USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 771 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 THR OG1 : rot -108:sc= 0.909 USER MOD Set 1.2: A 86 HIS : no HE2:sc= -1.26 K(o=-0.35,f=-1.4!) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0202 K(o=-0.02,f=-1.8!) USER MOD Single : A 19 ASN : amide:sc= -0.0314 K(o=-0.031,f=-2.2!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 73:sc= 0.246 USER MOD Single : A 32 SER OG : rot 11:sc= -2.87! USER MOD Single : A 34 TYR OH : rot -43:sc= -1.15! USER MOD Single : A 43 SER OG : rot -151:sc= 1.72 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0391) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 64 SER OG : rot 164:sc= 0.957 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.0024) USER MOD Single : A 73 ASN : amide:sc= -0.461 K(o=-0.46,f=-6.2!) USER MOD Single : A 76 LYS NZ :NH3+ 150:sc= -0.138 (180deg=-0.759) USER MOD Single : A 83 LYS NZ :NH3+ -120:sc= -0.0264 (180deg=-0.248) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 314 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= -0.222 X(o=-0.22,f=-0.076) USER MOD Single : B 325 SER OG : rot 176:sc= 0.00407 USER MOD Single : B 331 LYS NZ :NH3+ -171:sc= 0.271 (180deg=0.24) USER MOD Single : B 335 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 336 GLN : amide:sc= -0.239 X(o=-0.24,f=-0.27) USER MOD Single : B 337 ASN : amide:sc= -1.68 K(o=-1.7,f=-3.8!) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.229 -16.711 -2.672 1.00 0.00 N ATOM 143 CA ALA A 11 0.553 -16.924 -1.454 1.00 0.00 C ATOM 144 C ALA A 11 -0.357 -17.050 -0.236 1.00 0.00 C ATOM 145 O ALA A 11 -1.198 -16.186 0.016 1.00 0.00 O ATOM 146 CB ALA A 11 1.519 -15.756 -1.244 1.00 0.00 C ATOM 0 HA ALA A 11 1.114 -17.851 -1.570 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.098 -15.921 -0.335 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.194 -15.685 -2.097 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.954 -14.829 -1.150 1.00 0.00 H new ATOM 152 N TYR A 12 -0.184 -18.133 0.523 1.00 0.00 N ATOM 153 CA TYR A 12 -0.991 -18.366 1.725 1.00 0.00 C ATOM 154 C TYR A 12 -0.108 -18.801 2.891 1.00 0.00 C ATOM 155 O TYR A 12 0.837 -19.568 2.710 1.00 0.00 O ATOM 156 CB TYR A 12 -2.049 -19.440 1.445 1.00 0.00 C ATOM 157 CG TYR A 12 -3.139 -18.863 0.574 1.00 0.00 C ATOM 158 CD1 TYR A 12 -2.952 -18.757 -0.809 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.337 -18.429 1.154 1.00 0.00 C ATOM 160 CE1 TYR A 12 -3.963 -18.218 -1.611 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.348 -17.890 0.352 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.161 -17.783 -1.031 1.00 0.00 C ATOM 163 OH TYR A 12 -6.157 -17.251 -1.821 1.00 0.00 O ATOM 0 H TYR A 12 0.504 -18.861 0.329 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.486 -17.433 1.994 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.590 -20.297 0.951 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.472 -19.801 2.382 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -2.028 -19.091 -1.257 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.481 -18.510 2.221 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -3.820 -18.137 -2.678 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.273 -17.556 0.800 1.00 0.00 H new ATOM 0 HH TYR A 12 -6.921 -17.001 -1.260 1.00 0.00 H new ATOM 173 N ILE A 13 -0.421 -18.306 4.092 1.00 0.00 N ATOM 174 CA ILE A 13 0.358 -18.645 5.290 1.00 0.00 C ATOM 175 C ILE A 13 -0.425 -19.643 6.148 1.00 0.00 C ATOM 176 O ILE A 13 -1.526 -19.349 6.613 1.00 0.00 O ATOM 177 CB ILE A 13 0.670 -17.366 6.125 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.560 -16.123 5.237 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.098 -17.443 6.691 1.00 0.00 C ATOM 180 CD1 ILE A 13 0.829 -14.867 6.070 1.00 0.00 C ATOM 0 H ILE A 13 -1.203 -17.673 4.262 1.00 0.00 H new ATOM 0 HA ILE A 13 1.301 -19.093 4.976 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.048 -17.302 6.942 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.274 -16.186 4.416 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.433 -16.070 4.791 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.308 -16.545 7.273 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.189 -18.320 7.332 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.811 -17.518 5.870 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.750 -13.985 5.434 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.097 -14.801 6.875 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.832 -14.920 6.494 1.00 0.00 H new ATOM 192 N TYR A 14 0.150 -20.818 6.355 1.00 0.00 N ATOM 193 CA TYR A 14 -0.494 -21.848 7.163 1.00 0.00 C ATOM 194 C TYR A 14 -0.233 -21.595 8.645 1.00 0.00 C ATOM 195 O TYR A 14 0.920 -21.531 9.076 1.00 0.00 O ATOM 196 CB TYR A 14 0.042 -23.229 6.773 1.00 0.00 C ATOM 197 CG TYR A 14 -0.542 -24.276 7.694 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.821 -24.790 7.449 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.197 -24.732 8.792 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.361 -25.760 8.303 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.342 -25.701 9.645 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.620 -26.216 9.401 1.00 0.00 C ATOM 203 OH TYR A 14 -2.153 -27.171 10.243 1.00 0.00 O ATOM 0 H TYR A 14 1.059 -21.084 5.977 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.568 -21.815 6.981 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.219 -23.453 5.739 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.130 -23.240 6.837 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.391 -24.439 6.602 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.184 -24.336 8.981 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.348 -26.156 8.115 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.229 -26.052 10.492 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.510 -27.377 10.953 1.00 0.00 H new ATOM 213 N ILE A 15 -1.310 -21.456 9.423 1.00 0.00 N ATOM 214 CA ILE A 15 -1.188 -21.209 10.862 1.00 0.00 C ATOM 215 C ILE A 15 -1.631 -22.434 11.653 1.00 0.00 C ATOM 216 O ILE A 15 -2.736 -22.945 11.455 1.00 0.00 O ATOM 217 CB ILE A 15 -2.046 -20.010 11.269 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.603 -18.765 10.486 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.883 -19.744 12.768 1.00 0.00 C ATOM 220 CD1 ILE A 15 -2.612 -17.618 10.699 1.00 0.00 C ATOM 0 H ILE A 15 -2.270 -21.510 9.083 1.00 0.00 H new ATOM 0 HA ILE A 15 -0.142 -20.998 11.083 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.090 -20.229 11.047 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.611 -18.453 10.814 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.528 -19.001 9.425 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -2.496 -18.889 13.055 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -2.200 -20.622 13.330 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.837 -19.531 12.988 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.288 -16.740 10.140 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.596 -17.929 10.348 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.666 -17.373 11.760 1.00 0.00 H new ATOM 232 N GLY A 16 -0.762 -22.905 12.549 1.00 0.00 N ATOM 233 CA GLY A 16 -1.070 -24.080 13.373 1.00 0.00 C ATOM 234 C GLY A 16 -0.659 -23.853 14.824 1.00 0.00 C ATOM 235 O GLY A 16 -0.016 -22.855 15.147 1.00 0.00 O ATOM 0 H GLY A 16 0.156 -22.495 12.724 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.138 -24.294 13.323 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.551 -24.953 12.977 1.00 0.00 H new ATOM 239 N ASN A 17 -1.036 -24.786 15.695 1.00 0.00 N ATOM 240 CA ASN A 17 -0.706 -24.676 17.114 1.00 0.00 C ATOM 241 C ASN A 17 -1.206 -23.352 17.678 1.00 0.00 C ATOM 242 O ASN A 17 -0.546 -22.733 18.513 1.00 0.00 O ATOM 243 CB ASN A 17 0.812 -24.776 17.311 1.00 0.00 C ATOM 244 CG ASN A 17 1.288 -26.185 16.986 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.490 -27.122 16.962 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.553 -26.396 16.738 1.00 0.00 N ATOM 0 H ASN A 17 -1.566 -25.621 15.446 1.00 0.00 H new ATOM 0 HA ASN A 17 -1.195 -25.493 17.644 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.318 -24.055 16.669 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.071 -24.524 18.339 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.881 -27.338 16.524 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.213 -25.619 16.758 1.00 0.00 H new ATOM 253 N LEU A 18 -2.381 -22.924 17.222 1.00 0.00 N ATOM 254 CA LEU A 18 -2.966 -21.667 17.689 1.00 0.00 C ATOM 255 C LEU A 18 -3.933 -21.928 18.839 1.00 0.00 C ATOM 256 O LEU A 18 -4.620 -22.949 18.866 1.00 0.00 O ATOM 257 CB LEU A 18 -3.710 -20.977 16.533 1.00 0.00 C ATOM 258 CG LEU A 18 -4.840 -21.905 15.991 1.00 0.00 C ATOM 259 CD1 LEU A 18 -6.202 -21.452 16.540 1.00 0.00 C ATOM 260 CD2 LEU A 18 -4.875 -21.843 14.457 1.00 0.00 C ATOM 0 H LEU A 18 -2.944 -23.424 16.534 1.00 0.00 H new ATOM 0 HA LEU A 18 -2.165 -21.018 18.042 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.137 -20.035 16.876 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.011 -20.737 15.732 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.638 -22.926 16.314 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.985 -22.106 16.156 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.190 -21.501 17.629 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.399 -20.427 16.225 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.666 -22.493 14.085 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.067 -20.818 14.139 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.916 -22.173 14.058 1.00 0.00 H new ATOM 272 N ASN A 19 -3.982 -20.999 19.787 1.00 0.00 N ATOM 273 CA ASN A 19 -4.871 -21.140 20.937 1.00 0.00 C ATOM 274 C ASN A 19 -6.292 -20.716 20.572 1.00 0.00 C ATOM 275 O ASN A 19 -6.493 -19.720 19.876 1.00 0.00 O ATOM 276 CB ASN A 19 -4.360 -20.284 22.097 1.00 0.00 C ATOM 277 CG ASN A 19 -3.045 -20.849 22.624 1.00 0.00 C ATOM 278 OD1 ASN A 19 -2.783 -22.044 22.490 1.00 0.00 O ATOM 279 ND2 ASN A 19 -2.196 -20.053 23.215 1.00 0.00 N ATOM 0 H ASN A 19 -3.422 -20.146 19.784 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.885 -22.188 21.238 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -4.216 -19.256 21.765 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.101 -20.260 22.896 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -1.312 -20.421 23.567 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -2.416 -19.063 23.324 1.00 0.00 H new ATOM 286 N ARG A 20 -7.273 -21.475 21.047 1.00 0.00 N ATOM 287 CA ARG A 20 -8.672 -21.167 20.765 1.00 0.00 C ATOM 288 C ARG A 20 -9.031 -19.776 21.279 1.00 0.00 C ATOM 289 O ARG A 20 -10.000 -19.167 20.825 1.00 0.00 O ATOM 290 CB ARG A 20 -9.574 -22.212 21.425 1.00 0.00 C ATOM 291 CG ARG A 20 -9.465 -22.091 22.949 1.00 0.00 C ATOM 292 CD ARG A 20 -10.032 -23.355 23.604 1.00 0.00 C ATOM 293 NE ARG A 20 -9.274 -24.525 23.172 1.00 0.00 N ATOM 294 CZ ARG A 20 -8.087 -24.809 23.697 1.00 0.00 C ATOM 295 NH1 ARG A 20 -7.578 -24.035 24.619 1.00 0.00 N ATOM 296 NH2 ARG A 20 -7.430 -25.861 23.294 1.00 0.00 N ATOM 0 H ARG A 20 -7.128 -22.303 21.625 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.822 -21.187 19.686 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.608 -22.066 21.111 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -9.282 -23.213 21.107 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.424 -21.954 23.240 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.011 -21.213 23.295 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -9.988 -23.263 24.689 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.082 -23.473 23.337 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.663 -25.136 22.454 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.092 -23.213 24.936 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -6.667 -24.253 25.022 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -7.827 -26.466 22.575 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -6.519 -26.079 23.697 1.00 0.00 H new ATOM 310 N GLU A 21 -8.245 -19.280 22.228 1.00 0.00 N ATOM 311 CA GLU A 21 -8.489 -17.960 22.798 1.00 0.00 C ATOM 312 C GLU A 21 -8.267 -16.873 21.747 1.00 0.00 C ATOM 313 O GLU A 21 -8.781 -15.762 21.872 1.00 0.00 O ATOM 314 CB GLU A 21 -7.554 -17.724 23.990 1.00 0.00 C ATOM 315 CG GLU A 21 -7.866 -18.735 25.099 1.00 0.00 C ATOM 316 CD GLU A 21 -9.279 -18.514 25.629 1.00 0.00 C ATOM 317 OE1 GLU A 21 -9.749 -17.390 25.556 1.00 0.00 O ATOM 318 OE2 GLU A 21 -9.873 -19.471 26.099 1.00 0.00 O ATOM 0 H GLU A 21 -7.438 -19.768 22.617 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.524 -17.915 23.136 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.515 -17.824 23.675 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.677 -16.708 24.366 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.769 -19.750 24.714 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.145 -18.631 25.910 1.00 0.00 H new ATOM 325 N LEU A 22 -7.498 -17.202 20.713 1.00 0.00 N ATOM 326 CA LEU A 22 -7.213 -16.242 19.648 1.00 0.00 C ATOM 327 C LEU A 22 -8.327 -16.258 18.607 1.00 0.00 C ATOM 328 O LEU A 22 -8.654 -17.304 18.045 1.00 0.00 O ATOM 329 CB LEU A 22 -5.881 -16.589 18.979 1.00 0.00 C ATOM 330 CG LEU A 22 -4.765 -16.610 20.034 1.00 0.00 C ATOM 331 CD1 LEU A 22 -3.450 -17.036 19.373 1.00 0.00 C ATOM 332 CD2 LEU A 22 -4.598 -15.207 20.652 1.00 0.00 C ATOM 0 H LEU A 22 -7.064 -18.117 20.589 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.151 -15.245 20.084 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.951 -17.560 18.489 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.650 -15.857 18.205 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.028 -17.317 20.820 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.656 -17.052 20.120 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.564 -18.031 18.944 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.193 -16.328 18.585 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.805 -15.231 21.399 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.339 -14.493 19.870 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.532 -14.904 21.124 1.00 0.00 H new ATOM 344 N THR A 23 -8.912 -15.087 18.350 1.00 0.00 N ATOM 345 CA THR A 23 -9.996 -14.966 17.370 1.00 0.00 C ATOM 346 C THR A 23 -9.501 -14.275 16.109 1.00 0.00 C ATOM 347 O THR A 23 -8.304 -14.040 15.947 1.00 0.00 O ATOM 348 CB THR A 23 -11.160 -14.171 17.967 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.705 -12.881 18.345 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.706 -14.904 19.194 1.00 0.00 C ATOM 0 H THR A 23 -8.655 -14.211 18.804 1.00 0.00 H new ATOM 0 HA THR A 23 -10.338 -15.968 17.112 1.00 0.00 H new ATOM 0 HB THR A 23 -11.952 -14.073 17.225 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.449 -12.370 18.726 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.535 -14.337 19.618 1.00 0.00 H new ATOM 0 HG22 THR A 23 -12.056 -15.894 18.901 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.917 -15.005 19.939 1.00 0.00 H new ATOM 358 N GLU A 24 -10.429 -13.957 15.217 1.00 0.00 N ATOM 359 CA GLU A 24 -10.069 -13.301 13.969 1.00 0.00 C ATOM 360 C GLU A 24 -9.457 -11.932 14.243 1.00 0.00 C ATOM 361 O GLU A 24 -8.470 -11.548 13.618 1.00 0.00 O ATOM 362 CB GLU A 24 -11.315 -13.136 13.098 1.00 0.00 C ATOM 363 CG GLU A 24 -11.842 -14.513 12.701 1.00 0.00 C ATOM 364 CD GLU A 24 -13.029 -14.365 11.753 1.00 0.00 C ATOM 365 OE1 GLU A 24 -13.488 -13.249 11.579 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.459 -15.372 11.214 1.00 0.00 O ATOM 0 H GLU A 24 -11.426 -14.140 15.332 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.335 -13.917 13.450 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.082 -12.584 13.642 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.075 -12.555 12.207 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.052 -15.089 12.220 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.143 -15.066 13.590 1.00 0.00 H new ATOM 373 N GLY A 25 -10.049 -11.201 15.182 1.00 0.00 N ATOM 374 CA GLY A 25 -9.551 -9.877 15.532 1.00 0.00 C ATOM 375 C GLY A 25 -8.147 -9.953 16.126 1.00 0.00 C ATOM 376 O GLY A 25 -7.288 -9.124 15.826 1.00 0.00 O ATOM 0 H GLY A 25 -10.868 -11.501 15.711 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.539 -9.244 14.645 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.227 -9.409 16.248 1.00 0.00 H new ATOM 380 N ASP A 26 -7.924 -10.951 16.978 1.00 0.00 N ATOM 381 CA ASP A 26 -6.623 -11.120 17.617 1.00 0.00 C ATOM 382 C ASP A 26 -5.536 -11.381 16.578 1.00 0.00 C ATOM 383 O ASP A 26 -4.436 -10.835 16.666 1.00 0.00 O ATOM 384 CB ASP A 26 -6.677 -12.291 18.599 1.00 0.00 C ATOM 385 CG ASP A 26 -7.550 -11.931 19.795 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.671 -10.750 20.082 1.00 0.00 O ATOM 387 OD2 ASP A 26 -8.091 -12.838 20.405 1.00 0.00 O ATOM 0 H ASP A 26 -8.621 -11.649 17.240 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.383 -10.201 18.151 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.075 -13.175 18.101 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.671 -12.541 18.935 1.00 0.00 H new ATOM 392 N ILE A 27 -5.852 -12.219 15.598 1.00 0.00 N ATOM 393 CA ILE A 27 -4.896 -12.546 14.546 1.00 0.00 C ATOM 394 C ILE A 27 -4.597 -11.315 13.699 1.00 0.00 C ATOM 395 O ILE A 27 -3.448 -11.069 13.331 1.00 0.00 O ATOM 396 CB ILE A 27 -5.445 -13.663 13.659 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.559 -14.956 14.478 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.500 -13.894 12.468 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.329 -16.006 13.674 1.00 0.00 C ATOM 0 H ILE A 27 -6.756 -12.682 15.509 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.972 -12.886 15.014 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.429 -13.377 13.288 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.566 -15.330 14.727 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.070 -14.758 15.420 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.896 -14.691 11.839 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.420 -12.977 11.884 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.514 -14.178 12.836 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.409 -16.924 14.257 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.327 -15.631 13.448 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.800 -16.212 12.744 1.00 0.00 H new ATOM 411 N LEU A 28 -5.640 -10.548 13.391 1.00 0.00 N ATOM 412 CA LEU A 28 -5.475 -9.348 12.579 1.00 0.00 C ATOM 413 C LEU A 28 -4.494 -8.388 13.241 1.00 0.00 C ATOM 414 O LEU A 28 -3.623 -7.831 12.575 1.00 0.00 O ATOM 415 CB LEU A 28 -6.834 -8.646 12.397 1.00 0.00 C ATOM 416 CG LEU A 28 -7.666 -9.384 11.325 1.00 0.00 C ATOM 417 CD1 LEU A 28 -9.139 -8.975 11.448 1.00 0.00 C ATOM 418 CD2 LEU A 28 -7.154 -9.014 9.909 1.00 0.00 C ATOM 0 H LEU A 28 -6.598 -10.734 13.688 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.083 -9.641 11.605 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.375 -8.631 13.343 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.681 -7.608 12.101 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.566 -10.459 11.477 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.726 -9.496 10.691 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.508 -9.239 12.439 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.231 -7.899 11.301 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.746 -9.539 9.159 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.248 -7.939 9.758 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.108 -9.304 9.813 1.00 0.00 H new ATOM 430 N THR A 29 -4.636 -8.207 14.550 1.00 0.00 N ATOM 431 CA THR A 29 -3.754 -7.311 15.283 1.00 0.00 C ATOM 432 C THR A 29 -2.306 -7.793 15.209 1.00 0.00 C ATOM 433 O THR A 29 -1.386 -6.999 15.023 1.00 0.00 O ATOM 434 CB THR A 29 -4.184 -7.237 16.749 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.524 -6.770 16.820 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.267 -6.270 17.501 1.00 0.00 C ATOM 0 H THR A 29 -5.347 -8.665 15.119 1.00 0.00 H new ATOM 0 HA THR A 29 -3.822 -6.323 14.828 1.00 0.00 H new ATOM 0 HB THR A 29 -4.116 -8.226 17.201 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.133 -7.475 16.515 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.573 -6.217 18.546 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.238 -6.624 17.442 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.336 -5.279 17.052 1.00 0.00 H new ATOM 444 N VAL A 30 -2.109 -9.098 15.363 1.00 0.00 N ATOM 445 CA VAL A 30 -0.762 -9.662 15.333 1.00 0.00 C ATOM 446 C VAL A 30 -0.072 -9.406 13.989 1.00 0.00 C ATOM 447 O VAL A 30 1.055 -8.911 13.938 1.00 0.00 O ATOM 448 CB VAL A 30 -0.836 -11.177 15.574 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.548 -11.802 15.367 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.312 -11.444 17.004 1.00 0.00 C ATOM 0 H VAL A 30 -2.854 -9.779 15.508 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.180 -9.177 16.116 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.539 -11.621 14.869 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.491 -12.877 15.539 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.883 -11.615 14.347 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.256 -11.359 16.068 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.365 -12.519 17.175 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.611 -10.998 17.710 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.300 -11.005 17.147 1.00 0.00 H new ATOM 460 N PHE A 31 -0.757 -9.737 12.907 1.00 0.00 N ATOM 461 CA PHE A 31 -0.194 -9.551 11.575 1.00 0.00 C ATOM 462 C PHE A 31 -0.254 -8.084 11.149 1.00 0.00 C ATOM 463 O PHE A 31 0.452 -7.661 10.232 1.00 0.00 O ATOM 464 CB PHE A 31 -0.957 -10.425 10.568 1.00 0.00 C ATOM 465 CG PHE A 31 -0.518 -11.869 10.706 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.898 -12.611 11.831 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.269 -12.463 9.711 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.492 -13.944 11.961 1.00 0.00 C ATOM 469 CE2 PHE A 31 0.673 -13.797 9.841 1.00 0.00 C ATOM 470 CZ PHE A 31 0.294 -14.537 10.967 1.00 0.00 C ATOM 0 H PHE A 31 -1.697 -10.133 12.921 1.00 0.00 H new ATOM 0 HA PHE A 31 0.854 -9.850 11.598 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -2.030 -10.343 10.741 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.770 -10.074 9.553 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.505 -12.154 12.599 1.00 0.00 H new ATOM 0 HD2 PHE A 31 0.564 -11.892 8.843 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.786 -14.515 12.829 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.277 -14.255 9.072 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.608 -15.565 11.068 1.00 0.00 H new ATOM 480 N SER A 32 -1.103 -7.317 11.815 1.00 0.00 N ATOM 481 CA SER A 32 -1.255 -5.902 11.496 1.00 0.00 C ATOM 482 C SER A 32 0.014 -5.117 11.776 1.00 0.00 C ATOM 483 O SER A 32 0.187 -3.997 11.299 1.00 0.00 O ATOM 484 CB SER A 32 -2.400 -5.312 12.297 1.00 0.00 C ATOM 485 OG SER A 32 -2.304 -3.893 12.284 1.00 0.00 O ATOM 0 H SER A 32 -1.696 -7.646 12.577 1.00 0.00 H new ATOM 0 HA SER A 32 -1.467 -5.828 10.429 1.00 0.00 H new ATOM 0 HB2 SER A 32 -3.354 -5.627 11.874 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.369 -5.680 13.322 1.00 0.00 H new ATOM 0 HG SER A 32 -1.636 -3.616 11.622 1.00 0.00 H new ATOM 491 N GLU A 33 0.894 -5.706 12.562 1.00 0.00 N ATOM 492 CA GLU A 33 2.140 -5.045 12.902 1.00 0.00 C ATOM 493 C GLU A 33 3.048 -4.916 11.674 1.00 0.00 C ATOM 494 O GLU A 33 3.776 -3.933 11.532 1.00 0.00 O ATOM 495 CB GLU A 33 2.860 -5.838 13.998 1.00 0.00 C ATOM 496 CG GLU A 33 3.999 -4.994 14.586 1.00 0.00 C ATOM 497 CD GLU A 33 5.162 -4.925 13.603 1.00 0.00 C ATOM 498 OE1 GLU A 33 5.344 -5.878 12.861 1.00 0.00 O ATOM 499 OE2 GLU A 33 5.850 -3.918 13.601 1.00 0.00 O ATOM 0 H GLU A 33 0.772 -6.631 12.974 1.00 0.00 H new ATOM 0 HA GLU A 33 1.911 -4.043 13.263 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.156 -6.113 14.783 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.257 -6.766 13.587 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.640 -3.989 14.808 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.334 -5.428 15.528 1.00 0.00 H new ATOM 506 N TYR A 34 3.017 -5.928 10.799 1.00 0.00 N ATOM 507 CA TYR A 34 3.858 -5.968 9.591 1.00 0.00 C ATOM 508 C TYR A 34 3.030 -6.129 8.302 1.00 0.00 C ATOM 509 O TYR A 34 3.409 -6.897 7.425 1.00 0.00 O ATOM 510 CB TYR A 34 4.917 -7.082 9.717 1.00 0.00 C ATOM 511 CG TYR A 34 4.261 -8.394 10.084 1.00 0.00 C ATOM 512 CD1 TYR A 34 3.791 -9.254 9.083 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.120 -8.747 11.428 1.00 0.00 C ATOM 514 CE1 TYR A 34 3.175 -10.457 9.427 1.00 0.00 C ATOM 515 CE2 TYR A 34 3.506 -9.955 11.774 1.00 0.00 C ATOM 516 CZ TYR A 34 3.033 -10.810 10.773 1.00 0.00 C ATOM 517 OH TYR A 34 2.421 -11.998 11.113 1.00 0.00 O ATOM 0 H TYR A 34 2.411 -6.741 10.905 1.00 0.00 H new ATOM 0 HA TYR A 34 4.365 -5.006 9.512 1.00 0.00 H new ATOM 0 HB2 TYR A 34 5.456 -7.188 8.776 1.00 0.00 H new ATOM 0 HB3 TYR A 34 5.651 -6.810 10.476 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.906 -8.985 8.043 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.485 -8.087 12.201 1.00 0.00 H new ATOM 0 HE1 TYR A 34 2.808 -11.116 8.654 1.00 0.00 H new ATOM 0 HE2 TYR A 34 3.397 -10.228 12.813 1.00 0.00 H new ATOM 0 HH TYR A 34 1.622 -12.124 10.560 1.00 0.00 H new ATOM 527 N GLY A 35 1.888 -5.429 8.193 1.00 0.00 N ATOM 528 CA GLY A 35 1.038 -5.600 6.997 1.00 0.00 C ATOM 529 C GLY A 35 -0.255 -6.363 7.285 1.00 0.00 C ATOM 530 O GLY A 35 -0.328 -7.575 7.087 1.00 0.00 O ATOM 0 H GLY A 35 1.540 -4.766 8.885 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.791 -4.619 6.591 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.603 -6.130 6.230 1.00 0.00 H new ATOM 534 N VAL A 36 -1.260 -5.647 7.802 1.00 0.00 N ATOM 535 CA VAL A 36 -2.524 -6.283 8.166 1.00 0.00 C ATOM 536 C VAL A 36 -3.115 -7.030 6.965 1.00 0.00 C ATOM 537 O VAL A 36 -3.162 -6.506 5.854 1.00 0.00 O ATOM 538 CB VAL A 36 -3.532 -5.210 8.624 1.00 0.00 C ATOM 539 CG1 VAL A 36 -3.845 -4.262 7.461 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.829 -5.887 9.098 1.00 0.00 C ATOM 0 H VAL A 36 -1.222 -4.642 7.975 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.333 -6.990 8.973 1.00 0.00 H new ATOM 0 HB VAL A 36 -3.099 -4.641 9.446 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -4.558 -3.506 7.790 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.927 -3.776 7.130 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -4.273 -4.829 6.634 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -5.539 -5.126 9.421 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -5.260 -6.461 8.278 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -4.608 -6.554 9.931 1.00 0.00 H new ATOM 550 N PRO A 37 -3.557 -8.268 7.183 1.00 0.00 N ATOM 551 CA PRO A 37 -4.139 -9.126 6.109 1.00 0.00 C ATOM 552 C PRO A 37 -5.372 -8.498 5.472 1.00 0.00 C ATOM 553 O PRO A 37 -6.117 -7.768 6.126 1.00 0.00 O ATOM 554 CB PRO A 37 -4.515 -10.436 6.829 1.00 0.00 C ATOM 555 CG PRO A 37 -3.724 -10.431 8.097 1.00 0.00 C ATOM 556 CD PRO A 37 -3.549 -8.983 8.482 1.00 0.00 C ATOM 0 HA PRO A 37 -3.433 -9.272 5.291 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.585 -10.479 7.033 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.272 -11.305 6.217 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.243 -10.982 8.881 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -2.758 -10.915 7.954 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -4.355 -8.642 9.131 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.615 -8.822 9.021 1.00 0.00 H new ATOM 564 N VAL A 38 -5.582 -8.788 4.194 1.00 0.00 N ATOM 565 CA VAL A 38 -6.733 -8.257 3.478 1.00 0.00 C ATOM 566 C VAL A 38 -7.892 -9.247 3.551 1.00 0.00 C ATOM 567 O VAL A 38 -9.055 -8.860 3.442 1.00 0.00 O ATOM 568 CB VAL A 38 -6.367 -7.984 2.009 1.00 0.00 C ATOM 569 CG1 VAL A 38 -6.223 -9.310 1.253 1.00 0.00 C ATOM 570 CG2 VAL A 38 -7.469 -7.148 1.358 1.00 0.00 C ATOM 0 H VAL A 38 -4.973 -9.385 3.635 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.035 -7.319 3.944 1.00 0.00 H new ATOM 0 HB VAL A 38 -5.422 -7.442 1.970 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.964 -9.110 0.213 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.437 -9.908 1.714 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -7.166 -9.856 1.293 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -7.211 -6.954 0.317 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -8.413 -7.692 1.403 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.570 -6.202 1.890 1.00 0.00 H new ATOM 580 N ASP A 39 -7.561 -10.529 3.728 1.00 0.00 N ATOM 581 CA ASP A 39 -8.580 -11.569 3.808 1.00 0.00 C ATOM 582 C ASP A 39 -8.076 -12.761 4.624 1.00 0.00 C ATOM 583 O ASP A 39 -6.974 -13.265 4.391 1.00 0.00 O ATOM 584 CB ASP A 39 -8.957 -12.035 2.401 1.00 0.00 C ATOM 585 CG ASP A 39 -10.072 -13.072 2.476 1.00 0.00 C ATOM 586 OD1 ASP A 39 -10.363 -13.521 3.572 1.00 0.00 O ATOM 587 OD2 ASP A 39 -10.619 -13.402 1.437 1.00 0.00 O ATOM 0 H ASP A 39 -6.602 -10.866 3.818 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.457 -11.153 4.303 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.281 -11.184 1.802 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.085 -12.462 1.905 1.00 0.00 H new ATOM 592 N VAL A 40 -8.887 -13.213 5.585 1.00 0.00 N ATOM 593 CA VAL A 40 -8.510 -14.355 6.432 1.00 0.00 C ATOM 594 C VAL A 40 -9.585 -15.437 6.350 1.00 0.00 C ATOM 595 O VAL A 40 -10.771 -15.159 6.523 1.00 0.00 O ATOM 596 CB VAL A 40 -8.335 -13.903 7.888 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.740 -15.047 8.714 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.398 -12.696 7.938 1.00 0.00 C ATOM 0 H VAL A 40 -9.801 -12.812 5.797 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.563 -14.761 6.075 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.306 -13.627 8.300 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.617 -14.724 9.748 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.409 -15.907 8.680 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.770 -15.326 8.303 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.273 -12.375 8.972 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.428 -12.971 7.524 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.824 -11.880 7.353 1.00 0.00 H new ATOM 608 N ILE A 41 -9.163 -16.675 6.081 1.00 0.00 N ATOM 609 CA ILE A 41 -10.106 -17.794 5.970 1.00 0.00 C ATOM 610 C ILE A 41 -10.035 -18.692 7.203 1.00 0.00 C ATOM 611 O ILE A 41 -8.980 -19.239 7.528 1.00 0.00 O ATOM 612 CB ILE A 41 -9.783 -18.619 4.725 1.00 0.00 C ATOM 613 CG1 ILE A 41 -9.855 -17.723 3.486 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.797 -19.756 4.587 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.289 -18.474 2.279 1.00 0.00 C ATOM 0 H ILE A 41 -8.185 -16.928 5.937 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.113 -17.385 5.894 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.780 -19.035 4.817 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.888 -17.431 3.295 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.291 -16.806 3.654 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.566 -20.344 3.699 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.749 -20.396 5.468 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.800 -19.340 4.496 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.340 -17.836 1.397 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.251 -18.743 2.472 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.872 -19.379 2.107 1.00 0.00 H new ATOM 627 N LEU A 42 -11.166 -18.841 7.891 1.00 0.00 N ATOM 628 CA LEU A 42 -11.222 -19.679 9.093 1.00 0.00 C ATOM 629 C LEU A 42 -11.830 -21.040 8.747 1.00 0.00 C ATOM 630 O LEU A 42 -13.028 -21.149 8.486 1.00 0.00 O ATOM 631 CB LEU A 42 -12.062 -18.981 10.186 1.00 0.00 C ATOM 632 CG LEU A 42 -11.182 -17.971 10.969 1.00 0.00 C ATOM 633 CD1 LEU A 42 -10.153 -18.725 11.855 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.440 -17.066 9.969 1.00 0.00 C ATOM 0 H LEU A 42 -12.050 -18.398 7.642 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.211 -19.829 9.472 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.907 -18.464 9.732 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.473 -19.724 10.870 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.819 -17.366 11.613 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.543 -18.003 12.398 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.681 -19.361 12.565 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.512 -19.340 11.224 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.820 -16.354 10.513 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.809 -17.677 9.324 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.165 -16.525 9.361 1.00 0.00 H new ATOM 646 N SER A 43 -10.994 -22.073 8.748 1.00 0.00 N ATOM 647 CA SER A 43 -11.459 -23.418 8.428 1.00 0.00 C ATOM 648 C SER A 43 -12.258 -24.006 9.586 1.00 0.00 C ATOM 649 O SER A 43 -11.712 -24.263 10.660 1.00 0.00 O ATOM 650 CB SER A 43 -10.264 -24.321 8.126 1.00 0.00 C ATOM 651 OG SER A 43 -10.723 -25.648 7.895 1.00 0.00 O ATOM 0 H SER A 43 -10.000 -22.006 8.965 1.00 0.00 H new ATOM 0 HA SER A 43 -12.106 -23.357 7.553 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.727 -23.953 7.252 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.563 -24.307 8.960 1.00 0.00 H new ATOM 0 HG SER A 43 -10.024 -26.285 8.153 1.00 0.00 H new ATOM 657 N ARG A 44 -13.558 -24.219 9.363 1.00 0.00 N ATOM 658 CA ARG A 44 -14.434 -24.782 10.398 1.00 0.00 C ATOM 659 C ARG A 44 -15.284 -25.912 9.821 1.00 0.00 C ATOM 660 O ARG A 44 -15.716 -25.853 8.669 1.00 0.00 O ATOM 661 CB ARG A 44 -15.342 -23.681 10.978 1.00 0.00 C ATOM 662 CG ARG A 44 -14.498 -22.623 11.721 1.00 0.00 C ATOM 663 CD ARG A 44 -14.185 -23.108 13.147 1.00 0.00 C ATOM 664 NE ARG A 44 -13.409 -22.103 13.870 1.00 0.00 N ATOM 665 CZ ARG A 44 -14.004 -21.090 14.495 1.00 0.00 C ATOM 666 NH1 ARG A 44 -15.304 -20.980 14.466 1.00 0.00 N ATOM 667 NH2 ARG A 44 -13.289 -20.206 15.136 1.00 0.00 N ATOM 0 H ARG A 44 -14.026 -24.012 8.481 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.813 -25.187 11.197 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.907 -23.207 10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -16.068 -24.122 11.661 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -13.571 -22.439 11.179 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -15.038 -21.677 11.760 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -15.114 -23.312 13.680 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -13.629 -24.045 13.105 1.00 0.00 H new ATOM 0 HE ARG A 44 -12.392 -22.179 13.896 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -15.863 -21.670 13.965 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -15.761 -20.204 14.945 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -12.273 -20.291 15.158 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -13.746 -19.430 15.615 1.00 0.00 H new ATOM 786 N GLY A 53 -8.186 -25.325 14.873 1.00 0.00 N ATOM 787 CA GLY A 53 -6.901 -26.013 14.982 1.00 0.00 C ATOM 788 C GLY A 53 -5.926 -25.510 13.921 1.00 0.00 C ATOM 789 O GLY A 53 -4.721 -25.745 14.013 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.480 -25.852 15.975 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -7.047 -27.087 14.868 1.00 0.00 H new ATOM 793 N PHE A 54 -6.454 -24.811 12.920 1.00 0.00 N ATOM 794 CA PHE A 54 -5.620 -24.273 11.851 1.00 0.00 C ATOM 795 C PHE A 54 -6.401 -23.266 11.013 1.00 0.00 C ATOM 796 O PHE A 54 -7.632 -23.255 11.028 1.00 0.00 O ATOM 797 CB PHE A 54 -5.115 -25.407 10.958 1.00 0.00 C ATOM 798 CG PHE A 54 -6.293 -26.140 10.362 1.00 0.00 C ATOM 799 CD1 PHE A 54 -6.856 -27.229 11.040 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.824 -25.733 9.133 1.00 0.00 C ATOM 801 CE1 PHE A 54 -7.947 -27.909 10.489 1.00 0.00 C ATOM 802 CE2 PHE A 54 -7.916 -26.413 8.581 1.00 0.00 C ATOM 803 CZ PHE A 54 -8.477 -27.501 9.260 1.00 0.00 C ATOM 0 H PHE A 54 -7.449 -24.605 12.827 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.769 -23.764 12.304 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.483 -25.006 10.165 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.500 -26.095 11.538 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -6.447 -27.544 11.989 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.391 -24.893 8.610 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -8.380 -28.749 11.012 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.325 -26.099 7.632 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.320 -28.026 8.835 1.00 0.00 H new ATOM 813 N ALA A 55 -5.679 -22.423 10.277 1.00 0.00 N ATOM 814 CA ALA A 55 -6.321 -21.416 9.427 1.00 0.00 C ATOM 815 C ALA A 55 -5.380 -20.969 8.311 1.00 0.00 C ATOM 816 O ALA A 55 -4.176 -21.235 8.362 1.00 0.00 O ATOM 817 CB ALA A 55 -6.730 -20.206 10.272 1.00 0.00 C ATOM 0 H ALA A 55 -4.659 -22.415 10.250 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.207 -21.862 8.976 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.206 -19.461 9.634 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.430 -20.522 11.046 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.845 -19.772 10.738 1.00 0.00 H new ATOM 823 N TYR A 56 -5.930 -20.286 7.297 1.00 0.00 N ATOM 824 CA TYR A 56 -5.121 -19.806 6.167 1.00 0.00 C ATOM 825 C TYR A 56 -5.123 -18.278 6.133 1.00 0.00 C ATOM 826 O TYR A 56 -6.139 -17.643 6.426 1.00 0.00 O ATOM 827 CB TYR A 56 -5.680 -20.343 4.849 1.00 0.00 C ATOM 828 CG TYR A 56 -5.732 -21.851 4.902 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.569 -22.601 4.699 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.947 -22.499 5.159 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.618 -23.999 4.750 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.997 -23.897 5.211 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.833 -24.647 5.006 1.00 0.00 C ATOM 834 OH TYR A 56 -5.884 -26.025 5.057 1.00 0.00 O ATOM 0 H TYR A 56 -6.922 -20.055 7.235 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.100 -20.165 6.296 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.677 -19.940 4.674 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.054 -20.019 4.017 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.632 -22.101 4.503 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.845 -21.920 5.317 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.720 -24.577 4.592 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.934 -24.397 5.409 1.00 0.00 H new ATOM 0 HH TYR A 56 -6.802 -26.312 5.246 1.00 0.00 H new ATOM 844 N LEU A 57 -3.979 -17.690 5.776 1.00 0.00 N ATOM 845 CA LEU A 57 -3.853 -16.225 5.712 1.00 0.00 C ATOM 846 C LEU A 57 -3.516 -15.752 4.295 1.00 0.00 C ATOM 847 O LEU A 57 -2.602 -16.282 3.668 1.00 0.00 O ATOM 848 CB LEU A 57 -2.746 -15.750 6.692 1.00 0.00 C ATOM 849 CG LEU A 57 -3.361 -14.980 7.872 1.00 0.00 C ATOM 850 CD1 LEU A 57 -2.320 -14.791 8.992 1.00 0.00 C ATOM 851 CD2 LEU A 57 -3.826 -13.604 7.382 1.00 0.00 C ATOM 0 H LEU A 57 -3.130 -18.198 5.528 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.813 -15.794 5.996 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.188 -16.610 7.063 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.036 -15.112 6.165 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.204 -15.547 8.265 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.771 -14.244 9.820 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.982 -15.766 9.343 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.469 -14.229 8.607 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.264 -13.051 8.213 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.974 -13.051 6.987 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.572 -13.730 6.597 1.00 0.00 H new ATOM 863 N LYS A 58 -4.256 -14.748 3.805 1.00 0.00 N ATOM 864 CA LYS A 58 -4.008 -14.196 2.470 1.00 0.00 C ATOM 865 C LYS A 58 -3.934 -12.670 2.526 1.00 0.00 C ATOM 866 O LYS A 58 -4.934 -12.002 2.796 1.00 0.00 O ATOM 867 CB LYS A 58 -5.122 -14.620 1.493 1.00 0.00 C ATOM 868 CG LYS A 58 -4.648 -14.454 0.021 1.00 0.00 C ATOM 869 CD LYS A 58 -4.807 -12.988 -0.430 1.00 0.00 C ATOM 870 CE LYS A 58 -4.724 -12.893 -1.957 1.00 0.00 C ATOM 871 NZ LYS A 58 -3.345 -13.241 -2.403 1.00 0.00 N ATOM 0 H LYS A 58 -5.024 -14.306 4.309 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.054 -14.588 2.116 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.400 -15.658 1.677 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.013 -14.016 1.664 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.605 -14.758 -0.069 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.228 -15.107 -0.631 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.764 -12.595 -0.085 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.029 -12.374 0.023 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.447 -13.569 -2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.980 -11.885 -2.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.265 -13.095 -3.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -2.658 -12.634 -1.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.149 -14.237 -2.179 1.00 0.00 H new ATOM 885 N TYR A 59 -2.745 -12.118 2.258 1.00 0.00 N ATOM 886 CA TYR A 59 -2.549 -10.659 2.261 1.00 0.00 C ATOM 887 C TYR A 59 -2.177 -10.171 0.862 1.00 0.00 C ATOM 888 O TYR A 59 -1.508 -10.877 0.108 1.00 0.00 O ATOM 889 CB TYR A 59 -1.458 -10.245 3.266 1.00 0.00 C ATOM 890 CG TYR A 59 -1.299 -8.720 3.293 1.00 0.00 C ATOM 891 CD1 TYR A 59 -2.430 -7.879 3.307 1.00 0.00 C ATOM 892 CD2 TYR A 59 -0.019 -8.146 3.305 1.00 0.00 C ATOM 893 CE1 TYR A 59 -2.282 -6.492 3.330 1.00 0.00 C ATOM 894 CE2 TYR A 59 0.126 -6.749 3.330 1.00 0.00 C ATOM 895 CZ TYR A 59 -1.006 -5.924 3.342 1.00 0.00 C ATOM 896 OH TYR A 59 -0.864 -4.552 3.363 1.00 0.00 O ATOM 0 H TYR A 59 -1.906 -12.654 2.037 1.00 0.00 H new ATOM 0 HA TYR A 59 -3.488 -10.197 2.565 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -1.717 -10.607 4.261 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -0.510 -10.710 2.994 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -3.419 -8.312 3.300 1.00 0.00 H new ATOM 0 HD2 TYR A 59 0.856 -8.779 3.295 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -3.155 -5.857 3.339 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.113 -6.310 3.340 1.00 0.00 H new ATOM 0 HH TYR A 59 0.089 -4.322 3.370 1.00 0.00 H new ATOM 906 N GLU A 60 -2.614 -8.963 0.523 1.00 0.00 N ATOM 907 CA GLU A 60 -2.325 -8.396 -0.791 1.00 0.00 C ATOM 908 C GLU A 60 -0.821 -8.427 -1.071 1.00 0.00 C ATOM 909 O GLU A 60 -0.396 -8.325 -2.223 1.00 0.00 O ATOM 910 CB GLU A 60 -2.834 -6.946 -0.856 1.00 0.00 C ATOM 911 CG GLU A 60 -1.905 -6.027 -0.043 1.00 0.00 C ATOM 912 CD GLU A 60 -2.641 -4.753 0.363 1.00 0.00 C ATOM 913 OE1 GLU A 60 -3.540 -4.850 1.182 1.00 0.00 O ATOM 914 OE2 GLU A 60 -2.293 -3.701 -0.148 1.00 0.00 O ATOM 0 H GLU A 60 -3.166 -8.361 1.134 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.834 -8.994 -1.547 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.874 -6.612 -1.893 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -3.849 -6.890 -0.464 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -1.552 -6.550 0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -1.025 -5.774 -0.634 1.00 0.00 H new ATOM 921 N ASP A 61 -0.018 -8.563 -0.013 1.00 0.00 N ATOM 922 CA ASP A 61 1.444 -8.599 -0.155 1.00 0.00 C ATOM 923 C ASP A 61 2.007 -9.910 0.386 1.00 0.00 C ATOM 924 O ASP A 61 1.808 -10.249 1.553 1.00 0.00 O ATOM 925 CB ASP A 61 2.072 -7.425 0.598 1.00 0.00 C ATOM 926 CG ASP A 61 3.528 -7.248 0.176 1.00 0.00 C ATOM 927 OD1 ASP A 61 3.912 -7.838 -0.820 1.00 0.00 O ATOM 928 OD2 ASP A 61 4.237 -6.524 0.855 1.00 0.00 O ATOM 0 H ASP A 61 -0.351 -8.650 0.947 1.00 0.00 H new ATOM 0 HA ASP A 61 1.686 -8.524 -1.215 1.00 0.00 H new ATOM 0 HB2 ASP A 61 1.513 -6.512 0.394 1.00 0.00 H new ATOM 0 HB3 ASP A 61 2.016 -7.600 1.672 1.00 0.00 H new ATOM 933 N GLN A 62 2.707 -10.647 -0.469 1.00 0.00 N ATOM 934 CA GLN A 62 3.299 -11.919 -0.065 1.00 0.00 C ATOM 935 C GLN A 62 4.571 -11.691 0.744 1.00 0.00 C ATOM 936 O GLN A 62 5.012 -12.566 1.490 1.00 0.00 O ATOM 937 CB GLN A 62 3.625 -12.761 -1.306 1.00 0.00 C ATOM 938 CG GLN A 62 4.661 -12.032 -2.173 1.00 0.00 C ATOM 939 CD GLN A 62 5.017 -12.879 -3.390 1.00 0.00 C ATOM 940 OE1 GLN A 62 5.297 -14.070 -3.256 1.00 0.00 O ATOM 941 NE2 GLN A 62 5.023 -12.333 -4.574 1.00 0.00 N ATOM 0 H GLN A 62 2.878 -10.389 -1.441 1.00 0.00 H new ATOM 0 HA GLN A 62 2.579 -12.449 0.558 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.011 -13.735 -1.005 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.718 -12.942 -1.882 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.264 -11.069 -2.494 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.558 -11.828 -1.588 1.00 0.00 H new ATOM 0 HE21 GLN A 62 4.790 -11.346 -4.682 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.260 -12.893 -5.393 1.00 0.00 H new ATOM 950 N ARG A 63 5.157 -10.511 0.586 1.00 0.00 N ATOM 951 CA ARG A 63 6.388 -10.182 1.292 1.00 0.00 C ATOM 952 C ARG A 63 6.162 -10.185 2.799 1.00 0.00 C ATOM 953 O ARG A 63 7.077 -10.465 3.572 1.00 0.00 O ATOM 954 CB ARG A 63 6.890 -8.805 0.852 1.00 0.00 C ATOM 955 CG ARG A 63 7.266 -8.848 -0.630 1.00 0.00 C ATOM 956 CD ARG A 63 7.600 -7.437 -1.115 1.00 0.00 C ATOM 957 NE ARG A 63 6.412 -6.594 -1.073 1.00 0.00 N ATOM 958 CZ ARG A 63 6.464 -5.315 -1.433 1.00 0.00 C ATOM 959 NH1 ARG A 63 7.591 -4.796 -1.837 1.00 0.00 N ATOM 960 NH2 ARG A 63 5.388 -4.579 -1.387 1.00 0.00 N ATOM 0 H ARG A 63 4.803 -9.771 -0.020 1.00 0.00 H new ATOM 0 HA ARG A 63 7.135 -10.937 1.048 1.00 0.00 H new ATOM 0 HB2 ARG A 63 6.118 -8.054 1.021 1.00 0.00 H new ATOM 0 HB3 ARG A 63 7.754 -8.513 1.449 1.00 0.00 H new ATOM 0 HG2 ARG A 63 8.121 -9.507 -0.780 1.00 0.00 H new ATOM 0 HG3 ARG A 63 6.442 -9.258 -1.213 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.382 -7.006 -0.490 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.990 -7.477 -2.132 1.00 0.00 H new ATOM 0 HE ARG A 63 5.526 -6.992 -0.762 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.432 -5.371 -1.877 1.00 0.00 H new ATOM 0 HH12 ARG A 63 7.631 -3.815 -2.113 1.00 0.00 H new ATOM 0 HH21 ARG A 63 4.506 -4.984 -1.075 1.00 0.00 H new ATOM 0 HH22 ARG A 63 5.429 -3.598 -1.663 1.00 0.00 H new ATOM 974 N SER A 64 4.937 -9.873 3.212 1.00 0.00 N ATOM 975 CA SER A 64 4.599 -9.838 4.632 1.00 0.00 C ATOM 976 C SER A 64 4.835 -11.202 5.273 1.00 0.00 C ATOM 977 O SER A 64 5.163 -11.293 6.457 1.00 0.00 O ATOM 978 CB SER A 64 3.137 -9.438 4.816 1.00 0.00 C ATOM 979 OG SER A 64 2.948 -8.116 4.330 1.00 0.00 O ATOM 0 H SER A 64 4.165 -9.642 2.587 1.00 0.00 H new ATOM 0 HA SER A 64 5.240 -9.102 5.117 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.488 -10.131 4.281 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.862 -9.493 5.869 1.00 0.00 H new ATOM 0 HG SER A 64 1.990 -7.945 4.210 1.00 0.00 H new ATOM 985 N THR A 65 4.661 -12.261 4.487 1.00 0.00 N ATOM 986 CA THR A 65 4.851 -13.613 4.996 1.00 0.00 C ATOM 987 C THR A 65 6.279 -13.802 5.489 1.00 0.00 C ATOM 988 O THR A 65 6.516 -14.492 6.478 1.00 0.00 O ATOM 989 CB THR A 65 4.554 -14.632 3.890 1.00 0.00 C ATOM 990 OG1 THR A 65 5.497 -14.473 2.838 1.00 0.00 O ATOM 991 CG2 THR A 65 3.142 -14.402 3.341 1.00 0.00 C ATOM 0 H THR A 65 4.391 -12.209 3.505 1.00 0.00 H new ATOM 0 HA THR A 65 4.166 -13.768 5.830 1.00 0.00 H new ATOM 0 HB THR A 65 4.624 -15.640 4.300 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.055 -14.075 2.060 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.934 -15.128 2.555 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.415 -14.520 4.145 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.070 -13.394 2.932 1.00 0.00 H new ATOM 999 N ILE A 66 7.226 -13.181 4.795 1.00 0.00 N ATOM 1000 CA ILE A 66 8.633 -13.287 5.174 1.00 0.00 C ATOM 1001 C ILE A 66 8.857 -12.728 6.578 1.00 0.00 C ATOM 1002 O ILE A 66 9.496 -13.364 7.412 1.00 0.00 O ATOM 1003 CB ILE A 66 9.504 -12.512 4.178 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.475 -13.218 2.818 1.00 0.00 C ATOM 1005 CG2 ILE A 66 10.952 -12.455 4.687 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.062 -12.292 1.751 1.00 0.00 C ATOM 0 H ILE A 66 7.049 -12.603 3.973 1.00 0.00 H new ATOM 0 HA ILE A 66 8.910 -14.341 5.163 1.00 0.00 H new ATOM 0 HB ILE A 66 9.116 -11.499 4.076 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.047 -14.145 2.865 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.451 -13.488 2.558 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.566 -11.903 3.975 1.00 0.00 H new ATOM 0 HG22 ILE A 66 10.978 -11.953 5.654 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.341 -13.468 4.793 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.042 -12.793 0.783 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.472 -11.377 1.698 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.091 -12.045 2.010 1.00 0.00 H new ATOM 1018 N LEU A 67 8.328 -11.535 6.830 1.00 0.00 N ATOM 1019 CA LEU A 67 8.483 -10.901 8.135 1.00 0.00 C ATOM 1020 C LEU A 67 7.789 -11.723 9.216 1.00 0.00 C ATOM 1021 O LEU A 67 8.284 -11.842 10.340 1.00 0.00 O ATOM 1022 CB LEU A 67 7.885 -9.478 8.109 1.00 0.00 C ATOM 1023 CG LEU A 67 8.760 -8.553 7.238 1.00 0.00 C ATOM 1024 CD1 LEU A 67 7.940 -7.331 6.798 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.999 -8.068 8.040 1.00 0.00 C ATOM 0 H LEU A 67 7.792 -10.991 6.154 1.00 0.00 H new ATOM 0 HA LEU A 67 9.547 -10.843 8.362 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.869 -9.509 7.714 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.821 -9.083 9.123 1.00 0.00 H new ATOM 0 HG LEU A 67 9.094 -9.112 6.364 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.560 -6.679 6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.076 -7.661 6.221 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.601 -6.785 7.678 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.607 -7.416 7.412 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.669 -7.518 8.922 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.592 -8.929 8.350 1.00 0.00 H new ATOM 1037 N ALA A 68 6.637 -12.284 8.869 1.00 0.00 N ATOM 1038 CA ALA A 68 5.880 -13.071 9.830 1.00 0.00 C ATOM 1039 C ALA A 68 6.711 -14.220 10.381 1.00 0.00 C ATOM 1040 O ALA A 68 6.845 -14.368 11.592 1.00 0.00 O ATOM 1041 CB ALA A 68 4.640 -13.650 9.149 1.00 0.00 C ATOM 0 H ALA A 68 6.213 -12.210 7.944 1.00 0.00 H new ATOM 0 HA ALA A 68 5.597 -12.415 10.653 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.072 -14.240 9.868 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.018 -12.837 8.774 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.945 -14.286 8.318 1.00 0.00 H new ATOM 1047 N VAL A 69 7.283 -15.010 9.488 1.00 0.00 N ATOM 1048 CA VAL A 69 8.105 -16.141 9.892 1.00 0.00 C ATOM 1049 C VAL A 69 9.443 -15.670 10.452 1.00 0.00 C ATOM 1050 O VAL A 69 10.137 -16.411 11.137 1.00 0.00 O ATOM 1051 CB VAL A 69 8.335 -17.082 8.696 1.00 0.00 C ATOM 1052 CG1 VAL A 69 6.982 -17.619 8.185 1.00 0.00 C ATOM 1053 CG2 VAL A 69 9.034 -16.315 7.575 1.00 0.00 C ATOM 0 H VAL A 69 7.194 -14.890 8.479 1.00 0.00 H new ATOM 0 HA VAL A 69 7.577 -16.683 10.677 1.00 0.00 H new ATOM 0 HB VAL A 69 8.957 -17.919 9.011 1.00 0.00 H new ATOM 0 HG11 VAL A 69 7.151 -18.284 7.338 1.00 0.00 H new ATOM 0 HG12 VAL A 69 6.483 -18.168 8.984 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.355 -16.785 7.871 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.198 -16.980 6.727 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.411 -15.477 7.264 1.00 0.00 H new ATOM 0 HG23 VAL A 69 9.993 -15.941 7.933 1.00 0.00 H new ATOM 1063 N ASP A 70 9.813 -14.443 10.131 1.00 0.00 N ATOM 1064 CA ASP A 70 11.075 -13.891 10.599 1.00 0.00 C ATOM 1065 C ASP A 70 11.053 -13.581 12.104 1.00 0.00 C ATOM 1066 O ASP A 70 12.081 -13.674 12.776 1.00 0.00 O ATOM 1067 CB ASP A 70 11.391 -12.605 9.832 1.00 0.00 C ATOM 1068 CG ASP A 70 12.815 -12.152 10.129 1.00 0.00 C ATOM 1069 OD1 ASP A 70 13.362 -12.600 11.122 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.337 -11.360 9.361 1.00 0.00 O ATOM 0 H ASP A 70 9.261 -13.811 9.551 1.00 0.00 H new ATOM 0 HA ASP A 70 11.843 -14.644 10.421 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.271 -12.772 8.762 1.00 0.00 H new ATOM 0 HB3 ASP A 70 10.686 -11.822 10.114 1.00 0.00 H new ATOM 1075 N ASN A 71 9.877 -13.193 12.627 1.00 0.00 N ATOM 1076 CA ASN A 71 9.743 -12.837 14.056 1.00 0.00 C ATOM 1077 C ASN A 71 8.810 -13.775 14.845 1.00 0.00 C ATOM 1078 O ASN A 71 9.090 -14.124 15.992 1.00 0.00 O ATOM 1079 CB ASN A 71 9.173 -11.423 14.151 1.00 0.00 C ATOM 1080 CG ASN A 71 9.933 -10.489 13.215 1.00 0.00 C ATOM 1081 OD1 ASN A 71 9.346 -9.923 12.293 1.00 0.00 O ATOM 1082 ND2 ASN A 71 11.209 -10.295 13.397 1.00 0.00 N ATOM 0 H ASN A 71 9.013 -13.117 12.091 1.00 0.00 H new ATOM 0 HA ASN A 71 10.737 -12.922 14.495 1.00 0.00 H new ATOM 0 HB2 ASN A 71 8.115 -11.431 13.890 1.00 0.00 H new ATOM 0 HB3 ASN A 71 9.246 -11.061 15.177 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.724 -9.673 12.774 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.692 -10.766 14.162 1.00 0.00 H new ATOM 1089 N LEU A 72 7.702 -14.172 14.227 1.00 0.00 N ATOM 1090 CA LEU A 72 6.718 -15.030 14.904 1.00 0.00 C ATOM 1091 C LEU A 72 7.184 -16.486 14.993 1.00 0.00 C ATOM 1092 O LEU A 72 6.781 -17.223 15.891 1.00 0.00 O ATOM 1093 CB LEU A 72 5.387 -14.967 14.147 1.00 0.00 C ATOM 1094 CG LEU A 72 4.954 -13.495 13.977 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.593 -13.445 13.279 1.00 0.00 C ATOM 1096 CD2 LEU A 72 4.851 -12.800 15.353 1.00 0.00 C ATOM 0 H LEU A 72 7.459 -13.920 13.269 1.00 0.00 H new ATOM 0 HA LEU A 72 6.599 -14.659 15.922 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.490 -15.441 13.171 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.622 -15.521 14.691 1.00 0.00 H new ATOM 0 HG LEU A 72 5.700 -12.975 13.376 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.284 -12.407 13.157 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.669 -13.918 12.300 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.855 -13.975 13.882 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.545 -11.763 15.215 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.114 -13.317 15.968 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.821 -12.829 15.849 1.00 0.00 H new ATOM 1108 N ASN A 73 8.038 -16.891 14.065 1.00 0.00 N ATOM 1109 CA ASN A 73 8.548 -18.261 14.058 1.00 0.00 C ATOM 1110 C ASN A 73 9.451 -18.500 15.264 1.00 0.00 C ATOM 1111 O ASN A 73 10.459 -17.817 15.445 1.00 0.00 O ATOM 1112 CB ASN A 73 9.338 -18.515 12.780 1.00 0.00 C ATOM 1113 CG ASN A 73 9.644 -20.003 12.632 1.00 0.00 C ATOM 1114 OD1 ASN A 73 9.498 -20.768 13.586 1.00 0.00 O ATOM 1115 ND2 ASN A 73 10.062 -20.460 11.483 1.00 0.00 N ATOM 0 H ASN A 73 8.392 -16.300 13.313 1.00 0.00 H new ATOM 0 HA ASN A 73 7.700 -18.944 14.106 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.769 -18.166 11.918 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.268 -17.946 12.800 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.269 -21.453 11.374 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.182 -19.824 10.694 1.00 0.00 H new ATOM 1122 N GLY A 74 9.083 -19.475 16.086 1.00 0.00 N ATOM 1123 CA GLY A 74 9.868 -19.795 17.273 1.00 0.00 C ATOM 1124 C GLY A 74 9.561 -18.827 18.410 1.00 0.00 C ATOM 1125 O GLY A 74 10.270 -18.793 19.416 1.00 0.00 O ATOM 0 H GLY A 74 8.253 -20.054 15.955 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.653 -20.815 17.591 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.930 -19.754 17.033 1.00 0.00 H new ATOM 1129 N PHE A 75 8.501 -18.034 18.246 1.00 0.00 N ATOM 1130 CA PHE A 75 8.104 -17.061 19.269 1.00 0.00 C ATOM 1131 C PHE A 75 6.883 -17.555 20.031 1.00 0.00 C ATOM 1132 O PHE A 75 5.908 -18.010 19.432 1.00 0.00 O ATOM 1133 CB PHE A 75 7.779 -15.711 18.621 1.00 0.00 C ATOM 1134 CG PHE A 75 7.282 -14.749 19.675 1.00 0.00 C ATOM 1135 CD1 PHE A 75 8.196 -14.033 20.458 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.905 -14.577 19.870 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.734 -13.146 21.435 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.444 -13.686 20.849 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.357 -12.971 21.631 1.00 0.00 C ATOM 0 H PHE A 75 7.904 -18.045 17.419 1.00 0.00 H new ATOM 0 HA PHE A 75 8.936 -16.941 19.962 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.667 -15.307 18.135 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.023 -15.841 17.847 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.257 -14.166 20.307 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.200 -15.130 19.267 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.439 -12.595 22.040 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.383 -13.551 21.000 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.001 -12.285 22.385 1.00 0.00 H new ATOM 1149 N LYS A 76 6.945 -17.464 21.355 1.00 0.00 N ATOM 1150 CA LYS A 76 5.835 -17.901 22.187 1.00 0.00 C ATOM 1151 C LYS A 76 4.757 -16.824 22.209 1.00 0.00 C ATOM 1152 O LYS A 76 4.966 -15.736 22.748 1.00 0.00 O ATOM 1153 CB LYS A 76 6.327 -18.187 23.611 1.00 0.00 C ATOM 1154 CG LYS A 76 7.689 -18.899 23.560 1.00 0.00 C ATOM 1155 CD LYS A 76 7.945 -19.648 24.888 1.00 0.00 C ATOM 1156 CE LYS A 76 7.389 -21.076 24.792 1.00 0.00 C ATOM 1157 NZ LYS A 76 8.186 -21.851 23.799 1.00 0.00 N ATOM 0 H LYS A 76 7.745 -17.095 21.869 1.00 0.00 H new ATOM 0 HA LYS A 76 5.414 -18.817 21.773 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.415 -17.255 24.169 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.602 -18.807 24.138 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.710 -19.602 22.727 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.482 -18.172 23.384 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.014 -19.677 25.100 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.470 -19.117 25.713 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.431 -21.561 25.767 1.00 0.00 H new ATOM 0 HE3 LYS A 76 6.341 -21.051 24.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.191 -22.856 24.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.762 -21.746 22.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.162 -21.492 23.781 1.00 0.00 H new ATOM 1171 N ILE A 77 3.603 -17.130 21.616 1.00 0.00 N ATOM 1172 CA ILE A 77 2.499 -16.174 21.567 1.00 0.00 C ATOM 1173 C ILE A 77 1.505 -16.442 22.702 1.00 0.00 C ATOM 1174 O ILE A 77 0.912 -17.517 22.767 1.00 0.00 O ATOM 1175 CB ILE A 77 1.779 -16.265 20.192 1.00 0.00 C ATOM 1176 CG1 ILE A 77 0.965 -14.961 19.942 1.00 0.00 C ATOM 1177 CG2 ILE A 77 0.836 -17.483 20.167 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.774 -13.985 19.072 1.00 0.00 C ATOM 0 H ILE A 77 3.410 -18.025 21.167 1.00 0.00 H new ATOM 0 HA ILE A 77 2.902 -15.169 21.692 1.00 0.00 H new ATOM 0 HB ILE A 77 2.525 -16.382 19.406 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.022 -15.201 19.450 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.717 -14.491 20.894 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.337 -17.537 19.199 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.413 -18.393 20.329 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.090 -17.382 20.955 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.193 -13.078 18.906 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.705 -13.731 19.579 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.999 -14.453 18.114 1.00 0.00 H new ATOM 1190 N GLY A 78 1.323 -15.460 23.597 1.00 0.00 N ATOM 1191 CA GLY A 78 0.383 -15.602 24.724 1.00 0.00 C ATOM 1192 C GLY A 78 0.140 -17.069 25.080 1.00 0.00 C ATOM 1193 O GLY A 78 -0.995 -17.543 25.060 1.00 0.00 O ATOM 0 H GLY A 78 1.809 -14.564 23.565 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.777 -15.077 25.594 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.565 -15.128 24.469 1.00 0.00 H new ATOM 1197 N GLY A 79 1.219 -17.790 25.387 1.00 0.00 N ATOM 1198 CA GLY A 79 1.118 -19.210 25.727 1.00 0.00 C ATOM 1199 C GLY A 79 2.183 -20.033 25.001 1.00 0.00 C ATOM 1200 O GLY A 79 3.378 -19.883 25.254 1.00 0.00 O ATOM 0 H GLY A 79 2.168 -17.417 25.407 1.00 0.00 H new ATOM 0 HA2 GLY A 79 1.229 -19.337 26.804 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.127 -19.580 25.463 1.00 0.00 H new ATOM 1204 N ARG A 80 1.741 -20.908 24.093 1.00 0.00 N ATOM 1205 CA ARG A 80 2.663 -21.761 23.335 1.00 0.00 C ATOM 1206 C ARG A 80 3.073 -21.092 22.020 1.00 0.00 C ATOM 1207 O ARG A 80 2.523 -20.060 21.640 1.00 0.00 O ATOM 1208 CB ARG A 80 2.000 -23.110 23.037 1.00 0.00 C ATOM 1209 CG ARG A 80 0.696 -22.887 22.260 1.00 0.00 C ATOM 1210 CD ARG A 80 0.129 -24.238 21.819 1.00 0.00 C ATOM 1211 NE ARG A 80 -0.253 -25.033 22.989 1.00 0.00 N ATOM 1212 CZ ARG A 80 0.579 -25.931 23.526 1.00 0.00 C ATOM 1213 NH1 ARG A 80 1.770 -26.110 23.015 1.00 0.00 N ATOM 1214 NH2 ARG A 80 0.210 -26.629 24.564 1.00 0.00 N ATOM 0 H ARG A 80 0.756 -21.045 23.865 1.00 0.00 H new ATOM 0 HA ARG A 80 3.557 -21.916 23.939 1.00 0.00 H new ATOM 0 HB2 ARG A 80 2.677 -23.738 22.458 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.794 -23.638 23.968 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.027 -22.363 22.885 1.00 0.00 H new ATOM 0 HG3 ARG A 80 0.881 -22.257 21.390 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.738 -24.084 21.176 1.00 0.00 H new ATOM 0 HD3 ARG A 80 0.871 -24.777 21.230 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.175 -24.898 23.403 1.00 0.00 H new ATOM 0 HH11 ARG A 80 2.065 -25.564 22.206 1.00 0.00 H new ATOM 0 HH12 ARG A 80 2.404 -26.796 23.426 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.716 -26.491 24.969 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.847 -27.313 24.971 1.00 0.00 H new ATOM 1228 N ALA A 81 4.048 -21.686 21.331 1.00 0.00 N ATOM 1229 CA ALA A 81 4.521 -21.139 20.058 1.00 0.00 C ATOM 1230 C ALA A 81 3.613 -21.561 18.911 1.00 0.00 C ATOM 1231 O ALA A 81 3.175 -22.710 18.849 1.00 0.00 O ATOM 1232 CB ALA A 81 5.946 -21.621 19.782 1.00 0.00 C ATOM 0 H ALA A 81 4.522 -22.538 21.629 1.00 0.00 H new ATOM 0 HA ALA A 81 4.507 -20.051 20.130 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.292 -21.210 18.833 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.605 -21.287 20.584 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.959 -22.710 19.732 1.00 0.00 H new ATOM 1238 N LEU A 82 3.334 -20.625 18.003 1.00 0.00 N ATOM 1239 CA LEU A 82 2.475 -20.904 16.853 1.00 0.00 C ATOM 1240 C LEU A 82 3.318 -21.415 15.676 1.00 0.00 C ATOM 1241 O LEU A 82 4.506 -21.113 15.569 1.00 0.00 O ATOM 1242 CB LEU A 82 1.700 -19.629 16.441 1.00 0.00 C ATOM 1243 CG LEU A 82 2.527 -18.378 16.781 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.886 -18.448 16.072 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.772 -17.126 16.318 1.00 0.00 C ATOM 0 H LEU A 82 3.690 -19.670 18.042 1.00 0.00 H new ATOM 0 HA LEU A 82 1.756 -21.675 17.131 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.485 -19.654 15.373 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.741 -19.593 16.958 1.00 0.00 H new ATOM 0 HG LEU A 82 2.685 -18.331 17.858 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.469 -17.560 16.315 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.423 -19.337 16.402 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.732 -18.497 14.994 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.357 -16.238 16.559 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.613 -17.175 15.241 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.809 -17.074 16.825 1.00 0.00 H new ATOM 1257 N LYS A 83 2.694 -22.188 14.790 1.00 0.00 N ATOM 1258 CA LYS A 83 3.399 -22.737 13.627 1.00 0.00 C ATOM 1259 C LYS A 83 3.116 -21.909 12.373 1.00 0.00 C ATOM 1260 O LYS A 83 1.972 -21.817 11.930 1.00 0.00 O ATOM 1261 CB LYS A 83 2.958 -24.182 13.393 1.00 0.00 C ATOM 1262 CG LYS A 83 3.728 -24.771 12.208 1.00 0.00 C ATOM 1263 CD LYS A 83 3.364 -26.244 12.044 1.00 0.00 C ATOM 1264 CE LYS A 83 4.138 -26.830 10.864 1.00 0.00 C ATOM 1265 NZ LYS A 83 3.612 -26.264 9.591 1.00 0.00 N ATOM 0 H LYS A 83 1.710 -22.449 14.851 1.00 0.00 H new ATOM 0 HA LYS A 83 4.470 -22.704 13.829 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.138 -24.777 14.288 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.886 -24.218 13.197 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.488 -24.223 11.297 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.801 -24.667 12.370 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.600 -26.792 12.956 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.292 -26.349 11.878 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.199 -26.603 10.964 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.044 -27.916 10.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 3.255 -27.034 8.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.839 -25.600 9.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 4.375 -25.762 9.093 1.00 0.00 H new ATOM 1279 N ILE A 84 4.168 -21.310 11.801 1.00 0.00 N ATOM 1280 CA ILE A 84 4.023 -20.481 10.594 1.00 0.00 C ATOM 1281 C ILE A 84 4.694 -21.175 9.409 1.00 0.00 C ATOM 1282 O ILE A 84 5.868 -21.541 9.470 1.00 0.00 O ATOM 1283 CB ILE A 84 4.657 -19.082 10.808 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.341 -18.562 12.245 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.084 -18.095 9.761 1.00 0.00 C ATOM 1286 CD1 ILE A 84 2.929 -17.958 12.306 1.00 0.00 C ATOM 0 H ILE A 84 5.124 -21.382 12.150 1.00 0.00 H new ATOM 0 HA ILE A 84 2.960 -20.351 10.389 1.00 0.00 H new ATOM 0 HB ILE A 84 5.738 -19.157 10.690 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.423 -19.381 12.960 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.076 -17.811 12.535 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.527 -17.110 9.908 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.318 -18.452 8.758 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.002 -18.027 9.879 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.729 -17.602 13.317 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.859 -17.125 11.607 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.196 -18.719 12.038 1.00 0.00 H new ATOM 1298 N ASP A 85 3.942 -21.352 8.333 1.00 0.00 N ATOM 1299 CA ASP A 85 4.474 -22.006 7.139 1.00 0.00 C ATOM 1300 C ASP A 85 3.664 -21.622 5.910 1.00 0.00 C ATOM 1301 O ASP A 85 2.476 -21.355 6.007 1.00 0.00 O ATOM 1302 CB ASP A 85 4.434 -23.528 7.321 1.00 0.00 C ATOM 1303 CG ASP A 85 5.365 -24.200 6.315 1.00 0.00 C ATOM 1304 OD1 ASP A 85 5.178 -23.981 5.129 1.00 0.00 O ATOM 1305 OD2 ASP A 85 6.249 -24.922 6.744 1.00 0.00 O ATOM 0 H ASP A 85 2.969 -21.056 8.258 1.00 0.00 H new ATOM 0 HA ASP A 85 5.504 -21.679 6.996 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.733 -23.789 8.336 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.416 -23.892 7.185 1.00 0.00 H new ATOM 1310 N HIS A 86 4.320 -21.596 4.753 1.00 0.00 N ATOM 1311 CA HIS A 86 3.641 -21.242 3.512 1.00 0.00 C ATOM 1312 C HIS A 86 2.934 -22.462 2.930 1.00 0.00 C ATOM 1313 O HIS A 86 3.368 -23.597 3.133 1.00 0.00 O ATOM 1314 CB HIS A 86 4.653 -20.705 2.497 1.00 0.00 C ATOM 1315 CG HIS A 86 5.299 -19.462 3.042 1.00 0.00 C ATOM 1316 ND1 HIS A 86 6.409 -18.883 2.447 1.00 0.00 N ATOM 1317 CD2 HIS A 86 5.007 -18.678 4.129 1.00 0.00 C ATOM 1318 CE1 HIS A 86 6.741 -17.801 3.173 1.00 0.00 C ATOM 1319 NE2 HIS A 86 5.917 -17.630 4.210 1.00 0.00 N ATOM 0 H HIS A 86 5.311 -21.814 4.650 1.00 0.00 H new ATOM 0 HA HIS A 86 2.901 -20.471 3.728 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.411 -21.460 2.289 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.155 -20.485 1.553 1.00 0.00 H new ATOM 0 HD1 HIS A 86 6.887 -19.217 1.610 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.193 -18.849 4.818 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.572 -17.150 2.945 1.00 0.00 H new ATOM 1328 N THR A 87 1.843 -22.224 2.203 1.00 0.00 N ATOM 1329 CA THR A 87 1.082 -23.317 1.594 1.00 0.00 C ATOM 1330 C THR A 87 0.490 -22.878 0.255 1.00 0.00 C ATOM 1331 O THR A 87 0.307 -21.686 0.009 1.00 0.00 O ATOM 1332 CB THR A 87 -0.049 -23.751 2.534 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.656 -24.931 2.024 1.00 0.00 O ATOM 1334 CG2 THR A 87 -1.096 -22.638 2.637 1.00 0.00 C ATOM 0 H THR A 87 1.468 -21.293 2.022 1.00 0.00 H new ATOM 0 HA THR A 87 1.758 -24.155 1.423 1.00 0.00 H new ATOM 0 HB THR A 87 0.360 -23.948 3.525 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.378 -25.212 2.623 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.897 -22.953 3.306 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.629 -21.735 3.029 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.508 -22.434 1.649 1.00 0.00 H new ATOM 1342 N PHE A 88 0.195 -23.851 -0.609 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.373 -23.551 -1.927 1.00 0.00 C ATOM 1344 C PHE A 88 -1.863 -23.870 -1.944 1.00 0.00 C ATOM 1345 O PHE A 88 -2.486 -23.898 -3.001 1.00 0.00 O ATOM 1346 CB PHE A 88 0.334 -24.374 -3.004 1.00 0.00 C ATOM 1347 CG PHE A 88 1.817 -24.094 -2.960 1.00 0.00 C ATOM 1348 CD1 PHE A 88 2.334 -22.947 -3.571 1.00 0.00 C ATOM 1349 CD2 PHE A 88 2.675 -24.986 -2.303 1.00 0.00 C ATOM 1350 CE1 PHE A 88 3.710 -22.689 -3.525 1.00 0.00 C ATOM 1351 CE2 PHE A 88 4.050 -24.728 -2.258 1.00 0.00 C ATOM 1352 CZ PHE A 88 4.568 -23.581 -2.869 1.00 0.00 C ATOM 0 H PHE A 88 0.338 -24.844 -0.424 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.230 -22.490 -2.131 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.149 -25.436 -2.845 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.065 -24.125 -3.987 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.672 -22.260 -4.078 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.276 -25.872 -1.832 1.00 0.00 H new ATOM 0 HE1 PHE A 88 4.109 -21.803 -3.995 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.712 -25.415 -1.751 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.629 -23.383 -2.835 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.428 -24.110 -0.767 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.851 -24.428 -0.664 1.00 0.00 C ATOM 1364 C TYR A 89 -4.693 -23.429 -1.469 1.00 0.00 C ATOM 1365 O TYR A 89 -4.501 -22.219 -1.368 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.282 -24.408 0.815 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.794 -24.373 0.909 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.549 -25.474 0.487 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.436 -23.235 1.412 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -7.947 -25.435 0.566 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.833 -23.197 1.492 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.589 -24.297 1.067 1.00 0.00 C ATOM 1373 OH TYR A 89 -9.966 -24.259 1.145 1.00 0.00 O ATOM 0 H TYR A 89 -1.930 -24.091 0.123 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.015 -25.424 -1.076 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -3.897 -25.290 1.327 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.857 -23.538 1.315 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -6.054 -26.353 0.101 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.853 -22.386 1.738 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -8.530 -26.284 0.240 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.328 -22.320 1.881 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.249 -23.397 1.516 1.00 0.00 H new ATOM 2031 N PHE B 311 13.429 -5.115 5.669 1.00 0.00 N ATOM 2032 CA PHE B 311 12.470 -4.172 5.093 1.00 0.00 C ATOM 2033 C PHE B 311 11.624 -3.550 6.207 1.00 0.00 C ATOM 2034 O PHE B 311 10.745 -4.204 6.767 1.00 0.00 O ATOM 2035 CB PHE B 311 11.559 -4.895 4.057 1.00 0.00 C ATOM 2036 CG PHE B 311 11.937 -6.362 3.972 1.00 0.00 C ATOM 2037 CD1 PHE B 311 13.083 -6.755 3.271 1.00 0.00 C ATOM 2038 CD2 PHE B 311 11.149 -7.322 4.602 1.00 0.00 C ATOM 2039 CE1 PHE B 311 13.431 -8.110 3.205 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.495 -8.674 4.536 1.00 0.00 C ATOM 2041 CZ PHE B 311 12.632 -9.068 3.842 1.00 0.00 C ATOM 0 HA PHE B 311 13.014 -3.380 4.578 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.513 -4.796 4.348 1.00 0.00 H new ATOM 0 HB3 PHE B 311 11.663 -4.426 3.078 1.00 0.00 H new ATOM 0 HD1 PHE B 311 13.698 -6.014 2.782 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.266 -7.020 5.145 1.00 0.00 H new ATOM 0 HE1 PHE B 311 14.314 -8.416 2.664 1.00 0.00 H new ATOM 0 HE2 PHE B 311 10.878 -9.413 5.025 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.900 -10.113 3.794 1.00 0.00 H new ATOM 2051 N ALA B 312 11.894 -2.285 6.518 1.00 0.00 N ATOM 2052 CA ALA B 312 11.151 -1.593 7.564 1.00 0.00 C ATOM 2053 C ALA B 312 9.799 -1.117 7.045 1.00 0.00 C ATOM 2054 O ALA B 312 9.676 -0.001 6.538 1.00 0.00 O ATOM 2055 CB ALA B 312 11.955 -0.393 8.065 1.00 0.00 C ATOM 0 H ALA B 312 12.615 -1.724 6.065 1.00 0.00 H new ATOM 0 HA ALA B 312 10.984 -2.292 8.384 1.00 0.00 H new ATOM 0 HB1 ALA B 312 11.394 0.120 8.846 1.00 0.00 H new ATOM 0 HB2 ALA B 312 12.908 -0.736 8.468 1.00 0.00 H new ATOM 0 HB3 ALA B 312 12.137 0.294 7.238 1.00 0.00 H new ATOM 2061 N ILE B 313 8.787 -1.970 7.173 1.00 0.00 N ATOM 2062 CA ILE B 313 7.442 -1.626 6.711 1.00 0.00 C ATOM 2063 C ILE B 313 6.654 -0.965 7.840 1.00 0.00 C ATOM 2064 O ILE B 313 6.645 -1.451 8.971 1.00 0.00 O ATOM 2065 CB ILE B 313 6.707 -2.882 6.243 1.00 0.00 C ATOM 2066 CG1 ILE B 313 7.545 -3.596 5.174 1.00 0.00 C ATOM 2067 CG2 ILE B 313 5.359 -2.489 5.639 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.899 -4.943 4.821 1.00 0.00 C ATOM 0 H ILE B 313 8.869 -2.898 7.589 1.00 0.00 H new ATOM 0 HA ILE B 313 7.528 -0.930 5.876 1.00 0.00 H new ATOM 0 HB ILE B 313 6.550 -3.546 7.093 1.00 0.00 H new ATOM 0 HG12 ILE B 313 7.620 -2.974 4.282 1.00 0.00 H new ATOM 0 HG13 ILE B 313 8.560 -3.754 5.540 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.835 -3.385 5.305 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.759 -1.976 6.391 1.00 0.00 H new ATOM 0 HG23 ILE B 313 5.521 -1.825 4.790 1.00 0.00 H new ATOM 0 HD11 ILE B 313 7.498 -5.446 4.062 1.00 0.00 H new ATOM 0 HD12 ILE B 313 6.847 -5.566 5.714 1.00 0.00 H new ATOM 0 HD13 ILE B 313 5.893 -4.774 4.437 1.00 0.00 H new ATOM 2080 N MET B 314 5.995 0.146 7.524 1.00 0.00 N ATOM 2081 CA MET B 314 5.216 0.868 8.525 1.00 0.00 C ATOM 2082 C MET B 314 4.076 -0.005 9.081 1.00 0.00 C ATOM 2083 O MET B 314 3.480 -0.792 8.346 1.00 0.00 O ATOM 2084 CB MET B 314 4.630 2.139 7.906 1.00 0.00 C ATOM 2085 CG MET B 314 5.761 3.121 7.589 1.00 0.00 C ATOM 2086 SD MET B 314 6.443 3.777 9.135 1.00 0.00 S ATOM 2087 CE MET B 314 8.190 3.734 8.658 1.00 0.00 C ATOM 0 H MET B 314 5.984 0.563 6.593 1.00 0.00 H new ATOM 0 HA MET B 314 5.881 1.129 9.348 1.00 0.00 H new ATOM 0 HB2 MET B 314 4.081 1.894 6.997 1.00 0.00 H new ATOM 0 HB3 MET B 314 3.919 2.597 8.594 1.00 0.00 H new ATOM 0 HG2 MET B 314 6.543 2.620 7.018 1.00 0.00 H new ATOM 0 HG3 MET B 314 5.386 3.936 6.970 1.00 0.00 H new ATOM 0 HE1 MET B 314 8.801 4.104 9.481 1.00 0.00 H new ATOM 0 HE2 MET B 314 8.478 2.709 8.424 1.00 0.00 H new ATOM 0 HE3 MET B 314 8.343 4.363 7.781 1.00 0.00 H new ATOM 2097 N PRO B 315 3.764 0.121 10.364 1.00 0.00 N ATOM 2098 CA PRO B 315 2.678 -0.673 11.019 1.00 0.00 C ATOM 2099 C PRO B 315 1.285 -0.227 10.570 1.00 0.00 C ATOM 2100 O PRO B 315 1.100 0.901 10.114 1.00 0.00 O ATOM 2101 CB PRO B 315 2.887 -0.408 12.518 1.00 0.00 C ATOM 2102 CG PRO B 315 3.573 0.919 12.590 1.00 0.00 C ATOM 2103 CD PRO B 315 4.420 1.034 11.319 1.00 0.00 C ATOM 0 HA PRO B 315 2.730 -1.730 10.759 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.936 -0.389 13.051 1.00 0.00 H new ATOM 0 HB3 PRO B 315 3.493 -1.190 12.975 1.00 0.00 H new ATOM 0 HG2 PRO B 315 2.847 1.730 12.648 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.197 0.986 13.481 1.00 0.00 H new ATOM 0 HD2 PRO B 315 4.438 2.057 10.944 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.454 0.743 11.502 1.00 0.00 H new ATOM 2111 N GLY B 316 0.308 -1.121 10.706 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.068 -0.809 10.315 1.00 0.00 C ATOM 2113 C GLY B 316 -1.871 -0.298 11.507 1.00 0.00 C ATOM 2114 O GLY B 316 -1.574 -0.623 12.654 1.00 0.00 O ATOM 0 H GLY B 316 0.440 -2.060 11.081 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.064 -0.058 9.525 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.545 -1.700 9.905 1.00 0.00 H new ATOM 2118 N SER B 317 -2.891 0.503 11.227 1.00 0.00 N ATOM 2119 CA SER B 317 -3.734 1.053 12.284 1.00 0.00 C ATOM 2120 C SER B 317 -4.442 -0.063 13.048 1.00 0.00 C ATOM 2121 O SER B 317 -4.606 0.008 14.265 1.00 0.00 O ATOM 2122 CB SER B 317 -4.772 2.000 11.684 1.00 0.00 C ATOM 2123 OG SER B 317 -4.115 3.141 11.147 1.00 0.00 O ATOM 0 H SER B 317 -3.155 0.786 10.283 1.00 0.00 H new ATOM 0 HA SER B 317 -3.097 1.602 12.978 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.337 1.491 10.903 1.00 0.00 H new ATOM 0 HB3 SER B 317 -5.487 2.304 12.448 1.00 0.00 H new ATOM 0 HG SER B 317 -4.779 3.749 10.760 1.00 0.00 H new ATOM 2129 N ARG B 318 -4.865 -1.092 12.321 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.560 -2.217 12.937 1.00 0.00 C ATOM 2131 C ARG B 318 -4.690 -2.874 14.011 1.00 0.00 C ATOM 2132 O ARG B 318 -5.176 -3.671 14.813 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.945 -3.253 11.870 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.764 -4.405 12.515 1.00 0.00 C ATOM 2135 CD ARG B 318 -7.935 -4.787 11.607 1.00 0.00 C ATOM 2136 NE ARG B 318 -8.923 -3.713 11.588 1.00 0.00 N ATOM 2137 CZ ARG B 318 -10.083 -3.858 10.956 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -10.355 -4.974 10.338 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -10.950 -2.882 10.953 1.00 0.00 N ATOM 0 H ARG B 318 -4.740 -1.171 11.312 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.466 -1.838 13.410 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -6.530 -2.776 11.084 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -5.047 -3.654 11.400 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -6.123 -5.271 12.679 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.136 -4.095 13.491 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -7.575 -4.979 10.596 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.395 -5.709 11.962 1.00 0.00 H new ATOM 0 HE ARG B 318 -8.720 -2.836 12.068 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -9.677 -5.736 10.340 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -11.246 -5.085 9.853 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -10.737 -2.009 11.435 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -11.841 -2.992 10.468 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.403 -2.534 14.019 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.472 -3.096 14.996 1.00 0.00 C ATOM 2155 C TRP B 319 -2.879 -2.725 16.420 1.00 0.00 C ATOM 2156 O TRP B 319 -2.410 -3.316 17.392 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.047 -2.598 14.726 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.107 -3.169 15.748 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.256 -4.363 16.370 1.00 0.00 C ATOM 2160 CD2 TRP B 319 1.121 -2.590 16.272 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.796 -4.552 17.240 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.672 -3.489 17.218 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.803 -1.386 16.025 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.852 -3.205 17.891 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.997 -1.096 16.703 1.00 0.00 C ATOM 2166 CH2 TRP B 319 3.521 -2.004 17.635 1.00 0.00 C ATOM 0 H TRP B 319 -2.982 -1.875 13.364 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.501 -4.181 14.895 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.733 -2.892 13.725 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.020 -1.509 14.761 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -1.069 -5.056 16.210 1.00 0.00 H new ATOM 0 HE1 TRP B 319 0.912 -5.377 17.828 1.00 0.00 H new ATOM 0 HE3 TRP B 319 1.406 -0.681 15.310 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.251 -3.907 18.608 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 3.515 -0.169 16.506 1.00 0.00 H new ATOM 0 HH2 TRP B 319 4.440 -1.776 18.154 1.00 0.00 H new ATOM 2177 N ASP B 320 -3.739 -1.733 16.539 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.204 -1.284 17.850 1.00 0.00 C ATOM 2179 C ASP B 320 -3.022 -0.916 18.751 1.00 0.00 C ATOM 2180 O ASP B 320 -3.205 -0.541 19.909 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.036 -2.388 18.508 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.395 -2.504 17.823 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -6.761 -1.582 17.112 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -7.053 -3.512 18.023 1.00 0.00 O ATOM 0 H ASP B 320 -4.133 -1.220 15.751 1.00 0.00 H new ATOM 0 HA ASP B 320 -4.820 -0.396 17.713 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -4.507 -3.339 18.445 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -5.172 -2.169 19.567 1.00 0.00 H new ATOM 2189 N GLY B 321 -1.810 -1.023 18.213 1.00 0.00 N ATOM 2190 CA GLY B 321 -0.612 -0.692 18.977 1.00 0.00 C ATOM 2191 C GLY B 321 -0.344 -1.724 20.074 1.00 0.00 C ATOM 2192 O GLY B 321 0.353 -1.438 21.048 1.00 0.00 O ATOM 0 H GLY B 321 -1.632 -1.334 17.258 1.00 0.00 H new ATOM 0 HA2 GLY B 321 0.246 -0.641 18.307 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -0.726 0.295 19.425 1.00 0.00 H new ATOM 2196 N VAL B 322 -0.902 -2.922 19.910 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.714 -3.993 20.890 1.00 0.00 C ATOM 2198 C VAL B 322 0.737 -4.476 20.877 1.00 0.00 C ATOM 2199 O VAL B 322 1.391 -4.473 19.839 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.661 -5.165 20.588 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.253 -6.394 21.414 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -3.094 -4.770 20.957 1.00 0.00 C ATOM 0 H VAL B 322 -1.485 -3.176 19.113 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.945 -3.600 21.880 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.602 -5.405 19.526 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.929 -7.221 21.195 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.233 -6.682 21.159 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -1.307 -6.153 22.476 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.767 -5.600 20.743 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -3.143 -4.528 22.019 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.394 -3.900 20.372 1.00 0.00 H new ATOM 2212 N HIS B 323 1.229 -4.888 22.039 1.00 0.00 N ATOM 2213 CA HIS B 323 2.607 -5.362 22.148 1.00 0.00 C ATOM 2214 C HIS B 323 2.787 -6.690 21.410 1.00 0.00 C ATOM 2215 O HIS B 323 2.258 -7.720 21.826 1.00 0.00 O ATOM 2216 CB HIS B 323 2.971 -5.549 23.621 1.00 0.00 C ATOM 2217 CG HIS B 323 2.509 -4.355 24.409 1.00 0.00 C ATOM 2218 ND1 HIS B 323 1.995 -4.470 25.692 1.00 0.00 N ATOM 2219 CD2 HIS B 323 2.470 -3.016 24.107 1.00 0.00 C ATOM 2220 CE1 HIS B 323 1.673 -3.233 26.112 1.00 0.00 C ATOM 2221 NE2 HIS B 323 1.943 -2.309 25.185 1.00 0.00 N ATOM 0 H HIS B 323 0.702 -4.905 22.912 1.00 0.00 H new ATOM 0 HA HIS B 323 3.262 -4.619 21.694 1.00 0.00 H new ATOM 0 HB2 HIS B 323 2.506 -6.456 24.009 1.00 0.00 H new ATOM 0 HB3 HIS B 323 4.049 -5.673 23.727 1.00 0.00 H new ATOM 0 HD2 HIS B 323 2.798 -2.578 23.176 1.00 0.00 H new ATOM 0 HE1 HIS B 323 1.248 -3.014 27.080 1.00 0.00 H new ATOM 0 HE2 HIS B 323 1.795 -1.302 25.253 1.00 0.00 H new ATOM 2230 N ARG B 324 3.542 -6.659 20.304 1.00 0.00 N ATOM 2231 CA ARG B 324 3.791 -7.872 19.507 1.00 0.00 C ATOM 2232 C ARG B 324 5.272 -7.976 19.153 1.00 0.00 C ATOM 2233 O ARG B 324 5.960 -6.965 19.010 1.00 0.00 O ATOM 2234 CB ARG B 324 2.944 -7.843 18.222 1.00 0.00 C ATOM 2235 CG ARG B 324 1.444 -7.749 18.574 1.00 0.00 C ATOM 2236 CD ARG B 324 0.947 -9.088 19.142 1.00 0.00 C ATOM 2237 NE ARG B 324 -0.506 -9.079 19.281 1.00 0.00 N ATOM 2238 CZ ARG B 324 -1.144 -10.083 19.875 1.00 0.00 C ATOM 2239 NH1 ARG B 324 -0.470 -11.096 20.348 1.00 0.00 N ATOM 2240 NH2 ARG B 324 -2.444 -10.055 19.987 1.00 0.00 N ATOM 0 H ARG B 324 3.988 -5.817 19.941 1.00 0.00 H new ATOM 0 HA ARG B 324 3.509 -8.743 20.098 1.00 0.00 H new ATOM 0 HB2 ARG B 324 3.234 -6.992 17.606 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.131 -8.741 17.634 1.00 0.00 H new ATOM 0 HG2 ARG B 324 1.283 -6.954 19.303 1.00 0.00 H new ATOM 0 HG3 ARG B 324 0.870 -7.487 17.685 1.00 0.00 H new ATOM 0 HD2 ARG B 324 1.250 -9.903 18.485 1.00 0.00 H new ATOM 0 HD3 ARG B 324 1.409 -9.272 20.112 1.00 0.00 H new ATOM 0 HE ARG B 324 -1.040 -8.290 18.917 1.00 0.00 H new ATOM 0 HH11 ARG B 324 0.546 -11.117 20.262 1.00 0.00 H new ATOM 0 HH12 ARG B 324 -0.960 -11.866 20.804 1.00 0.00 H new ATOM 0 HH21 ARG B 324 -2.971 -9.263 19.619 1.00 0.00 H new ATOM 0 HH22 ARG B 324 -2.933 -10.825 20.443 1.00 0.00 H new ATOM 2254 N SER B 325 5.758 -9.207 19.013 1.00 0.00 N ATOM 2255 CA SER B 325 7.163 -9.430 18.677 1.00 0.00 C ATOM 2256 C SER B 325 7.374 -9.359 17.169 1.00 0.00 C ATOM 2257 O SER B 325 7.010 -10.280 16.436 1.00 0.00 O ATOM 2258 CB SER B 325 7.606 -10.800 19.189 1.00 0.00 C ATOM 2259 OG SER B 325 8.881 -11.115 18.645 1.00 0.00 O ATOM 0 H SER B 325 5.207 -10.058 19.125 1.00 0.00 H new ATOM 0 HA SER B 325 7.759 -8.650 19.151 1.00 0.00 H new ATOM 0 HB2 SER B 325 7.653 -10.796 20.278 1.00 0.00 H new ATOM 0 HB3 SER B 325 6.878 -11.560 18.904 1.00 0.00 H new ATOM 0 HG SER B 325 9.199 -11.961 19.024 1.00 0.00 H new ATOM 2286 N PHE B 328 9.514 -4.592 17.497 1.00 0.00 N ATOM 2287 CA PHE B 328 10.272 -4.184 18.672 1.00 0.00 C ATOM 2288 C PHE B 328 11.629 -3.608 18.268 1.00 0.00 C ATOM 2289 O PHE B 328 12.106 -2.643 18.854 1.00 0.00 O ATOM 2290 CB PHE B 328 10.475 -5.378 19.604 1.00 0.00 C ATOM 2291 CG PHE B 328 11.113 -4.912 20.891 1.00 0.00 C ATOM 2292 CD1 PHE B 328 10.318 -4.369 21.907 1.00 0.00 C ATOM 2293 CD2 PHE B 328 12.497 -5.020 21.068 1.00 0.00 C ATOM 2294 CE1 PHE B 328 10.907 -3.935 23.101 1.00 0.00 C ATOM 2295 CE2 PHE B 328 13.087 -4.587 22.261 1.00 0.00 C ATOM 2296 CZ PHE B 328 12.292 -4.045 23.279 1.00 0.00 C ATOM 0 HA PHE B 328 9.707 -3.411 19.193 1.00 0.00 H new ATOM 0 HB2 PHE B 328 9.518 -5.856 19.813 1.00 0.00 H new ATOM 0 HB3 PHE B 328 11.106 -6.125 19.123 1.00 0.00 H new ATOM 0 HD1 PHE B 328 9.250 -4.285 21.770 1.00 0.00 H new ATOM 0 HD2 PHE B 328 13.110 -5.438 20.283 1.00 0.00 H new ATOM 0 HE1 PHE B 328 10.293 -3.516 23.885 1.00 0.00 H new ATOM 0 HE2 PHE B 328 14.155 -4.671 22.397 1.00 0.00 H new ATOM 0 HZ PHE B 328 12.747 -3.712 24.200 1.00 0.00 H new ATOM 2306 N GLU B 329 12.247 -4.209 17.264 1.00 0.00 N ATOM 2307 CA GLU B 329 13.553 -3.757 16.793 1.00 0.00 C ATOM 2308 C GLU B 329 13.491 -2.308 16.308 1.00 0.00 C ATOM 2309 O GLU B 329 14.515 -1.634 16.202 1.00 0.00 O ATOM 2310 CB GLU B 329 14.037 -4.661 15.655 1.00 0.00 C ATOM 2311 CG GLU B 329 14.282 -6.076 16.191 1.00 0.00 C ATOM 2312 CD GLU B 329 12.949 -6.780 16.436 1.00 0.00 C ATOM 2313 OE1 GLU B 329 11.957 -6.337 15.881 1.00 0.00 O ATOM 2314 OE2 GLU B 329 12.941 -7.748 17.177 1.00 0.00 O ATOM 0 H GLU B 329 11.869 -5.010 16.758 1.00 0.00 H new ATOM 0 HA GLU B 329 14.253 -3.811 17.627 1.00 0.00 H new ATOM 0 HB2 GLU B 329 13.295 -4.687 14.857 1.00 0.00 H new ATOM 0 HB3 GLU B 329 14.955 -4.261 15.224 1.00 0.00 H new ATOM 0 HG2 GLU B 329 14.878 -6.646 15.478 1.00 0.00 H new ATOM 0 HG3 GLU B 329 14.853 -6.029 17.118 1.00 0.00 H new ATOM 2321 N GLU B 330 12.285 -1.837 16.005 1.00 0.00 N ATOM 2322 CA GLU B 330 12.110 -0.471 15.513 1.00 0.00 C ATOM 2323 C GLU B 330 12.956 0.516 16.324 1.00 0.00 C ATOM 2324 O GLU B 330 13.575 1.420 15.764 1.00 0.00 O ATOM 2325 CB GLU B 330 10.632 -0.073 15.611 1.00 0.00 C ATOM 2326 CG GLU B 330 10.236 0.083 17.084 1.00 0.00 C ATOM 2327 CD GLU B 330 8.718 0.167 17.213 1.00 0.00 C ATOM 2328 OE1 GLU B 330 8.055 0.163 16.190 1.00 0.00 O ATOM 2329 OE2 GLU B 330 8.242 0.231 18.334 1.00 0.00 O ATOM 0 H GLU B 330 11.421 -2.373 16.090 1.00 0.00 H new ATOM 0 HA GLU B 330 12.436 -0.437 14.474 1.00 0.00 H new ATOM 0 HB2 GLU B 330 10.461 0.862 15.077 1.00 0.00 H new ATOM 0 HB3 GLU B 330 10.009 -0.830 15.135 1.00 0.00 H new ATOM 0 HG2 GLU B 330 10.612 -0.762 17.661 1.00 0.00 H new ATOM 0 HG3 GLU B 330 10.694 0.981 17.499 1.00 0.00 H new ATOM 2336 N LYS B 331 12.983 0.334 17.646 1.00 0.00 N ATOM 2337 CA LYS B 331 13.765 1.218 18.515 1.00 0.00 C ATOM 2338 C LYS B 331 15.261 0.961 18.329 1.00 0.00 C ATOM 2339 O LYS B 331 16.074 1.880 18.425 1.00 0.00 O ATOM 2340 CB LYS B 331 13.374 0.992 19.989 1.00 0.00 C ATOM 2341 CG LYS B 331 13.077 -0.496 20.220 1.00 0.00 C ATOM 2342 CD LYS B 331 13.247 -0.849 21.706 1.00 0.00 C ATOM 2343 CE LYS B 331 12.138 -0.183 22.521 1.00 0.00 C ATOM 2344 NZ LYS B 331 12.233 -0.626 23.941 1.00 0.00 N ATOM 0 H LYS B 331 12.480 -0.407 18.134 1.00 0.00 H new ATOM 0 HA LYS B 331 13.550 2.251 18.243 1.00 0.00 H new ATOM 0 HB2 LYS B 331 14.182 1.318 20.644 1.00 0.00 H new ATOM 0 HB3 LYS B 331 12.499 1.591 20.240 1.00 0.00 H new ATOM 0 HG2 LYS B 331 12.061 -0.725 19.899 1.00 0.00 H new ATOM 0 HG3 LYS B 331 13.748 -1.106 19.615 1.00 0.00 H new ATOM 0 HD2 LYS B 331 13.211 -1.930 21.840 1.00 0.00 H new ATOM 0 HD3 LYS B 331 14.223 -0.516 22.060 1.00 0.00 H new ATOM 0 HE2 LYS B 331 12.228 0.902 22.460 1.00 0.00 H new ATOM 0 HE3 LYS B 331 11.163 -0.445 22.111 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 11.396 -0.299 24.464 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 12.280 -1.664 23.978 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 13.089 -0.225 24.373 1.00 0.00 H new ATOM 2358 N TRP B 332 15.612 -0.293 18.068 1.00 0.00 N ATOM 2359 CA TRP B 332 17.012 -0.659 17.874 1.00 0.00 C ATOM 2360 C TRP B 332 17.593 0.068 16.664 1.00 0.00 C ATOM 2361 O TRP B 332 18.682 0.641 16.733 1.00 0.00 O ATOM 2362 CB TRP B 332 17.136 -2.171 17.676 1.00 0.00 C ATOM 2363 CG TRP B 332 18.580 -2.550 17.595 1.00 0.00 C ATOM 2364 CD1 TRP B 332 19.352 -2.896 18.652 1.00 0.00 C ATOM 2365 CD2 TRP B 332 19.438 -2.623 16.419 1.00 0.00 C ATOM 2366 NE1 TRP B 332 20.628 -3.179 18.197 1.00 0.00 N ATOM 2367 CE2 TRP B 332 20.731 -3.025 16.829 1.00 0.00 C ATOM 2368 CE3 TRP B 332 19.220 -2.382 15.051 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 21.772 -3.184 15.913 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 20.265 -2.541 14.127 1.00 0.00 C ATOM 2371 CH2 TRP B 332 21.539 -2.940 14.558 1.00 0.00 C ATOM 0 H TRP B 332 14.954 -1.068 17.986 1.00 0.00 H new ATOM 0 HA TRP B 332 17.572 -0.365 18.762 1.00 0.00 H new ATOM 0 HB2 TRP B 332 16.658 -2.696 18.502 1.00 0.00 H new ATOM 0 HB3 TRP B 332 16.619 -2.472 16.765 1.00 0.00 H new ATOM 0 HD1 TRP B 332 19.026 -2.943 19.681 1.00 0.00 H new ATOM 0 HE1 TRP B 332 21.399 -3.467 18.800 1.00 0.00 H new ATOM 0 HE3 TRP B 332 18.243 -2.073 14.709 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 22.750 -3.493 16.250 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 20.087 -2.355 13.078 1.00 0.00 H new ATOM 0 HH2 TRP B 332 22.339 -3.058 13.842 1.00 0.00 H new ATOM 2382 N PHE B 333 16.858 0.042 15.555 1.00 0.00 N ATOM 2383 CA PHE B 333 17.304 0.707 14.334 1.00 0.00 C ATOM 2384 C PHE B 333 17.387 2.216 14.554 1.00 0.00 C ATOM 2385 O PHE B 333 18.302 2.875 14.059 1.00 0.00 O ATOM 2386 CB PHE B 333 16.337 0.400 13.179 1.00 0.00 C ATOM 2387 CG PHE B 333 16.625 -0.977 12.618 1.00 0.00 C ATOM 2388 CD1 PHE B 333 17.697 -1.158 11.735 1.00 0.00 C ATOM 2389 CD2 PHE B 333 15.825 -2.067 12.981 1.00 0.00 C ATOM 2390 CE1 PHE B 333 17.969 -2.430 11.217 1.00 0.00 C ATOM 2391 CE2 PHE B 333 16.097 -3.338 12.462 1.00 0.00 C ATOM 2392 CZ PHE B 333 17.169 -3.518 11.579 1.00 0.00 C ATOM 0 H PHE B 333 15.957 -0.429 15.477 1.00 0.00 H new ATOM 0 HA PHE B 333 18.295 0.332 14.076 1.00 0.00 H new ATOM 0 HB2 PHE B 333 15.307 0.450 13.532 1.00 0.00 H new ATOM 0 HB3 PHE B 333 16.442 1.151 12.396 1.00 0.00 H new ATOM 0 HD1 PHE B 333 18.313 -0.317 11.454 1.00 0.00 H new ATOM 0 HD2 PHE B 333 14.998 -1.927 13.661 1.00 0.00 H new ATOM 0 HE1 PHE B 333 18.797 -2.571 10.538 1.00 0.00 H new ATOM 0 HE2 PHE B 333 15.481 -4.179 12.742 1.00 0.00 H new ATOM 0 HZ PHE B 333 17.378 -4.498 11.177 1.00 0.00 H new ATOM 2402 N ALA B 334 16.426 2.755 15.296 1.00 0.00 N ATOM 2403 CA ALA B 334 16.403 4.187 15.572 1.00 0.00 C ATOM 2404 C ALA B 334 17.657 4.607 16.332 1.00 0.00 C ATOM 2405 O ALA B 334 18.245 5.649 16.050 1.00 0.00 O ATOM 2406 CB ALA B 334 15.165 4.539 16.400 1.00 0.00 C ATOM 0 H ALA B 334 15.659 2.228 15.714 1.00 0.00 H new ATOM 0 HA ALA B 334 16.371 4.720 14.622 1.00 0.00 H new ATOM 0 HB1 ALA B 334 15.155 5.610 16.602 1.00 0.00 H new ATOM 0 HB2 ALA B 334 14.267 4.266 15.846 1.00 0.00 H new ATOM 0 HB3 ALA B 334 15.190 3.992 17.343 1.00 0.00 H new ATOM 2412 N LYS B 335 18.063 3.788 17.295 1.00 0.00 N ATOM 2413 CA LYS B 335 19.249 4.091 18.091 1.00 0.00 C ATOM 2414 C LYS B 335 20.481 4.144 17.199 1.00 0.00 C ATOM 2415 O LYS B 335 21.326 5.022 17.355 1.00 0.00 O ATOM 2416 CB LYS B 335 19.434 3.015 19.169 1.00 0.00 C ATOM 2417 CG LYS B 335 18.296 3.110 20.211 1.00 0.00 C ATOM 2418 CD LYS B 335 18.645 4.156 21.284 1.00 0.00 C ATOM 2419 CE LYS B 335 17.583 4.139 22.385 1.00 0.00 C ATOM 2420 NZ LYS B 335 17.990 5.066 23.478 1.00 0.00 N ATOM 0 H LYS B 335 17.594 2.917 17.543 1.00 0.00 H new ATOM 0 HA LYS B 335 19.118 5.063 18.567 1.00 0.00 H new ATOM 0 HB2 LYS B 335 19.437 2.026 18.711 1.00 0.00 H new ATOM 0 HB3 LYS B 335 20.399 3.142 19.660 1.00 0.00 H new ATOM 0 HG2 LYS B 335 17.363 3.382 19.718 1.00 0.00 H new ATOM 0 HG3 LYS B 335 18.138 2.138 20.678 1.00 0.00 H new ATOM 0 HD2 LYS B 335 19.626 3.942 21.708 1.00 0.00 H new ATOM 0 HD3 LYS B 335 18.701 5.147 20.835 1.00 0.00 H new ATOM 0 HE2 LYS B 335 16.617 4.440 21.979 1.00 0.00 H new ATOM 0 HE3 LYS B 335 17.464 3.128 22.776 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 17.269 5.056 24.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 18.903 4.760 23.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 18.082 6.030 23.099 1.00 0.00 H new ATOM 2434 N GLN B 336 20.572 3.202 16.263 1.00 0.00 N ATOM 2435 CA GLN B 336 21.705 3.157 15.344 1.00 0.00 C ATOM 2436 C GLN B 336 21.714 4.396 14.462 1.00 0.00 C ATOM 2437 O GLN B 336 22.768 4.957 14.169 1.00 0.00 O ATOM 2438 CB GLN B 336 21.625 1.899 14.472 1.00 0.00 C ATOM 2439 CG GLN B 336 21.863 0.656 15.336 1.00 0.00 C ATOM 2440 CD GLN B 336 23.298 0.643 15.852 1.00 0.00 C ATOM 2441 OE1 GLN B 336 24.243 0.715 15.065 1.00 0.00 O ATOM 2442 NE2 GLN B 336 23.521 0.553 17.135 1.00 0.00 N ATOM 0 H GLN B 336 19.881 2.465 16.122 1.00 0.00 H new ATOM 0 HA GLN B 336 22.626 3.129 15.926 1.00 0.00 H new ATOM 0 HB2 GLN B 336 20.648 1.839 13.992 1.00 0.00 H new ATOM 0 HB3 GLN B 336 22.368 1.948 13.676 1.00 0.00 H new ATOM 0 HG2 GLN B 336 21.167 0.648 16.175 1.00 0.00 H new ATOM 0 HG3 GLN B 336 21.670 -0.244 14.753 1.00 0.00 H new ATOM 0 HE21 GLN B 336 22.738 0.493 17.786 1.00 0.00 H new ATOM 0 HE22 GLN B 336 24.478 0.542 17.487 1.00 0.00 H new ATOM 2451 N ASN B 337 20.531 4.819 14.041 1.00 0.00 N ATOM 2452 CA ASN B 337 20.408 5.998 13.196 1.00 0.00 C ATOM 2453 C ASN B 337 20.907 7.231 13.942 1.00 0.00 C ATOM 2454 O ASN B 337 21.557 8.101 13.361 1.00 0.00 O ATOM 2455 CB ASN B 337 18.951 6.197 12.778 1.00 0.00 C ATOM 2456 CG ASN B 337 18.850 7.323 11.754 1.00 0.00 C ATOM 2457 OD1 ASN B 337 19.648 8.260 11.781 1.00 0.00 O ATOM 2458 ND2 ASN B 337 17.913 7.285 10.847 1.00 0.00 N ATOM 0 H ASN B 337 19.646 4.366 14.269 1.00 0.00 H new ATOM 0 HA ASN B 337 21.015 5.854 12.303 1.00 0.00 H new ATOM 0 HB2 ASN B 337 18.556 5.273 12.355 1.00 0.00 H new ATOM 0 HB3 ASN B 337 18.343 6.433 13.651 1.00 0.00 H new ATOM 0 HD21 ASN B 337 17.840 8.033 10.157 1.00 0.00 H new ATOM 0 HD22 ASN B 337 17.253 6.507 10.827 1.00 0.00 H new ATOM 2465 N GLU B 338 20.599 7.296 15.235 1.00 0.00 N ATOM 2466 CA GLU B 338 21.013 8.427 16.057 1.00 0.00 C ATOM 2467 C GLU B 338 22.535 8.567 16.066 1.00 0.00 C ATOM 2468 O GLU B 338 23.067 9.665 16.221 1.00 0.00 O ATOM 2469 CB GLU B 338 20.511 8.244 17.493 1.00 0.00 C ATOM 2470 CG GLU B 338 18.997 8.457 17.537 1.00 0.00 C ATOM 2471 CD GLU B 338 18.463 8.116 18.924 1.00 0.00 C ATOM 2472 OE1 GLU B 338 19.201 7.523 19.693 1.00 0.00 O ATOM 2473 OE2 GLU B 338 17.323 8.453 19.198 1.00 0.00 O ATOM 0 H GLU B 338 20.067 6.582 15.733 1.00 0.00 H new ATOM 0 HA GLU B 338 20.580 9.332 15.630 1.00 0.00 H new ATOM 0 HB2 GLU B 338 20.759 7.245 17.851 1.00 0.00 H new ATOM 0 HB3 GLU B 338 21.008 8.952 18.156 1.00 0.00 H new ATOM 0 HG2 GLU B 338 18.760 9.492 17.291 1.00 0.00 H new ATOM 0 HG3 GLU B 338 18.511 7.832 16.787 1.00 0.00 H new