.375 0.102 6.180 1.00 0.00 H new ATOM 0 HG3 LYS B 178 10.351 -0.060 4.766 1.00 0.00 H new ATOM 0 HD2 LYS B 178 10.352 2.453 4.513 1.00 0.00 H new ATOM 0 HD3 LYS B 178 11.440 2.571 5.882 1.00 0.00 H new ATOM 0 HE2 LYS B 178 12.118 0.901 3.430 1.00 0.00 H new ATOM 0 HE3 LYS B 178 12.492 2.611 3.516 1.00 0.00 H new ATOM 0 HZ1 LYS B 178 14.338 1.153 4.190 1.00 0.00 H new ATOM 0 HZ2 LYS B 178 13.879 2.239 5.412 1.00 0.00 H new ATOM 0 HZ3 LYS B 178 13.416 0.608 5.508 1.00 0.00 H new ATOM 2391 N LEU B 179 6.705 0.188 8.128 1.00 0.00 N ATOM 2392 CA LEU B 179 5.828 0.453 9.281 1.00 0.00 C ATOM 2393 C LEU B 179 5.447 -0.827 10.054 1.00 0.00 C ATOM 2394 O LEU B 179 5.238 -0.766 11.271 1.00 0.00 O ATOM 2395 CB LEU B 179 4.629 1.331 8.864 1.00 0.00 C ATOM 2396 CG LEU B 179 3.458 0.647 8.132 1.00 0.00 C ATOM 2397 CD1 LEU B 179 2.451 -0.001 9.090 1.00 0.00 C ATOM 2398 CD2 LEU B 179 2.683 1.681 7.321 1.00 0.00 C ATOM 0 H LEU B 179 6.272 0.373 7.223 1.00 0.00 H new ATOM 0 HA LEU B 179 6.393 1.034 10.010 1.00 0.00 H new ATOM 0 HB2 LEU B 179 4.232 1.804 9.762 1.00 0.00 H new ATOM 0 HB3 LEU B 179 5.005 2.129 8.223 1.00 0.00 H new ATOM 0 HG LEU B 179 3.905 -0.125 7.505 1.00 0.00 H new ATOM 0 HD11 LEU B 179 1.650 -0.466 8.516 1.00 0.00 H new ATOM 0 HD12 LEU B 179 2.955 -0.759 9.690 1.00 0.00 H new ATOM 0 HD13 LEU B 179 2.031 0.761 9.747 1.00 0.00 H new ATOM 0 HD21 LEU B 179 1.856 1.193 6.805 1.00 0.00 H new ATOM 0 HD22 LEU B 179 2.292 2.449 7.989 1.00 0.00 H new ATOM 0 HD23 LEU B 179 3.347 2.141 6.589 1.00 0.00 H new ATOM 2410 N LYS B 180 5.409 -1.982 9.375 1.00 0.00 N ATOM 2411 CA LYS B 180 5.227 -3.313 9.976 1.00 0.00 C ATOM 2412 C LYS B 180 6.500 -3.828 10.666 1.00 0.00 C ATOM 2413 O LYS B 180 6.415 -4.443 11.726 1.00 0.00 O ATOM 2414 CB LYS B 180 4.739 -4.279 8.880 1.00 0.00 C ATOM 2415 CG LYS B 180 4.272 -5.625 9.446 1.00 0.00 C ATOM 2416 CD LYS B 180 3.748 -6.551 8.340 1.00 0.00 C ATOM 2417 CE LYS B 180 3.157 -7.817 8.965 1.00 0.00 C ATOM 2418 NZ LYS B 180 2.703 -8.778 7.930 1.00 0.00 N1+ ATOM 0 H LYS B 180 5.507 -2.018 8.360 1.00 0.00 H new ATOM 0 HA LYS B 180 4.479 -3.245 10.766 1.00 0.00 H new ATOM 0 HB2 LYS B 180 3.919 -3.816 8.331 1.00 0.00 H new ATOM 0 HB3 LYS B 180 5.545 -4.449 8.166 1.00 0.00 H new ATOM 0 HG2 LYS B 180 5.099 -6.109 9.965 1.00 0.00 H new ATOM 0 HG3 LYS B 180 3.487 -5.458 10.184 1.00 0.00 H new ATOM 0 HD2 LYS B 180 2.989 -6.036 7.751 1.00 0.00 H new ATOM 0 HD3 LYS B 180 4.557 -6.814 7.659 1.00 0.00 H new ATOM 0 HE2 LYS B 180 3.904 -8.292 9.600 1.00 0.00 H new ATOM 0 HE3 LYS B 180 2.317 -7.549 9.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 180 1.937 -9.367 8.315 1.00 0.00 H new ATOM 0 HZ2 LYS B 180 2.355 -8.256 7.100 1.00 0.00 H new ATOM 0 HZ3 LYS B 180 3.498 -9.386 7.648 1.00 0.00 H new ATOM 2432 N GLN B 181 7.673 -3.534 10.108 1.00 0.00 N ATOM 2433 CA GLN B 181 8.971 -3.951 10.644 1.00 0.00 C ATOM 2434 C GLN B 181 9.344 -3.188 11.925 1.00 0.00 C ATOM 2435 O GLN B 181 9.862 -3.777 12.872 1.00 0.00 O ATOM 2436 CB GLN B 181 10.029 -3.775 9.540 1.00 0.00 C ATOM 2437 CG GLN B 181 11.433 -4.234 9.973 1.00 0.00 C ATOM 2438 CD GLN B 181 12.354 -4.459 8.773 1.00 0.00 C ATOM 2439 OE1 GLN B 181 12.821 -5.562 8.514 1.00 0.00 O ATOM 2440 NE2 GLN B 181 12.624 -3.450 7.969 1.00 0.00 N ATOM 0 H GLN B 181 7.751 -2.987 9.251 1.00 0.00 H new ATOM 0 HA GLN B 181 8.919 -5.000 10.936 1.00 0.00 H new ATOM 0 HB2 GLN B 181 9.724 -4.340 8.659 1.00 0.00 H new ATOM 0 HB3 GLN B 181 10.070 -2.726 9.248 1.00 0.00 H new ATOM 0 HG2 GLN B 181 11.872 -3.486 10.633 1.00 0.00 H new ATOM 0 HG3 GLN B 181 11.352 -5.157 10.547 1.00 0.00 H new ATOM 0 HE21 GLN B 181 12.245 -2.524 8.167 1.00 0.00 H new ATOM 0 HE22 GLN B 181 13.212 -3.595 7.148 1.00 0.00 H new ATOM 2449 N GLN B 182 9.056 -1.885 11.984 1.00 0.00 N ATOM 2450 CA GLN B 182 9.382 -1.038 13.142 1.00 0.00 C ATOM 2451 C GLN B 182 8.417 -1.216 14.332 1.00 0.00 C ATOM 2452 O GLN B 182 8.824 -1.002 15.473 1.00 0.00 O ATOM 2453 CB GLN B 182 9.504 0.431 12.692 1.00 0.00 C ATOM 2454 CG GLN B 182 8.189 1.080 12.227 1.00 0.00 C ATOM 2455 CD GLN B 182 7.333 1.650 13.358 1.00 0.00 C ATOM 2456 OE1 GLN B 182 7.799 2.319 14.273 1.00 0.00 O ATOM 2457 NE2 GLN B 182 6.043 1.391 13.357 1.00 0.00 N ATOM 0 H GLN B 182 8.589 -1.383 11.229 1.00 0.00 H new ATOM 0 HA GLN B 182 10.347 -1.367 13.528 1.00 0.00 H new ATOM 0 HB2 GLN B 182 9.908 1.016 13.518 1.00 0.00 H new ATOM 0 HB3 GLN B 182 10.227 0.487 11.878 1.00 0.00 H new ATOM 0 HG2 GLN B 182 8.421 1.880 11.524 1.00 0.00 H new ATOM 0 HG3 GLN B 182 7.604 0.338 11.683 1.00 0.00 H new ATOM 0 HE21 GLN B 182 5.635 0.836 12.605 1.00 0.00 H new ATOM 0 HE22 GLN B 182 5.451 1.745 14.108 1.00 0.00 H new