USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=18 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 Single : A 12 TYR OH : rot 180:sc= -0.339 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0157 K(o=-0.016,f=-1.4!) USER MOD Single : A 19 ASN : amide:sc= -0.899 K(o=-0.9,f=-9.2!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 72:sc= 0.153 USER MOD Single : A 32 SER OG : rot 100:sc= -1.24 USER MOD Single : A 34 TYR OH : rot -153:sc= 0.83 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0.753 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 SER OG : rot 160:sc= 0 USER MOD Single : A 65 THR OG1 : rot -72:sc= 0.848 USER MOD Single : A 71 ASN : amide:sc= -3.08! C(o=-3.1!,f=-4.5!) USER MOD Single : A 73 ASN : amide:sc=-0.00262 X(o=-0.0026,f=-0.14) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.231 X(o=-0.23,f=-0.0025) USER MOD Single : A 87 THR OG1 : rot -40:sc= -3.02! USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 314 MET CE :methyl 148:sc= 0 (180deg=-0.0512) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= 0.492 K(o=0.49,f=-2.2!) USER MOD Single : B 325 SER OG : rot -150:sc= 2.35 USER MOD Single : B 331 LYS NZ :NH3+ -151:sc= -0.195 (180deg=-1.05) USER MOD Single : B 335 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.114) USER MOD Single : B 336 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.22) USER MOD Single : B 337 ASN : amide:sc= -0.0393 K(o=-0.039,f=-1) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.931 -14.747 -2.403 1.00 0.00 N ATOM 143 CA ALA A 11 -0.053 -15.454 -1.472 1.00 0.00 C ATOM 144 C ALA A 11 -0.783 -15.767 -0.166 1.00 0.00 C ATOM 145 O ALA A 11 -1.503 -14.923 0.369 1.00 0.00 O ATOM 146 CB ALA A 11 1.183 -14.604 -1.173 1.00 0.00 C ATOM 0 HA ALA A 11 0.251 -16.392 -1.936 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.832 -15.137 -0.479 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.724 -14.410 -2.099 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.875 -13.658 -0.728 1.00 0.00 H new ATOM 152 N TYR A 12 -0.595 -16.984 0.343 1.00 0.00 N ATOM 153 CA TYR A 12 -1.234 -17.399 1.594 1.00 0.00 C ATOM 154 C TYR A 12 -0.215 -18.047 2.527 1.00 0.00 C ATOM 155 O TYR A 12 0.845 -18.494 2.092 1.00 0.00 O ATOM 156 CB TYR A 12 -2.373 -18.395 1.302 1.00 0.00 C ATOM 157 CG TYR A 12 -3.627 -17.641 0.922 1.00 0.00 C ATOM 158 CD1 TYR A 12 -3.810 -17.203 -0.393 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.602 -17.377 1.891 1.00 0.00 C ATOM 160 CE1 TYR A 12 -4.970 -16.502 -0.741 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.762 -16.677 1.544 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.945 -16.238 0.228 1.00 0.00 C ATOM 163 OH TYR A 12 -7.089 -15.543 -0.114 1.00 0.00 O ATOM 0 H TYR A 12 -0.008 -17.698 -0.088 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.644 -16.514 2.080 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.083 -19.067 0.494 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.561 -19.014 2.179 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -3.057 -17.406 -1.140 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.458 -17.714 2.907 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -5.113 -16.165 -1.757 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.516 -16.476 2.291 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.662 -15.447 0.676 1.00 0.00 H new ATOM 173 N ILE A 13 -0.547 -18.099 3.816 1.00 0.00 N ATOM 174 CA ILE A 13 0.339 -18.720 4.806 1.00 0.00 C ATOM 175 C ILE A 13 -0.466 -19.615 5.749 1.00 0.00 C ATOM 176 O ILE A 13 -1.605 -19.301 6.102 1.00 0.00 O ATOM 177 CB ILE A 13 1.072 -17.647 5.613 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.063 -16.631 6.141 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.088 -16.933 4.719 1.00 0.00 C ATOM 180 CD1 ILE A 13 0.725 -15.749 7.208 1.00 0.00 C ATOM 0 H ILE A 13 -1.414 -17.723 4.199 1.00 0.00 H new ATOM 0 HA ILE A 13 1.073 -19.328 4.277 1.00 0.00 H new ATOM 0 HB ILE A 13 1.591 -18.117 6.448 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.307 -16.013 5.323 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.798 -17.147 6.565 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.608 -16.169 5.297 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.810 -17.656 4.340 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.570 -16.464 3.882 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.001 -15.025 7.582 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.073 -16.373 8.031 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.572 -15.221 6.770 1.00 0.00 H new ATOM 192 N TYR A 14 0.134 -20.734 6.157 1.00 0.00 N ATOM 193 CA TYR A 14 -0.537 -21.671 7.058 1.00 0.00 C ATOM 194 C TYR A 14 -0.170 -21.377 8.510 1.00 0.00 C ATOM 195 O TYR A 14 1.002 -21.412 8.878 1.00 0.00 O ATOM 196 CB TYR A 14 -0.134 -23.108 6.712 1.00 0.00 C ATOM 197 CG TYR A 14 -0.764 -24.063 7.697 1.00 0.00 C ATOM 198 CD1 TYR A 14 -2.035 -24.589 7.444 1.00 0.00 C ATOM 199 CD2 TYR A 14 -0.076 -24.420 8.862 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.619 -25.474 8.358 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.660 -25.304 9.777 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.932 -25.830 9.524 1.00 0.00 C ATOM 203 OH TYR A 14 -2.510 -26.701 10.427 1.00 0.00 O ATOM 0 H TYR A 14 1.076 -21.012 5.880 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.614 -21.554 6.935 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.454 -23.352 5.699 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.951 -23.208 6.737 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.565 -24.313 6.545 1.00 0.00 H new ATOM 0 HD2 TYR A 14 0.906 -24.013 9.055 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.600 -25.882 8.163 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -0.130 -25.580 10.677 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.900 -26.843 11.181 1.00 0.00 H new ATOM 213 N ILE A 15 -1.180 -21.087 9.331 1.00 0.00 N ATOM 214 CA ILE A 15 -0.947 -20.787 10.745 1.00 0.00 C ATOM 215 C ILE A 15 -1.537 -21.896 11.620 1.00 0.00 C ATOM 216 O ILE A 15 -2.745 -22.141 11.597 1.00 0.00 O ATOM 217 CB ILE A 15 -1.587 -19.443 11.109 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.051 -18.353 10.176 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.237 -19.082 12.558 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.876 -17.075 10.354 1.00 0.00 C ATOM 0 H ILE A 15 -2.159 -21.053 9.045 1.00 0.00 H new ATOM 0 HA ILE A 15 0.127 -20.729 10.920 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.669 -19.519 11.002 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.002 -18.155 10.396 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.101 -18.689 9.140 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.693 -18.126 12.815 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.614 -19.855 13.227 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.155 -19.008 12.663 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.494 -16.300 9.690 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.919 -17.279 10.112 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.803 -16.736 11.387 1.00 0.00 H new ATOM 232 N GLY A 16 -0.680 -22.562 12.390 1.00 0.00 N ATOM 233 CA GLY A 16 -1.126 -23.653 13.265 1.00 0.00 C ATOM 234 C GLY A 16 -0.602 -23.466 14.683 1.00 0.00 C ATOM 235 O GLY A 16 0.073 -22.481 14.979 1.00 0.00 O ATOM 0 H GLY A 16 0.321 -22.370 12.429 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.215 -23.691 13.278 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.779 -24.607 12.868 1.00 0.00 H new ATOM 239 N ASN A 17 -0.922 -24.420 15.556 1.00 0.00 N ATOM 240 CA ASN A 17 -0.480 -24.350 16.942 1.00 0.00 C ATOM 241 C ASN A 17 -0.884 -23.019 17.562 1.00 0.00 C ATOM 242 O ASN A 17 -0.109 -22.406 18.296 1.00 0.00 O ATOM 243 CB ASN A 17 1.040 -24.511 17.012 1.00 0.00 C ATOM 244 CG ASN A 17 1.439 -25.902 16.531 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.635 -26.832 16.582 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.641 -26.100 16.064 1.00 0.00 N ATOM 0 H ASN A 17 -1.481 -25.242 15.328 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.955 -25.157 17.500 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.523 -23.752 16.397 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.384 -24.358 18.035 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.916 -27.027 15.740 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.306 -25.327 16.023 1.00 0.00 H new ATOM 253 N LEU A 18 -2.105 -22.576 17.264 1.00 0.00 N ATOM 254 CA LEU A 18 -2.608 -21.310 17.797 1.00 0.00 C ATOM 255 C LEU A 18 -3.497 -21.563 19.018 1.00 0.00 C ATOM 256 O LEU A 18 -4.047 -22.649 19.186 1.00 0.00 O ATOM 257 CB LEU A 18 -3.409 -20.559 16.711 1.00 0.00 C ATOM 258 CG LEU A 18 -4.078 -21.568 15.762 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.027 -22.473 16.557 1.00 0.00 C ATOM 260 CD2 LEU A 18 -4.873 -20.814 14.690 1.00 0.00 C ATOM 0 H LEU A 18 -2.761 -23.071 16.660 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.759 -20.698 18.101 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.166 -19.927 17.176 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.747 -19.901 16.148 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.310 -22.177 15.285 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.500 -23.187 15.882 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.463 -23.012 17.318 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.794 -21.864 17.036 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.347 -21.529 14.018 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.639 -20.203 15.168 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.200 -20.173 14.121 1.00 0.00 H new ATOM 272 N ASN A 19 -3.630 -20.549 19.865 1.00 0.00 N ATOM 273 CA ASN A 19 -4.454 -20.670 21.065 1.00 0.00 C ATOM 274 C ASN A 19 -5.937 -20.643 20.703 1.00 0.00 C ATOM 275 O ASN A 19 -6.342 -19.975 19.753 1.00 0.00 O ATOM 276 CB ASN A 19 -4.136 -19.526 22.032 1.00 0.00 C ATOM 277 CG ASN A 19 -4.667 -19.856 23.423 1.00 0.00 C ATOM 278 OD1 ASN A 19 -5.422 -20.816 23.589 1.00 0.00 O ATOM 279 ND2 ASN A 19 -4.318 -19.116 24.438 1.00 0.00 N ATOM 0 H ASN A 19 -3.182 -19.640 19.746 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.230 -21.623 21.545 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.059 -19.363 22.074 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -4.585 -18.600 21.673 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -4.670 -19.331 25.371 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -3.693 -18.322 24.299 1.00 0.00 H new ATOM 286 N ARG A 20 -6.742 -21.373 21.465 1.00 0.00 N ATOM 287 CA ARG A 20 -8.179 -21.424 21.211 1.00 0.00 C ATOM 288 C ARG A 20 -8.812 -20.062 21.449 1.00 0.00 C ATOM 289 O ARG A 20 -9.681 -19.629 20.692 1.00 0.00 O ATOM 290 CB ARG A 20 -8.831 -22.450 22.134 1.00 0.00 C ATOM 291 CG ARG A 20 -8.064 -23.770 22.050 1.00 0.00 C ATOM 292 CD ARG A 20 -8.671 -24.776 23.027 1.00 0.00 C ATOM 293 NE ARG A 20 -9.819 -25.441 22.421 1.00 0.00 N ATOM 294 CZ ARG A 20 -10.446 -26.434 23.043 1.00 0.00 C ATOM 295 NH1 ARG A 20 -10.039 -26.827 24.220 1.00 0.00 N ATOM 296 NH2 ARG A 20 -11.470 -27.013 22.480 1.00 0.00 N ATOM 0 H ARG A 20 -6.429 -21.934 22.258 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.335 -21.711 20.171 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -8.833 -22.083 23.160 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -9.872 -22.603 21.848 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.106 -24.163 21.034 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -7.012 -23.607 22.286 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -7.922 -25.515 23.311 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.978 -24.266 23.940 1.00 0.00 H new ATOM 0 HE ARG A 20 -10.146 -25.139 21.504 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.240 -26.372 24.662 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.520 -27.589 24.698 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -11.790 -26.704 21.562 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.951 -27.775 22.958 1.00 0.00 H new ATOM 310 N GLU A 21 -8.369 -19.391 22.504 1.00 0.00 N ATOM 311 CA GLU A 21 -8.903 -18.075 22.835 1.00 0.00 C ATOM 312 C GLU A 21 -8.603 -17.076 21.721 1.00 0.00 C ATOM 313 O GLU A 21 -9.365 -16.134 21.496 1.00 0.00 O ATOM 314 CB GLU A 21 -8.289 -17.578 24.146 1.00 0.00 C ATOM 315 CG GLU A 21 -8.817 -18.419 25.308 1.00 0.00 C ATOM 316 CD GLU A 21 -8.089 -18.046 26.596 1.00 0.00 C ATOM 317 OE1 GLU A 21 -7.058 -17.402 26.503 1.00 0.00 O ATOM 318 OE2 GLU A 21 -8.576 -18.408 27.653 1.00 0.00 O ATOM 0 H GLU A 21 -7.648 -19.731 23.140 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.984 -18.161 22.948 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.202 -17.645 24.099 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.537 -16.528 24.301 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.888 -18.258 25.427 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.676 -19.478 25.094 1.00 0.00 H new ATOM 325 N LEU A 22 -7.491 -17.287 21.024 1.00 0.00 N ATOM 326 CA LEU A 22 -7.103 -16.395 19.936 1.00 0.00 C ATOM 327 C LEU A 22 -8.226 -16.294 18.901 1.00 0.00 C ATOM 328 O LEU A 22 -8.544 -17.268 18.221 1.00 0.00 O ATOM 329 CB LEU A 22 -5.808 -16.915 19.262 1.00 0.00 C ATOM 330 CG LEU A 22 -4.665 -15.903 19.451 1.00 0.00 C ATOM 331 CD1 LEU A 22 -4.208 -15.909 20.919 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.487 -16.278 18.547 1.00 0.00 C ATOM 0 H LEU A 22 -6.847 -18.061 21.191 1.00 0.00 H new ATOM 0 HA LEU A 22 -6.918 -15.403 20.348 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.527 -17.876 19.692 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.984 -17.081 18.199 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.020 -14.907 19.186 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.398 -15.191 21.051 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -5.044 -15.634 21.562 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.857 -16.906 21.187 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.680 -15.559 18.684 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.132 -17.275 18.807 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.810 -16.267 17.506 1.00 0.00 H new ATOM 344 N THR A 23 -8.818 -15.108 18.785 1.00 0.00 N ATOM 345 CA THR A 23 -9.901 -14.890 17.826 1.00 0.00 C ATOM 346 C THR A 23 -9.356 -14.293 16.535 1.00 0.00 C ATOM 347 O THR A 23 -8.152 -14.067 16.404 1.00 0.00 O ATOM 348 CB THR A 23 -10.948 -13.947 18.424 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.351 -12.686 18.691 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.493 -14.544 19.723 1.00 0.00 C ATOM 0 H THR A 23 -8.570 -14.288 19.338 1.00 0.00 H new ATOM 0 HA THR A 23 -10.364 -15.851 17.604 1.00 0.00 H new ATOM 0 HB THR A 23 -11.767 -13.817 17.716 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.021 -12.081 19.072 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.238 -13.872 20.148 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.953 -15.510 19.515 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.677 -14.676 20.433 1.00 0.00 H new ATOM 358 N GLU A 24 -10.250 -14.039 15.585 1.00 0.00 N ATOM 359 CA GLU A 24 -9.843 -13.475 14.305 1.00 0.00 C ATOM 360 C GLU A 24 -9.187 -12.113 14.512 1.00 0.00 C ATOM 361 O GLU A 24 -8.152 -11.814 13.914 1.00 0.00 O ATOM 362 CB GLU A 24 -11.062 -13.317 13.394 1.00 0.00 C ATOM 363 CG GLU A 24 -10.599 -13.020 11.967 1.00 0.00 C ATOM 364 CD GLU A 24 -11.787 -12.599 11.108 1.00 0.00 C ATOM 365 OE1 GLU A 24 -12.901 -12.660 11.602 1.00 0.00 O ATOM 366 OE2 GLU A 24 -11.566 -12.223 9.968 1.00 0.00 O ATOM 0 H GLU A 24 -11.251 -14.213 15.676 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.125 -14.151 13.840 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.662 -14.227 13.411 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.698 -12.509 13.757 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -9.849 -12.229 11.977 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -10.125 -13.903 11.539 1.00 0.00 H new ATOM 373 N GLY A 25 -9.794 -11.290 15.363 1.00 0.00 N ATOM 374 CA GLY A 25 -9.258 -9.961 15.639 1.00 0.00 C ATOM 375 C GLY A 25 -7.873 -10.049 16.269 1.00 0.00 C ATOM 376 O GLY A 25 -6.972 -9.286 15.917 1.00 0.00 O ATOM 0 H GLY A 25 -10.650 -11.517 15.869 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.204 -9.388 14.714 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -9.932 -9.425 16.308 1.00 0.00 H new ATOM 380 N ASP A 26 -7.713 -10.981 17.201 1.00 0.00 N ATOM 381 CA ASP A 26 -6.431 -11.154 17.878 1.00 0.00 C ATOM 382 C ASP A 26 -5.339 -11.516 16.879 1.00 0.00 C ATOM 383 O ASP A 26 -4.228 -10.997 16.946 1.00 0.00 O ATOM 384 CB ASP A 26 -6.545 -12.258 18.932 1.00 0.00 C ATOM 385 CG ASP A 26 -7.394 -11.777 20.102 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.577 -10.576 20.225 1.00 0.00 O ATOM 387 OD2 ASP A 26 -7.854 -12.617 20.860 1.00 0.00 O ATOM 0 H ASP A 26 -8.446 -11.623 17.504 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.167 -10.213 18.360 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -6.991 -13.149 18.490 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.553 -12.540 19.284 1.00 0.00 H new ATOM 392 N ILE A 27 -5.666 -12.406 15.950 1.00 0.00 N ATOM 393 CA ILE A 27 -4.704 -12.829 14.940 1.00 0.00 C ATOM 394 C ILE A 27 -4.290 -11.648 14.069 1.00 0.00 C ATOM 395 O ILE A 27 -3.110 -11.473 13.763 1.00 0.00 O ATOM 396 CB ILE A 27 -5.311 -13.925 14.063 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.512 -15.193 14.899 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.369 -14.233 12.893 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.364 -16.193 14.115 1.00 0.00 C ATOM 0 H ILE A 27 -6.583 -12.846 15.875 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.822 -13.220 15.447 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.271 -13.585 13.675 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.547 -15.636 15.145 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.999 -14.946 15.842 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.805 -15.014 12.271 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.224 -13.333 12.296 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.408 -14.571 13.279 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.507 -17.095 14.710 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.334 -15.748 13.892 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.859 -16.449 13.183 1.00 0.00 H new ATOM 411 N LEU A 28 -5.270 -10.841 13.673 1.00 0.00 N ATOM 412 CA LEU A 28 -4.994 -9.685 12.830 1.00 0.00 C ATOM 413 C LEU A 28 -3.999 -8.749 13.505 1.00 0.00 C ATOM 414 O LEU A 28 -3.045 -8.297 12.878 1.00 0.00 O ATOM 415 CB LEU A 28 -6.304 -8.921 12.542 1.00 0.00 C ATOM 416 CG LEU A 28 -7.093 -9.626 11.419 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.579 -9.276 11.532 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.576 -9.159 10.048 1.00 0.00 C ATOM 0 H LEU A 28 -6.252 -10.965 13.920 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.562 -10.039 11.894 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -6.911 -8.870 13.446 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.079 -7.895 12.250 1.00 0.00 H new ATOM 0 HG LEU A 28 -6.959 -10.703 11.517 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.132 -9.776 10.737 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -8.958 -9.605 12.500 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.707 -8.197 11.440 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.136 -9.660 9.258 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.707 -8.081 9.958 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.518 -9.405 9.955 1.00 0.00 H new ATOM 430 N THR A 29 -4.222 -8.468 14.786 1.00 0.00 N ATOM 431 CA THR A 29 -3.345 -7.564 15.530 1.00 0.00 C ATOM 432 C THR A 29 -1.921 -8.104 15.596 1.00 0.00 C ATOM 433 O THR A 29 -0.952 -7.355 15.478 1.00 0.00 O ATOM 434 CB THR A 29 -3.875 -7.372 16.952 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.199 -6.857 16.896 1.00 0.00 O ATOM 436 CG2 THR A 29 -2.975 -6.392 17.706 1.00 0.00 C ATOM 0 H THR A 29 -4.997 -8.849 15.329 1.00 0.00 H new ATOM 0 HA THR A 29 -3.332 -6.608 15.006 1.00 0.00 H new ATOM 0 HB THR A 29 -3.879 -8.330 17.472 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.811 -7.561 16.596 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.354 -6.256 18.719 1.00 0.00 H new ATOM 0 HG22 THR A 29 -1.960 -6.788 17.748 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.969 -5.432 17.189 1.00 0.00 H new ATOM 444 N VAL A 30 -1.798 -9.409 15.792 1.00 0.00 N ATOM 445 CA VAL A 30 -0.483 -10.030 15.902 1.00 0.00 C ATOM 446 C VAL A 30 0.338 -9.807 14.632 1.00 0.00 C ATOM 447 O VAL A 30 1.492 -9.382 14.694 1.00 0.00 O ATOM 448 CB VAL A 30 -0.646 -11.533 16.147 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.722 -12.212 16.084 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.267 -11.762 17.530 1.00 0.00 C ATOM 0 H VAL A 30 -2.583 -10.054 15.878 1.00 0.00 H new ATOM 0 HA VAL A 30 0.045 -9.571 16.738 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.297 -11.956 15.382 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.606 -13.282 16.258 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.163 -12.051 15.101 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.374 -11.789 16.848 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.383 -12.832 17.704 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.617 -11.338 18.295 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.243 -11.279 17.575 1.00 0.00 H new ATOM 460 N PHE A 31 -0.259 -10.100 13.484 1.00 0.00 N ATOM 461 CA PHE A 31 0.424 -9.940 12.202 1.00 0.00 C ATOM 462 C PHE A 31 0.200 -8.542 11.621 1.00 0.00 C ATOM 463 O PHE A 31 0.869 -8.133 10.673 1.00 0.00 O ATOM 464 CB PHE A 31 -0.074 -10.994 11.213 1.00 0.00 C ATOM 465 CG PHE A 31 0.273 -12.372 11.730 1.00 0.00 C ATOM 466 CD1 PHE A 31 1.606 -12.793 11.750 1.00 0.00 C ATOM 467 CD2 PHE A 31 -0.739 -13.227 12.186 1.00 0.00 C ATOM 468 CE1 PHE A 31 1.929 -14.069 12.225 1.00 0.00 C ATOM 469 CE2 PHE A 31 -0.414 -14.503 12.662 1.00 0.00 C ATOM 470 CZ PHE A 31 0.920 -14.925 12.680 1.00 0.00 C ATOM 0 H PHE A 31 -1.214 -10.450 13.412 1.00 0.00 H new ATOM 0 HA PHE A 31 1.493 -10.070 12.372 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.152 -10.904 11.081 1.00 0.00 H new ATOM 0 HB3 PHE A 31 0.381 -10.835 10.235 1.00 0.00 H new ATOM 0 HD1 PHE A 31 2.386 -12.134 11.399 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.769 -12.902 12.170 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.959 -14.394 12.240 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.193 -15.162 13.015 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.171 -15.910 13.045 1.00 0.00 H new ATOM 480 N SER A 32 -0.758 -7.819 12.188 1.00 0.00 N ATOM 481 CA SER A 32 -1.091 -6.484 11.690 1.00 0.00 C ATOM 482 C SER A 32 0.163 -5.654 11.406 1.00 0.00 C ATOM 483 O SER A 32 0.364 -5.179 10.286 1.00 0.00 O ATOM 484 CB SER A 32 -1.947 -5.745 12.714 1.00 0.00 C ATOM 485 OG SER A 32 -1.912 -4.351 12.442 1.00 0.00 O ATOM 0 H SER A 32 -1.315 -8.128 12.985 1.00 0.00 H new ATOM 0 HA SER A 32 -1.640 -6.613 10.757 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.974 -6.108 12.676 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.578 -5.939 13.721 1.00 0.00 H new ATOM 0 HG SER A 32 -2.725 -4.091 11.960 1.00 0.00 H new ATOM 491 N GLU A 33 1.006 -5.488 12.419 1.00 0.00 N ATOM 492 CA GLU A 33 2.229 -4.703 12.271 1.00 0.00 C ATOM 493 C GLU A 33 3.172 -5.337 11.251 1.00 0.00 C ATOM 494 O GLU A 33 3.988 -4.655 10.632 1.00 0.00 O ATOM 495 CB GLU A 33 2.946 -4.585 13.622 1.00 0.00 C ATOM 496 CG GLU A 33 4.119 -3.598 13.504 1.00 0.00 C ATOM 497 CD GLU A 33 5.310 -4.275 12.829 1.00 0.00 C ATOM 498 OE1 GLU A 33 5.398 -5.490 12.905 1.00 0.00 O ATOM 499 OE2 GLU A 33 6.115 -3.571 12.243 1.00 0.00 O ATOM 0 H GLU A 33 0.867 -5.884 13.349 1.00 0.00 H new ATOM 0 HA GLU A 33 1.948 -3.712 11.915 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.248 -4.244 14.386 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.311 -5.562 13.937 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.813 -2.725 12.928 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.406 -3.242 14.494 1.00 0.00 H new ATOM 506 N TYR A 34 3.058 -6.646 11.088 1.00 0.00 N ATOM 507 CA TYR A 34 3.924 -7.380 10.168 1.00 0.00 C ATOM 508 C TYR A 34 3.268 -7.542 8.801 1.00 0.00 C ATOM 509 O TYR A 34 3.455 -8.559 8.135 1.00 0.00 O ATOM 510 CB TYR A 34 4.259 -8.754 10.752 1.00 0.00 C ATOM 511 CG TYR A 34 5.070 -8.579 12.014 1.00 0.00 C ATOM 512 CD1 TYR A 34 6.359 -8.035 11.947 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.536 -8.960 13.252 1.00 0.00 C ATOM 514 CE1 TYR A 34 7.111 -7.872 13.116 1.00 0.00 C ATOM 515 CE2 TYR A 34 5.287 -8.797 14.419 1.00 0.00 C ATOM 516 CZ TYR A 34 6.576 -8.253 14.352 1.00 0.00 C ATOM 517 OH TYR A 34 7.317 -8.091 15.503 1.00 0.00 O ATOM 0 H TYR A 34 2.376 -7.225 11.579 1.00 0.00 H new ATOM 0 HA TYR A 34 4.842 -6.807 10.037 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.342 -9.302 10.969 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.819 -9.343 10.026 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.772 -7.741 10.993 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.543 -9.380 13.304 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.105 -7.452 13.064 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.874 -9.090 15.373 1.00 0.00 H new ATOM 0 HH TYR A 34 7.034 -8.751 16.170 1.00 0.00 H new ATOM 527 N GLY A 35 2.488 -6.537 8.389 1.00 0.00 N ATOM 528 CA GLY A 35 1.812 -6.606 7.095 1.00 0.00 C ATOM 529 C GLY A 35 0.383 -7.112 7.247 1.00 0.00 C ATOM 530 O GLY A 35 0.078 -8.247 6.878 1.00 0.00 O ATOM 0 H GLY A 35 2.313 -5.685 8.921 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.804 -5.619 6.633 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.365 -7.266 6.427 1.00 0.00 H new ATOM 534 N VAL A 36 -0.483 -6.271 7.803 1.00 0.00 N ATOM 535 CA VAL A 36 -1.862 -6.672 8.042 1.00 0.00 C ATOM 536 C VAL A 36 -2.524 -7.160 6.747 1.00 0.00 C ATOM 537 O VAL A 36 -2.466 -6.488 5.717 1.00 0.00 O ATOM 538 CB VAL A 36 -2.660 -5.477 8.591 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.914 -4.457 7.476 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.001 -5.971 9.140 1.00 0.00 C ATOM 0 H VAL A 36 -0.257 -5.319 8.093 1.00 0.00 H new ATOM 0 HA VAL A 36 -1.859 -7.487 8.765 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.087 -5.001 9.387 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.480 -3.615 7.875 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.961 -4.101 7.084 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.482 -4.928 6.674 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.568 -5.126 9.530 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.567 -6.450 8.341 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.824 -6.689 9.941 1.00 0.00 H new ATOM 550 N PRO A 37 -3.149 -8.325 6.789 1.00 0.00 N ATOM 551 CA PRO A 37 -3.840 -8.930 5.612 1.00 0.00 C ATOM 552 C PRO A 37 -5.131 -8.196 5.281 1.00 0.00 C ATOM 553 O PRO A 37 -5.669 -7.451 6.099 1.00 0.00 O ATOM 554 CB PRO A 37 -4.128 -10.377 6.036 1.00 0.00 C ATOM 555 CG PRO A 37 -4.232 -10.338 7.522 1.00 0.00 C ATOM 556 CD PRO A 37 -3.280 -9.224 7.972 1.00 0.00 C ATOM 0 HA PRO A 37 -3.230 -8.872 4.711 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.051 -10.742 5.587 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.330 -11.047 5.715 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.254 -10.131 7.838 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.950 -11.295 7.960 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.679 -8.688 8.833 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.312 -9.628 8.269 1.00 0.00 H new ATOM 564 N VAL A 38 -5.623 -8.410 4.074 1.00 0.00 N ATOM 565 CA VAL A 38 -6.852 -7.763 3.640 1.00 0.00 C ATOM 566 C VAL A 38 -8.059 -8.629 3.977 1.00 0.00 C ATOM 567 O VAL A 38 -9.197 -8.161 3.939 1.00 0.00 O ATOM 568 CB VAL A 38 -6.802 -7.518 2.132 1.00 0.00 C ATOM 569 CG1 VAL A 38 -5.603 -6.626 1.798 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.658 -8.856 1.405 1.00 0.00 C ATOM 0 H VAL A 38 -5.195 -9.022 3.379 1.00 0.00 H new ATOM 0 HA VAL A 38 -6.947 -6.811 4.162 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.721 -7.026 1.813 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.568 -6.452 0.723 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.703 -5.673 2.317 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.684 -7.118 2.116 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.622 -8.684 0.329 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.739 -9.347 1.725 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.510 -9.493 1.642 1.00 0.00 H new ATOM 580 N ASP A 39 -7.804 -9.893 4.307 1.00 0.00 N ATOM 581 CA ASP A 39 -8.880 -10.815 4.651 1.00 0.00 C ATOM 582 C ASP A 39 -8.320 -12.088 5.285 1.00 0.00 C ATOM 583 O ASP A 39 -7.204 -12.512 4.975 1.00 0.00 O ATOM 584 CB ASP A 39 -9.673 -11.179 3.391 1.00 0.00 C ATOM 585 CG ASP A 39 -11.018 -11.789 3.775 1.00 0.00 C ATOM 586 OD1 ASP A 39 -11.484 -11.509 4.868 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.562 -12.528 2.972 1.00 0.00 O ATOM 0 H ASP A 39 -6.869 -10.299 4.343 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.536 -10.325 5.370 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.829 -10.289 2.781 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -9.104 -11.885 2.785 1.00 0.00 H new ATOM 592 N VAL A 40 -9.101 -12.696 6.176 1.00 0.00 N ATOM 593 CA VAL A 40 -8.679 -13.932 6.840 1.00 0.00 C ATOM 594 C VAL A 40 -9.792 -14.970 6.774 1.00 0.00 C ATOM 595 O VAL A 40 -10.938 -14.691 7.128 1.00 0.00 O ATOM 596 CB VAL A 40 -8.319 -13.651 8.301 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.912 -14.957 8.990 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.154 -12.660 8.355 1.00 0.00 C ATOM 0 H VAL A 40 -10.022 -12.358 6.454 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.800 -14.320 6.326 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.183 -13.227 8.813 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.656 -14.755 10.030 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.742 -15.663 8.951 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.048 -15.384 8.480 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.896 -12.458 9.395 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.291 -13.085 7.843 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.444 -11.730 7.866 1.00 0.00 H new ATOM 608 N ILE A 41 -9.451 -16.172 6.315 1.00 0.00 N ATOM 609 CA ILE A 41 -10.437 -17.244 6.196 1.00 0.00 C ATOM 610 C ILE A 41 -10.280 -18.257 7.323 1.00 0.00 C ATOM 611 O ILE A 41 -9.272 -18.960 7.402 1.00 0.00 O ATOM 612 CB ILE A 41 -10.271 -17.951 4.850 1.00 0.00 C ATOM 613 CG1 ILE A 41 -10.527 -16.953 3.717 1.00 0.00 C ATOM 614 CG2 ILE A 41 -11.270 -19.107 4.752 1.00 0.00 C ATOM 615 CD1 ILE A 41 -10.121 -17.581 2.381 1.00 0.00 C ATOM 0 H ILE A 41 -8.508 -16.427 6.022 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.431 -16.802 6.262 1.00 0.00 H new ATOM 0 HB ILE A 41 -9.257 -18.343 4.767 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.581 -16.675 3.695 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.959 -16.039 3.888 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -11.151 -19.610 3.792 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -11.086 -19.816 5.559 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.285 -18.719 4.835 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -10.303 -16.871 1.575 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -9.062 -17.837 2.406 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.708 -18.483 2.210 1.00 0.00 H new ATOM 627 N LEU A 42 -11.286 -18.332 8.195 1.00 0.00 N ATOM 628 CA LEU A 42 -11.258 -19.278 9.312 1.00 0.00 C ATOM 629 C LEU A 42 -12.335 -20.338 9.125 1.00 0.00 C ATOM 630 O LEU A 42 -13.512 -20.097 9.390 1.00 0.00 O ATOM 631 CB LEU A 42 -11.483 -18.542 10.637 1.00 0.00 C ATOM 632 CG LEU A 42 -10.536 -17.342 10.729 1.00 0.00 C ATOM 633 CD1 LEU A 42 -10.685 -16.678 12.097 1.00 0.00 C ATOM 634 CD2 LEU A 42 -9.091 -17.811 10.550 1.00 0.00 C ATOM 0 H LEU A 42 -12.125 -17.754 8.151 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.280 -19.760 9.336 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.518 -18.207 10.707 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.310 -19.219 11.474 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.786 -16.627 9.945 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.011 -15.824 12.162 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.713 -16.340 12.227 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.438 -17.396 12.879 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.420 -16.955 10.616 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -8.842 -18.528 11.332 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -8.980 -18.284 9.574 1.00 0.00 H new ATOM 646 N SER A 43 -11.923 -21.514 8.669 1.00 0.00 N ATOM 647 CA SER A 43 -12.861 -22.607 8.442 1.00 0.00 C ATOM 648 C SER A 43 -13.079 -23.406 9.723 1.00 0.00 C ATOM 649 O SER A 43 -12.175 -23.525 10.551 1.00 0.00 O ATOM 650 CB SER A 43 -12.330 -23.532 7.348 1.00 0.00 C ATOM 651 OG SER A 43 -12.261 -22.818 6.122 1.00 0.00 O ATOM 0 H SER A 43 -10.952 -21.735 8.450 1.00 0.00 H new ATOM 0 HA SER A 43 -13.814 -22.181 8.128 1.00 0.00 H new ATOM 0 HB2 SER A 43 -11.343 -23.907 7.620 1.00 0.00 H new ATOM 0 HB3 SER A 43 -12.982 -24.399 7.241 1.00 0.00 H new ATOM 0 HG SER A 43 -11.919 -23.408 5.418 1.00 0.00 H new ATOM 657 N ARG A 44 -14.280 -23.955 9.879 1.00 0.00 N ATOM 658 CA ARG A 44 -14.601 -24.748 11.060 1.00 0.00 C ATOM 659 C ARG A 44 -15.709 -25.748 10.746 1.00 0.00 C ATOM 660 O ARG A 44 -16.601 -25.470 9.944 1.00 0.00 O ATOM 661 CB ARG A 44 -15.043 -23.827 12.201 1.00 0.00 C ATOM 662 CG ARG A 44 -16.340 -23.116 11.809 1.00 0.00 C ATOM 663 CD ARG A 44 -16.651 -22.023 12.832 1.00 0.00 C ATOM 664 NE ARG A 44 -17.847 -21.285 12.435 1.00 0.00 N ATOM 665 CZ ARG A 44 -19.062 -21.713 12.764 1.00 0.00 C ATOM 666 NH1 ARG A 44 -19.204 -22.811 13.454 1.00 0.00 N ATOM 667 NH2 ARG A 44 -20.115 -21.034 12.395 1.00 0.00 N ATOM 0 H ARG A 44 -15.042 -23.866 9.207 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.710 -25.297 11.364 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.194 -24.406 13.112 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -14.264 -23.095 12.414 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -16.243 -22.681 10.814 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -17.161 -23.832 11.765 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -16.799 -22.468 13.816 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -15.805 -21.341 12.915 1.00 0.00 H new ATOM 0 HE ARG A 44 -17.748 -20.425 11.895 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -18.382 -23.342 13.742 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -20.137 -23.138 13.706 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -20.005 -20.176 11.855 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -21.047 -21.362 12.647 1.00 0.00 H new ATOM 786 N GLY A 53 -8.057 -26.722 14.280 1.00 0.00 N ATOM 787 CA GLY A 53 -7.942 -25.276 14.433 1.00 0.00 C ATOM 788 C GLY A 53 -7.063 -24.675 13.339 1.00 0.00 C ATOM 789 O GLY A 53 -6.261 -23.778 13.597 1.00 0.00 O ATOM 0 HA2 GLY A 53 -8.933 -24.824 14.397 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -7.521 -25.043 15.411 1.00 0.00 H new ATOM 793 N PHE A 54 -7.219 -25.177 12.116 1.00 0.00 N ATOM 794 CA PHE A 54 -6.432 -24.685 10.989 1.00 0.00 C ATOM 795 C PHE A 54 -7.056 -23.415 10.417 1.00 0.00 C ATOM 796 O PHE A 54 -8.259 -23.193 10.541 1.00 0.00 O ATOM 797 CB PHE A 54 -6.357 -25.755 9.897 1.00 0.00 C ATOM 798 CG PHE A 54 -7.731 -25.978 9.309 1.00 0.00 C ATOM 799 CD1 PHE A 54 -8.659 -26.783 9.983 1.00 0.00 C ATOM 800 CD2 PHE A 54 -8.078 -25.382 8.091 1.00 0.00 C ATOM 801 CE1 PHE A 54 -9.932 -26.988 9.440 1.00 0.00 C ATOM 802 CE2 PHE A 54 -9.351 -25.591 7.547 1.00 0.00 C ATOM 803 CZ PHE A 54 -10.278 -26.393 8.222 1.00 0.00 C ATOM 0 H PHE A 54 -7.878 -25.919 11.881 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.427 -24.457 11.343 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -5.663 -25.444 9.116 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.973 -26.687 10.313 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.392 -27.245 10.922 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.364 -24.761 7.571 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -10.648 -27.606 9.961 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -9.618 -25.133 6.606 1.00 0.00 H new ATOM 0 HZ PHE A 54 -11.260 -26.553 7.803 1.00 0.00 H new ATOM 813 N ALA A 55 -6.225 -22.584 9.789 1.00 0.00 N ATOM 814 CA ALA A 55 -6.705 -21.335 9.206 1.00 0.00 C ATOM 815 C ALA A 55 -5.792 -20.883 8.070 1.00 0.00 C ATOM 816 O ALA A 55 -4.620 -21.261 8.018 1.00 0.00 O ATOM 817 CB ALA A 55 -6.754 -20.253 10.281 1.00 0.00 C ATOM 0 H ALA A 55 -5.226 -22.752 9.672 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.705 -21.502 8.805 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.113 -19.321 9.843 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.429 -20.563 11.079 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.755 -20.101 10.690 1.00 0.00 H new ATOM 823 N TYR A 56 -6.330 -20.069 7.160 1.00 0.00 N ATOM 824 CA TYR A 56 -5.546 -19.560 6.030 1.00 0.00 C ATOM 825 C TYR A 56 -5.540 -18.035 6.038 1.00 0.00 C ATOM 826 O TYR A 56 -6.594 -17.399 6.043 1.00 0.00 O ATOM 827 CB TYR A 56 -6.132 -20.063 4.710 1.00 0.00 C ATOM 828 CG TYR A 56 -6.200 -21.573 4.732 1.00 0.00 C ATOM 829 CD1 TYR A 56 -5.020 -22.328 4.728 1.00 0.00 C ATOM 830 CD2 TYR A 56 -7.443 -22.220 4.758 1.00 0.00 C ATOM 831 CE1 TYR A 56 -5.084 -23.727 4.749 1.00 0.00 C ATOM 832 CE2 TYR A 56 -7.506 -23.619 4.778 1.00 0.00 C ATOM 833 CZ TYR A 56 -6.326 -24.372 4.773 1.00 0.00 C ATOM 834 OH TYR A 56 -6.389 -25.750 4.795 1.00 0.00 O ATOM 0 H TYR A 56 -7.298 -19.749 7.181 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.523 -19.923 6.128 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.128 -19.646 4.559 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.516 -19.728 3.875 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -4.061 -21.831 4.709 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -8.353 -21.639 4.763 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -4.174 -24.309 4.747 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -8.464 -24.117 4.797 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.327 -26.034 4.811 1.00 0.00 H new ATOM 844 N LEU A 57 -4.345 -17.450 6.039 1.00 0.00 N ATOM 845 CA LEU A 57 -4.218 -15.992 6.055 1.00 0.00 C ATOM 846 C LEU A 57 -3.906 -15.463 4.654 1.00 0.00 C ATOM 847 O LEU A 57 -3.038 -15.999 3.961 1.00 0.00 O ATOM 848 CB LEU A 57 -3.095 -15.569 7.029 1.00 0.00 C ATOM 849 CG LEU A 57 -3.512 -14.300 7.804 1.00 0.00 C ATOM 850 CD1 LEU A 57 -4.287 -14.702 9.064 1.00 0.00 C ATOM 851 CD2 LEU A 57 -2.267 -13.502 8.205 1.00 0.00 C ATOM 0 H LEU A 57 -3.459 -17.955 6.029 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.166 -15.569 6.388 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.886 -16.379 7.728 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.175 -15.380 6.475 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.145 -13.683 7.166 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.581 -13.807 9.611 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.177 -15.263 8.780 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.654 -15.323 9.698 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.568 -12.608 8.751 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.629 -14.117 8.839 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.717 -13.212 7.310 1.00 0.00 H new ATOM 863 N LYS A 58 -4.617 -14.411 4.243 1.00 0.00 N ATOM 864 CA LYS A 58 -4.399 -13.822 2.923 1.00 0.00 C ATOM 865 C LYS A 58 -3.455 -12.630 3.024 1.00 0.00 C ATOM 866 O LYS A 58 -3.851 -11.546 3.452 1.00 0.00 O ATOM 867 CB LYS A 58 -5.733 -13.367 2.325 1.00 0.00 C ATOM 868 CG LYS A 58 -5.514 -12.882 0.890 1.00 0.00 C ATOM 869 CD LYS A 58 -6.849 -12.435 0.295 1.00 0.00 C ATOM 870 CE LYS A 58 -6.635 -11.975 -1.149 1.00 0.00 C ATOM 871 NZ LYS A 58 -7.947 -11.587 -1.745 1.00 0.00 N ATOM 0 H LYS A 58 -5.340 -13.955 4.799 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.951 -14.577 2.277 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.448 -14.190 2.336 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.160 -12.566 2.929 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.803 -12.056 0.878 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.084 -13.681 0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.565 -13.256 0.324 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.270 -11.623 0.888 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.947 -11.130 -1.175 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.180 -12.775 -1.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.804 -11.274 -2.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.589 -12.405 -1.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.364 -10.811 -1.192 1.00 0.00 H new ATOM 885 N TYR A 59 -2.204 -12.835 2.623 1.00 0.00 N ATOM 886 CA TYR A 59 -1.212 -11.765 2.665 1.00 0.00 C ATOM 887 C TYR A 59 -1.161 -11.030 1.322 1.00 0.00 C ATOM 888 O TYR A 59 -1.083 -11.658 0.265 1.00 0.00 O ATOM 889 CB TYR A 59 0.181 -12.352 2.995 1.00 0.00 C ATOM 890 CG TYR A 59 0.657 -11.826 4.334 1.00 0.00 C ATOM 891 CD1 TYR A 59 0.211 -12.419 5.519 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.538 -10.740 4.382 1.00 0.00 C ATOM 893 CE1 TYR A 59 0.645 -11.927 6.756 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.973 -10.247 5.618 1.00 0.00 C ATOM 895 CZ TYR A 59 1.526 -10.842 6.804 1.00 0.00 C ATOM 896 OH TYR A 59 1.951 -10.356 8.023 1.00 0.00 O ATOM 0 H TYR A 59 -1.855 -13.725 2.268 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.497 -11.055 3.442 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.130 -13.441 3.019 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.893 -12.083 2.215 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -0.469 -13.257 5.480 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.882 -10.282 3.466 1.00 0.00 H new ATOM 0 HE1 TYR A 59 0.300 -12.385 7.671 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.653 -9.409 5.657 1.00 0.00 H new ATOM 0 HH TYR A 59 2.560 -9.602 7.880 1.00 0.00 H new ATOM 906 N GLU A 60 -1.199 -9.702 1.377 1.00 0.00 N ATOM 907 CA GLU A 60 -1.143 -8.895 0.162 1.00 0.00 C ATOM 908 C GLU A 60 0.221 -9.028 -0.503 1.00 0.00 C ATOM 909 O GLU A 60 0.321 -9.132 -1.725 1.00 0.00 O ATOM 910 CB GLU A 60 -1.416 -7.426 0.496 1.00 0.00 C ATOM 911 CG GLU A 60 -1.402 -6.597 -0.792 1.00 0.00 C ATOM 912 CD GLU A 60 -1.771 -5.149 -0.485 1.00 0.00 C ATOM 913 OE1 GLU A 60 -2.065 -4.864 0.666 1.00 0.00 O ATOM 914 OE2 GLU A 60 -1.756 -4.346 -1.404 1.00 0.00 O ATOM 0 H GLU A 60 -1.268 -9.165 2.242 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.906 -9.254 -0.528 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.381 -7.329 0.993 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.662 -7.053 1.189 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.414 -6.640 -1.251 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.106 -7.016 -1.511 1.00 0.00 H new ATOM 921 N ASP A 61 1.276 -9.022 0.310 1.00 0.00 N ATOM 922 CA ASP A 61 2.638 -9.142 -0.211 1.00 0.00 C ATOM 923 C ASP A 61 3.227 -10.502 0.147 1.00 0.00 C ATOM 924 O ASP A 61 3.175 -10.929 1.300 1.00 0.00 O ATOM 925 CB ASP A 61 3.518 -8.034 0.368 1.00 0.00 C ATOM 926 CG ASP A 61 3.125 -6.688 -0.232 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.415 -6.688 -1.226 1.00 0.00 O ATOM 928 OD2 ASP A 61 3.540 -5.676 0.308 1.00 0.00 O ATOM 0 H ASP A 61 1.216 -8.936 1.325 1.00 0.00 H new ATOM 0 HA ASP A 61 2.603 -9.047 -1.296 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.411 -8.003 1.452 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.567 -8.243 0.157 1.00 0.00 H new ATOM 933 N GLN A 62 3.787 -11.182 -0.852 1.00 0.00 N ATOM 934 CA GLN A 62 4.379 -12.496 -0.633 1.00 0.00 C ATOM 935 C GLN A 62 5.724 -12.371 0.081 1.00 0.00 C ATOM 936 O GLN A 62 6.152 -13.290 0.781 1.00 0.00 O ATOM 937 CB GLN A 62 4.574 -13.209 -1.973 1.00 0.00 C ATOM 938 CG GLN A 62 5.651 -12.489 -2.784 1.00 0.00 C ATOM 939 CD GLN A 62 5.646 -12.993 -4.223 1.00 0.00 C ATOM 940 OE1 GLN A 62 4.751 -12.653 -4.997 1.00 0.00 O ATOM 941 NE2 GLN A 62 6.596 -13.789 -4.629 1.00 0.00 N ATOM 0 H GLN A 62 3.842 -10.846 -1.814 1.00 0.00 H new ATOM 0 HA GLN A 62 3.703 -13.077 -0.006 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.863 -14.247 -1.806 1.00 0.00 H new ATOM 0 HB3 GLN A 62 3.636 -13.225 -2.528 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.473 -11.414 -2.766 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.630 -12.658 -2.335 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.336 -14.069 -3.986 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.599 -14.131 -5.590 1.00 0.00 H new ATOM 950 N ARG A 63 6.386 -11.234 -0.106 1.00 0.00 N ATOM 951 CA ARG A 63 7.683 -11.003 0.521 1.00 0.00 C ATOM 952 C ARG A 63 7.513 -10.620 1.988 1.00 0.00 C ATOM 953 O ARG A 63 8.348 -10.954 2.829 1.00 0.00 O ATOM 954 CB ARG A 63 8.430 -9.889 -0.221 1.00 0.00 C ATOM 955 CG ARG A 63 7.598 -8.606 -0.189 1.00 0.00 C ATOM 956 CD ARG A 63 8.329 -7.499 -0.949 1.00 0.00 C ATOM 957 NE ARG A 63 7.506 -6.295 -1.004 1.00 0.00 N ATOM 958 CZ ARG A 63 7.469 -5.442 0.013 1.00 0.00 C ATOM 959 NH1 ARG A 63 8.174 -5.676 1.087 1.00 0.00 N ATOM 960 NH2 ARG A 63 6.725 -4.372 -0.059 1.00 0.00 N ATOM 0 H ARG A 63 6.049 -10.463 -0.682 1.00 0.00 H new ATOM 0 HA ARG A 63 8.261 -11.926 0.467 1.00 0.00 H new ATOM 0 HB2 ARG A 63 9.401 -9.717 0.243 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.618 -10.187 -1.252 1.00 0.00 H new ATOM 0 HG2 ARG A 63 6.620 -8.784 -0.637 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.425 -8.299 0.842 1.00 0.00 H new ATOM 0 HD2 ARG A 63 9.277 -7.278 -0.460 1.00 0.00 H new ATOM 0 HD3 ARG A 63 8.562 -7.835 -1.959 1.00 0.00 H new ATOM 0 HE ARG A 63 6.950 -6.106 -1.838 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.753 -6.514 1.145 1.00 0.00 H new ATOM 0 HH12 ARG A 63 8.146 -5.021 1.868 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.172 -4.191 -0.897 1.00 0.00 H new ATOM 0 HH22 ARG A 63 6.697 -3.717 0.722 1.00 0.00 H new ATOM 974 N SER A 64 6.426 -9.918 2.290 1.00 0.00 N ATOM 975 CA SER A 64 6.155 -9.492 3.658 1.00 0.00 C ATOM 976 C SER A 64 5.988 -10.700 4.574 1.00 0.00 C ATOM 977 O SER A 64 6.424 -10.682 5.724 1.00 0.00 O ATOM 978 CB SER A 64 4.888 -8.636 3.700 1.00 0.00 C ATOM 979 OG SER A 64 4.648 -8.220 5.038 1.00 0.00 O ATOM 0 H SER A 64 5.721 -9.633 1.610 1.00 0.00 H new ATOM 0 HA SER A 64 7.002 -8.901 4.007 1.00 0.00 H new ATOM 0 HB2 SER A 64 5.000 -7.767 3.051 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.037 -9.206 3.326 1.00 0.00 H new ATOM 0 HG SER A 64 4.057 -7.438 5.037 1.00 0.00 H new ATOM 985 N THR A 65 5.347 -11.745 4.056 1.00 0.00 N ATOM 986 CA THR A 65 5.118 -12.954 4.840 1.00 0.00 C ATOM 987 C THR A 65 6.400 -13.392 5.542 1.00 0.00 C ATOM 988 O THR A 65 6.357 -13.993 6.612 1.00 0.00 O ATOM 989 CB THR A 65 4.632 -14.084 3.928 1.00 0.00 C ATOM 990 OG1 THR A 65 5.580 -14.293 2.891 1.00 0.00 O ATOM 991 CG2 THR A 65 3.282 -13.706 3.322 1.00 0.00 C ATOM 0 H THR A 65 4.980 -11.779 3.105 1.00 0.00 H new ATOM 0 HA THR A 65 4.359 -12.735 5.591 1.00 0.00 H new ATOM 0 HB THR A 65 4.522 -15.000 4.508 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.535 -13.551 2.252 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.936 -14.511 2.673 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.557 -13.547 4.120 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.388 -12.790 2.740 1.00 0.00 H new ATOM 999 N ILE A 66 7.538 -13.084 4.934 1.00 0.00 N ATOM 1000 CA ILE A 66 8.828 -13.458 5.507 1.00 0.00 C ATOM 1001 C ILE A 66 9.026 -12.797 6.869 1.00 0.00 C ATOM 1002 O ILE A 66 9.515 -13.424 7.811 1.00 0.00 O ATOM 1003 CB ILE A 66 9.960 -13.041 4.565 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.890 -13.874 3.282 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.309 -13.276 5.250 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.845 -13.291 2.240 1.00 0.00 C ATOM 0 H ILE A 66 7.596 -12.579 4.050 1.00 0.00 H new ATOM 0 HA ILE A 66 8.844 -14.540 5.637 1.00 0.00 H new ATOM 0 HB ILE A 66 9.856 -11.984 4.320 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.155 -14.910 3.494 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.871 -13.879 2.894 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.115 -12.979 4.579 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.361 -12.684 6.164 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.413 -14.333 5.496 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.794 -13.885 1.327 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.559 -12.262 2.020 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.863 -13.310 2.629 1.00 0.00 H new ATOM 1018 N LEU A 67 8.644 -11.530 6.961 1.00 0.00 N ATOM 1019 CA LEU A 67 8.811 -10.790 8.206 1.00 0.00 C ATOM 1020 C LEU A 67 8.072 -11.468 9.351 1.00 0.00 C ATOM 1021 O LEU A 67 8.647 -11.706 10.409 1.00 0.00 O ATOM 1022 CB LEU A 67 8.268 -9.371 8.042 1.00 0.00 C ATOM 1023 CG LEU A 67 9.195 -8.567 7.113 1.00 0.00 C ATOM 1024 CD1 LEU A 67 8.524 -7.227 6.753 1.00 0.00 C ATOM 1025 CD2 LEU A 67 10.544 -8.299 7.826 1.00 0.00 C ATOM 0 H LEU A 67 8.222 -10.998 6.200 1.00 0.00 H new ATOM 0 HA LEU A 67 9.875 -10.763 8.439 1.00 0.00 H new ATOM 0 HB2 LEU A 67 7.260 -9.402 7.628 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.199 -8.883 9.014 1.00 0.00 H new ATOM 0 HG LEU A 67 9.378 -9.137 6.202 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.180 -6.657 6.095 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.578 -7.418 6.246 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.339 -6.657 7.663 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.198 -7.730 7.165 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.366 -7.731 8.739 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.018 -9.248 8.076 1.00 0.00 H new ATOM 1037 N ALA A 68 6.798 -11.783 9.129 1.00 0.00 N ATOM 1038 CA ALA A 68 5.991 -12.420 10.164 1.00 0.00 C ATOM 1039 C ALA A 68 6.535 -13.794 10.517 1.00 0.00 C ATOM 1040 O ALA A 68 6.642 -14.146 11.689 1.00 0.00 O ATOM 1041 CB ALA A 68 4.546 -12.561 9.683 1.00 0.00 C ATOM 0 H ALA A 68 6.307 -11.610 8.252 1.00 0.00 H new ATOM 0 HA ALA A 68 6.029 -11.791 11.053 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.949 -13.037 10.460 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.137 -11.574 9.465 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.521 -13.172 8.781 1.00 0.00 H new ATOM 1047 N VAL A 69 6.880 -14.562 9.495 1.00 0.00 N ATOM 1048 CA VAL A 69 7.378 -15.909 9.716 1.00 0.00 C ATOM 1049 C VAL A 69 8.491 -15.924 10.757 1.00 0.00 C ATOM 1050 O VAL A 69 8.298 -16.405 11.865 1.00 0.00 O ATOM 1051 CB VAL A 69 7.911 -16.490 8.398 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.655 -17.803 8.674 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.736 -16.762 7.443 1.00 0.00 C ATOM 0 H VAL A 69 6.825 -14.280 8.516 1.00 0.00 H new ATOM 0 HA VAL A 69 6.551 -16.516 10.084 1.00 0.00 H new ATOM 0 HB VAL A 69 8.595 -15.775 7.942 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.032 -18.212 7.736 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.490 -17.613 9.348 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.973 -18.518 9.134 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.115 -17.174 6.508 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.051 -17.475 7.903 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.208 -15.830 7.241 1.00 0.00 H new ATOM 1063 N ASP A 70 9.647 -15.384 10.397 1.00 0.00 N ATOM 1064 CA ASP A 70 10.795 -15.387 11.304 1.00 0.00 C ATOM 1065 C ASP A 70 10.495 -14.647 12.608 1.00 0.00 C ATOM 1066 O ASP A 70 10.932 -15.055 13.683 1.00 0.00 O ATOM 1067 CB ASP A 70 11.995 -14.728 10.619 1.00 0.00 C ATOM 1068 CG ASP A 70 12.535 -15.639 9.519 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.196 -16.812 9.530 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.279 -15.153 8.684 1.00 0.00 O ATOM 0 H ASP A 70 9.818 -14.942 9.494 1.00 0.00 H new ATOM 0 HA ASP A 70 11.018 -16.426 11.547 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.700 -13.768 10.195 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.777 -14.526 11.352 1.00 0.00 H new ATOM 1075 N ASN A 71 9.755 -13.550 12.505 1.00 0.00 N ATOM 1076 CA ASN A 71 9.438 -12.741 13.680 1.00 0.00 C ATOM 1077 C ASN A 71 8.558 -13.497 14.681 1.00 0.00 C ATOM 1078 O ASN A 71 8.794 -13.454 15.887 1.00 0.00 O ATOM 1079 CB ASN A 71 8.713 -11.467 13.245 1.00 0.00 C ATOM 1080 CG ASN A 71 9.680 -10.541 12.514 1.00 0.00 C ATOM 1081 OD1 ASN A 71 10.893 -10.647 12.686 1.00 0.00 O ATOM 1082 ND2 ASN A 71 9.210 -9.636 11.699 1.00 0.00 N ATOM 0 H ASN A 71 9.365 -13.201 11.630 1.00 0.00 H new ATOM 0 HA ASN A 71 10.380 -12.499 14.173 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.876 -11.719 12.594 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.298 -10.959 14.116 1.00 0.00 H new ATOM 0 HD21 ASN A 71 9.849 -9.015 11.203 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.203 -9.550 11.558 1.00 0.00 H new ATOM 1089 N LEU A 72 7.541 -14.193 14.174 1.00 0.00 N ATOM 1090 CA LEU A 72 6.604 -14.922 15.039 1.00 0.00 C ATOM 1091 C LEU A 72 7.000 -16.398 15.182 1.00 0.00 C ATOM 1092 O LEU A 72 6.615 -17.064 16.141 1.00 0.00 O ATOM 1093 CB LEU A 72 5.186 -14.816 14.454 1.00 0.00 C ATOM 1094 CG LEU A 72 4.542 -13.468 14.864 1.00 0.00 C ATOM 1095 CD1 LEU A 72 4.235 -13.469 16.376 1.00 0.00 C ATOM 1096 CD2 LEU A 72 5.509 -12.320 14.541 1.00 0.00 C ATOM 0 H LEU A 72 7.343 -14.270 13.176 1.00 0.00 H new ATOM 0 HA LEU A 72 6.634 -14.473 16.032 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.225 -14.894 13.367 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.574 -15.644 14.811 1.00 0.00 H new ATOM 0 HG LEU A 72 3.613 -13.333 14.310 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.782 -12.518 16.656 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.545 -14.281 16.607 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.160 -13.609 16.935 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.057 -11.371 14.829 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.438 -12.461 15.093 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.719 -12.312 13.472 1.00 0.00 H new ATOM 1108 N ASN A 73 7.769 -16.903 14.223 1.00 0.00 N ATOM 1109 CA ASN A 73 8.197 -18.302 14.248 1.00 0.00 C ATOM 1110 C ASN A 73 9.059 -18.578 15.472 1.00 0.00 C ATOM 1111 O ASN A 73 10.134 -18.000 15.632 1.00 0.00 O ATOM 1112 CB ASN A 73 8.991 -18.637 12.980 1.00 0.00 C ATOM 1113 CG ASN A 73 9.637 -20.014 13.102 1.00 0.00 C ATOM 1114 OD1 ASN A 73 10.791 -20.122 13.518 1.00 0.00 O ATOM 1115 ND2 ASN A 73 8.959 -21.076 12.766 1.00 0.00 N ATOM 0 H ASN A 73 8.108 -16.370 13.422 1.00 0.00 H new ATOM 0 HA ASN A 73 7.306 -18.928 14.293 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.330 -18.614 12.113 1.00 0.00 H new ATOM 0 HB3 ASN A 73 9.759 -17.882 12.815 1.00 0.00 H new ATOM 0 HD21 ASN A 73 9.384 -22.000 12.847 1.00 0.00 H new ATOM 0 HD22 ASN A 73 8.003 -20.983 12.422 1.00 0.00 H new ATOM 1122 N GLY A 74 8.581 -19.466 16.334 1.00 0.00 N ATOM 1123 CA GLY A 74 9.321 -19.819 17.541 1.00 0.00 C ATOM 1124 C GLY A 74 8.941 -18.903 18.698 1.00 0.00 C ATOM 1125 O GLY A 74 9.321 -19.148 19.844 1.00 0.00 O ATOM 0 H GLY A 74 7.691 -19.952 16.223 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.115 -20.855 17.809 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.392 -19.746 17.351 1.00 0.00 H new ATOM 1129 N PHE A 75 8.190 -17.846 18.394 1.00 0.00 N ATOM 1130 CA PHE A 75 7.764 -16.900 19.417 1.00 0.00 C ATOM 1131 C PHE A 75 6.613 -17.470 20.225 1.00 0.00 C ATOM 1132 O PHE A 75 5.590 -17.872 19.671 1.00 0.00 O ATOM 1133 CB PHE A 75 7.324 -15.584 18.773 1.00 0.00 C ATOM 1134 CG PHE A 75 6.841 -14.634 19.844 1.00 0.00 C ATOM 1135 CD1 PHE A 75 7.737 -14.139 20.797 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.495 -14.239 19.880 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.291 -13.257 21.790 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.048 -13.359 20.873 1.00 0.00 C ATOM 1139 CZ PHE A 75 5.946 -12.868 21.826 1.00 0.00 C ATOM 0 H PHE A 75 7.867 -17.626 17.452 1.00 0.00 H new ATOM 0 HA PHE A 75 8.610 -16.715 20.080 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.155 -15.139 18.226 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.529 -15.769 18.051 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.775 -14.437 20.767 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.803 -14.614 19.141 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.983 -12.878 22.527 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.011 -13.060 20.903 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.602 -12.188 22.591 1.00 0.00 H new ATOM 1149 N LYS A 76 6.785 -17.498 21.537 1.00 0.00 N ATOM 1150 CA LYS A 76 5.747 -18.007 22.412 1.00 0.00 C ATOM 1151 C LYS A 76 4.675 -16.949 22.610 1.00 0.00 C ATOM 1152 O LYS A 76 4.962 -15.831 23.042 1.00 0.00 O ATOM 1153 CB LYS A 76 6.352 -18.407 23.763 1.00 0.00 C ATOM 1154 CG LYS A 76 7.398 -19.518 23.554 1.00 0.00 C ATOM 1155 CD LYS A 76 6.704 -20.898 23.514 1.00 0.00 C ATOM 1156 CE LYS A 76 6.474 -21.408 24.943 1.00 0.00 C ATOM 1157 NZ LYS A 76 5.983 -22.813 24.902 1.00 0.00 N ATOM 0 H LYS A 76 7.627 -17.177 22.014 1.00 0.00 H new ATOM 0 HA LYS A 76 5.294 -18.887 21.956 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.816 -17.541 24.235 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.567 -18.754 24.435 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.940 -19.348 22.624 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.132 -19.494 24.360 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.752 -20.821 22.988 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.318 -21.608 22.960 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.402 -21.353 25.513 1.00 0.00 H new ATOM 0 HE3 LYS A 76 5.749 -20.774 25.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.828 -23.155 25.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 5.088 -22.853 24.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.689 -23.414 24.431 1.00 0.00 H new ATOM 1171 N ILE A 77 3.437 -17.305 22.295 1.00 0.00 N ATOM 1172 CA ILE A 77 2.329 -16.367 22.429 1.00 0.00 C ATOM 1173 C ILE A 77 1.107 -17.066 23.023 1.00 0.00 C ATOM 1174 O ILE A 77 0.702 -18.130 22.554 1.00 0.00 O ATOM 1175 CB ILE A 77 1.984 -15.777 21.044 1.00 0.00 C ATOM 1176 CG1 ILE A 77 1.211 -14.465 21.222 1.00 0.00 C ATOM 1177 CG2 ILE A 77 1.122 -16.771 20.258 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.189 -13.694 19.897 1.00 0.00 C ATOM 0 H ILE A 77 3.175 -18.228 21.948 1.00 0.00 H new ATOM 0 HA ILE A 77 2.624 -15.561 23.101 1.00 0.00 H new ATOM 0 HB ILE A 77 2.907 -15.586 20.497 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.192 -14.673 21.549 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.678 -13.859 21.999 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.881 -16.351 19.282 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.671 -17.704 20.126 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.201 -16.967 20.806 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.639 -12.762 20.027 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.211 -13.472 19.588 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.702 -14.299 19.132 1.00 0.00 H new ATOM 1190 N GLY A 78 0.527 -16.462 24.052 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.642 -17.037 24.697 1.00 0.00 C ATOM 1192 C GLY A 78 -0.259 -18.281 25.482 1.00 0.00 C ATOM 1193 O GLY A 78 -1.122 -19.039 25.922 1.00 0.00 O ATOM 0 H GLY A 78 0.845 -15.580 24.454 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.094 -16.303 25.365 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.391 -17.290 23.947 1.00 0.00 H new ATOM 1197 N GLY A 79 1.045 -18.484 25.656 1.00 0.00 N ATOM 1198 CA GLY A 79 1.536 -19.644 26.389 1.00 0.00 C ATOM 1199 C GLY A 79 1.929 -20.761 25.430 1.00 0.00 C ATOM 1200 O GLY A 79 2.691 -21.657 25.792 1.00 0.00 O ATOM 0 H GLY A 79 1.774 -17.865 25.302 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.396 -19.360 26.996 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.766 -20.000 27.074 1.00 0.00 H new ATOM 1204 N ARG A 80 1.407 -20.704 24.199 1.00 0.00 N ATOM 1205 CA ARG A 80 1.712 -21.723 23.190 1.00 0.00 C ATOM 1206 C ARG A 80 2.411 -21.090 21.985 1.00 0.00 C ATOM 1207 O ARG A 80 2.060 -19.992 21.555 1.00 0.00 O ATOM 1208 CB ARG A 80 0.410 -22.426 22.733 1.00 0.00 C ATOM 1209 CG ARG A 80 0.253 -23.771 23.461 1.00 0.00 C ATOM 1210 CD ARG A 80 0.027 -23.523 24.953 1.00 0.00 C ATOM 1211 NE ARG A 80 -0.381 -24.755 25.617 1.00 0.00 N ATOM 1212 CZ ARG A 80 -1.647 -25.158 25.604 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -2.551 -24.445 24.989 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -1.989 -26.264 26.206 1.00 0.00 N ATOM 0 H ARG A 80 0.776 -19.969 23.880 1.00 0.00 H new ATOM 0 HA ARG A 80 2.379 -22.461 23.635 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -0.449 -21.788 22.941 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.434 -22.587 21.655 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.587 -24.326 23.043 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.144 -24.382 23.314 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.942 -23.143 25.408 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.738 -22.758 25.089 1.00 0.00 H new ATOM 0 HE ARG A 80 0.319 -25.318 26.101 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -2.285 -23.580 24.519 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -3.523 -24.753 24.978 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -1.284 -26.821 26.688 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -2.962 -26.571 26.195 1.00 0.00 H new ATOM 1228 N ALA A 81 3.400 -21.795 21.441 1.00 0.00 N ATOM 1229 CA ALA A 81 4.131 -21.298 20.280 1.00 0.00 C ATOM 1230 C ALA A 81 3.352 -21.572 18.992 1.00 0.00 C ATOM 1231 O ALA A 81 2.894 -22.692 18.764 1.00 0.00 O ATOM 1232 CB ALA A 81 5.509 -21.973 20.203 1.00 0.00 C ATOM 0 H ALA A 81 3.711 -22.704 21.782 1.00 0.00 H new ATOM 0 HA ALA A 81 4.258 -20.221 20.388 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.050 -21.598 19.334 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.075 -21.749 21.107 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.381 -23.052 20.113 1.00 0.00 H new ATOM 1238 N LEU A 82 3.206 -20.543 18.153 1.00 0.00 N ATOM 1239 CA LEU A 82 2.481 -20.681 16.887 1.00 0.00 C ATOM 1240 C LEU A 82 3.448 -21.046 15.755 1.00 0.00 C ATOM 1241 O LEU A 82 4.643 -20.769 15.834 1.00 0.00 O ATOM 1242 CB LEU A 82 1.748 -19.364 16.541 1.00 0.00 C ATOM 1243 CG LEU A 82 2.537 -18.167 17.091 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.961 -18.183 16.523 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.842 -16.865 16.684 1.00 0.00 C ATOM 0 H LEU A 82 3.578 -19.609 18.326 1.00 0.00 H new ATOM 0 HA LEU A 82 1.747 -21.479 16.998 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.637 -19.272 15.461 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.744 -19.374 16.965 1.00 0.00 H new ATOM 0 HG LEU A 82 2.580 -18.233 18.178 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.519 -17.332 16.915 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.458 -19.108 16.814 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.920 -18.120 15.436 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.403 -16.016 17.075 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.797 -16.801 15.597 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.831 -16.850 17.090 1.00 0.00 H new ATOM 1257 N LYS A 83 2.919 -21.668 14.702 1.00 0.00 N ATOM 1258 CA LYS A 83 3.746 -22.064 13.558 1.00 0.00 C ATOM 1259 C LYS A 83 3.200 -21.466 12.263 1.00 0.00 C ATOM 1260 O LYS A 83 2.048 -21.702 11.898 1.00 0.00 O ATOM 1261 CB LYS A 83 3.782 -23.593 13.439 1.00 0.00 C ATOM 1262 CG LYS A 83 4.910 -24.023 12.459 1.00 0.00 C ATOM 1263 CD LYS A 83 6.003 -24.792 13.222 1.00 0.00 C ATOM 1264 CE LYS A 83 5.520 -26.221 13.504 1.00 0.00 C ATOM 1265 NZ LYS A 83 6.319 -26.804 14.619 1.00 0.00 N ATOM 0 H LYS A 83 1.931 -21.908 14.615 1.00 0.00 H new ATOM 0 HA LYS A 83 4.756 -21.687 13.721 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.951 -24.039 14.419 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.820 -23.961 13.083 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.497 -24.650 11.668 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.340 -23.144 11.978 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.922 -24.816 12.636 1.00 0.00 H new ATOM 0 HD3 LYS A 83 6.235 -24.284 14.158 1.00 0.00 H new ATOM 0 HE2 LYS A 83 4.462 -26.214 13.766 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.623 -26.835 12.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.992 -27.773 14.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.324 -26.824 14.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.199 -26.223 15.473 1.00 0.00 H new ATOM 1279 N ILE A 84 4.035 -20.688 11.566 1.00 0.00 N ATOM 1280 CA ILE A 84 3.630 -20.063 10.302 1.00 0.00 C ATOM 1281 C ILE A 84 4.449 -20.617 9.147 1.00 0.00 C ATOM 1282 O ILE A 84 5.680 -20.606 9.182 1.00 0.00 O ATOM 1283 CB ILE A 84 3.810 -18.542 10.375 1.00 0.00 C ATOM 1284 CG1 ILE A 84 2.893 -17.963 11.479 1.00 0.00 C ATOM 1285 CG2 ILE A 84 3.443 -17.914 9.024 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.720 -17.654 12.721 1.00 0.00 C ATOM 0 H ILE A 84 4.991 -20.477 11.854 1.00 0.00 H new ATOM 0 HA ILE A 84 2.577 -20.291 10.133 1.00 0.00 H new ATOM 0 HB ILE A 84 4.850 -18.314 10.610 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.404 -17.057 11.121 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.105 -18.676 11.722 1.00 0.00 H new ATOM 0 HG21 ILE A 84 3.572 -16.833 9.078 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.092 -18.318 8.247 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.405 -18.144 8.786 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.072 -17.246 13.497 1.00 0.00 H new ATOM 0 HD12 ILE A 84 4.189 -18.569 13.083 1.00 0.00 H new ATOM 0 HD13 ILE A 84 4.491 -16.925 12.472 1.00 0.00 H new ATOM 1298 N ASP A 85 3.761 -21.106 8.123 1.00 0.00 N ATOM 1299 CA ASP A 85 4.433 -21.667 6.950 1.00 0.00 C ATOM 1300 C ASP A 85 3.828 -21.107 5.664 1.00 0.00 C ATOM 1301 O ASP A 85 2.691 -20.636 5.657 1.00 0.00 O ATOM 1302 CB ASP A 85 4.312 -23.191 6.955 1.00 0.00 C ATOM 1303 CG ASP A 85 4.965 -23.763 8.208 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.091 -23.382 8.490 1.00 0.00 O ATOM 1305 OD2 ASP A 85 4.333 -24.572 8.866 1.00 0.00 O ATOM 0 H ASP A 85 2.742 -21.127 8.077 1.00 0.00 H new ATOM 0 HA ASP A 85 5.486 -21.389 6.992 1.00 0.00 H new ATOM 0 HB2 ASP A 85 3.262 -23.481 6.918 1.00 0.00 H new ATOM 0 HB3 ASP A 85 4.788 -23.605 6.066 1.00 0.00 H new ATOM 1310 N HIS A 86 4.593 -21.164 4.581 1.00 0.00 N ATOM 1311 CA HIS A 86 4.121 -20.655 3.299 1.00 0.00 C ATOM 1312 C HIS A 86 2.982 -21.520 2.765 1.00 0.00 C ATOM 1313 O HIS A 86 3.037 -22.748 2.840 1.00 0.00 O ATOM 1314 CB HIS A 86 5.270 -20.641 2.290 1.00 0.00 C ATOM 1315 CG HIS A 86 6.274 -19.595 2.689 1.00 0.00 C ATOM 1316 ND1 HIS A 86 7.371 -19.284 1.901 1.00 0.00 N ATOM 1317 CD2 HIS A 86 6.362 -18.782 3.792 1.00 0.00 C ATOM 1318 CE1 HIS A 86 8.066 -18.322 2.534 1.00 0.00 C ATOM 1319 NE2 HIS A 86 7.494 -17.979 3.692 1.00 0.00 N ATOM 0 H HIS A 86 5.535 -21.554 4.564 1.00 0.00 H new ATOM 0 HA HIS A 86 3.752 -19.640 3.445 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.746 -21.621 2.251 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.888 -20.432 1.291 1.00 0.00 H new ATOM 0 HD2 HIS A 86 5.660 -18.768 4.612 1.00 0.00 H new ATOM 0 HE1 HIS A 86 8.975 -17.881 2.153 1.00 0.00 H new ATOM 0 HE2 HIS A 86 7.818 -17.279 4.359 1.00 0.00 H new ATOM 1328 N THR A 87 1.948 -20.874 2.224 1.00 0.00 N ATOM 1329 CA THR A 87 0.799 -21.599 1.681 1.00 0.00 C ATOM 1330 C THR A 87 0.425 -21.044 0.309 1.00 0.00 C ATOM 1331 O THR A 87 0.274 -19.835 0.133 1.00 0.00 O ATOM 1332 CB THR A 87 -0.397 -21.475 2.632 1.00 0.00 C ATOM 1333 OG1 THR A 87 0.017 -21.807 3.948 1.00 0.00 O ATOM 1334 CG2 THR A 87 -1.511 -22.428 2.192 1.00 0.00 C ATOM 0 H THR A 87 1.882 -19.859 2.150 1.00 0.00 H new ATOM 0 HA THR A 87 1.067 -22.650 1.577 1.00 0.00 H new ATOM 0 HB THR A 87 -0.773 -20.452 2.611 1.00 0.00 H new ATOM 0 HG1 THR A 87 0.629 -22.572 3.915 1.00 0.00 H new ATOM 0 HG21 THR A 87 -2.358 -22.336 2.871 1.00 0.00 H new ATOM 0 HG22 THR A 87 -1.828 -22.175 1.180 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.141 -23.453 2.211 1.00 0.00 H new ATOM 1342 N PHE A 88 0.274 -21.938 -0.666 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.081 -21.530 -2.025 1.00 0.00 C ATOM 1344 C PHE A 88 -1.568 -21.739 -2.278 1.00 0.00 C ATOM 1345 O PHE A 88 -1.982 -22.030 -3.399 1.00 0.00 O ATOM 1346 CB PHE A 88 0.730 -22.335 -3.042 1.00 0.00 C ATOM 1347 CG PHE A 88 2.191 -21.974 -2.921 1.00 0.00 C ATOM 1348 CD1 PHE A 88 2.702 -20.881 -3.631 1.00 0.00 C ATOM 1349 CD2 PHE A 88 3.036 -22.731 -2.100 1.00 0.00 C ATOM 1350 CE1 PHE A 88 4.057 -20.545 -3.520 1.00 0.00 C ATOM 1351 CE2 PHE A 88 4.390 -22.396 -1.989 1.00 0.00 C ATOM 1352 CZ PHE A 88 4.901 -21.303 -2.699 1.00 0.00 C ATOM 0 H PHE A 88 0.391 -22.944 -0.543 1.00 0.00 H new ATOM 0 HA PHE A 88 0.148 -20.470 -2.135 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.593 -23.402 -2.869 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.376 -22.127 -4.052 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.051 -20.297 -4.265 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.642 -23.574 -1.552 1.00 0.00 H new ATOM 0 HE1 PHE A 88 4.451 -19.701 -4.067 1.00 0.00 H new ATOM 0 HE2 PHE A 88 5.041 -22.981 -1.356 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.946 -21.044 -2.614 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.368 -21.589 -1.226 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.806 -21.772 -1.345 1.00 0.00 C ATOM 1364 C TYR A 89 -4.381 -20.818 -2.389 1.00 0.00 C ATOM 1365 O TYR A 89 -4.153 -19.611 -2.334 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.477 -21.515 0.006 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.946 -21.845 -0.091 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.376 -23.165 0.088 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.877 -20.836 -0.360 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -7.738 -23.475 -0.001 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -8.239 -21.145 -0.449 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.670 -22.465 -0.270 1.00 0.00 C ATOM 1373 OH TYR A 89 -10.013 -22.769 -0.358 1.00 0.00 O ATOM 0 H TYR A 89 -2.046 -21.343 -0.290 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.000 -22.798 -1.659 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -4.007 -22.123 0.779 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -4.346 -20.473 0.297 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.657 -23.944 0.295 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -6.544 -19.818 -0.499 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -8.070 -24.493 0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.957 -20.366 -0.656 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.521 -21.953 -0.549 1.00 0.00 H new ATOM 2031 N PHE B 311 13.082 -4.886 5.174 1.00 0.00 N ATOM 2032 CA PHE B 311 11.809 -4.448 4.612 1.00 0.00 C ATOM 2033 C PHE B 311 11.440 -3.065 5.138 1.00 0.00 C ATOM 2034 O PHE B 311 12.241 -2.410 5.801 1.00 0.00 O ATOM 2035 CB PHE B 311 10.715 -5.444 4.980 1.00 0.00 C ATOM 2036 CG PHE B 311 11.126 -6.831 4.536 1.00 0.00 C ATOM 2037 CD1 PHE B 311 12.154 -7.507 5.209 1.00 0.00 C ATOM 2038 CD2 PHE B 311 10.478 -7.444 3.458 1.00 0.00 C ATOM 2039 CE1 PHE B 311 12.531 -8.793 4.802 1.00 0.00 C ATOM 2040 CE2 PHE B 311 10.855 -8.729 3.052 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.883 -9.403 3.724 1.00 0.00 C ATOM 0 HA PHE B 311 11.906 -4.396 3.528 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.543 -5.431 6.056 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.776 -5.161 4.504 1.00 0.00 H new ATOM 0 HD1 PHE B 311 12.655 -7.036 6.042 1.00 0.00 H new ATOM 0 HD2 PHE B 311 9.686 -6.925 2.939 1.00 0.00 H new ATOM 0 HE1 PHE B 311 13.322 -9.313 5.321 1.00 0.00 H new ATOM 0 HE2 PHE B 311 10.353 -9.201 2.220 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.175 -10.394 3.409 1.00 0.00 H new ATOM 2051 N ALA B 312 10.220 -2.629 4.835 1.00 0.00 N ATOM 2052 CA ALA B 312 9.752 -1.323 5.286 1.00 0.00 C ATOM 2053 C ALA B 312 8.228 -1.309 5.396 1.00 0.00 C ATOM 2054 O ALA B 312 7.574 -0.367 4.949 1.00 0.00 O ATOM 2055 CB ALA B 312 10.205 -0.239 4.305 1.00 0.00 C ATOM 0 H ALA B 312 9.543 -3.156 4.284 1.00 0.00 H new ATOM 0 HA ALA B 312 10.178 -1.124 6.269 1.00 0.00 H new ATOM 0 HB1 ALA B 312 9.852 0.733 4.649 1.00 0.00 H new ATOM 0 HB2 ALA B 312 11.294 -0.231 4.249 1.00 0.00 H new ATOM 0 HB3 ALA B 312 9.793 -0.447 3.318 1.00 0.00 H new ATOM 2061 N ILE B 313 7.672 -2.358 5.997 1.00 0.00 N ATOM 2062 CA ILE B 313 6.223 -2.458 6.153 1.00 0.00 C ATOM 2063 C ILE B 313 5.748 -1.543 7.280 1.00 0.00 C ATOM 2064 O ILE B 313 6.190 -1.666 8.423 1.00 0.00 O ATOM 2065 CB ILE B 313 5.827 -3.903 6.463 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.588 -4.854 5.527 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.324 -4.080 6.250 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.433 -4.393 4.075 1.00 0.00 C ATOM 0 H ILE B 313 8.197 -3.144 6.381 1.00 0.00 H new ATOM 0 HA ILE B 313 5.751 -2.148 5.221 1.00 0.00 H new ATOM 0 HB ILE B 313 6.077 -4.131 7.499 1.00 0.00 H new ATOM 0 HG12 ILE B 313 7.643 -4.878 5.799 1.00 0.00 H new ATOM 0 HG13 ILE B 313 6.207 -5.869 5.638 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.044 -5.110 6.471 1.00 0.00 H new ATOM 0 HG22 ILE B 313 3.781 -3.406 6.912 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.074 -3.851 5.214 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.975 -5.072 3.418 1.00 0.00 H new ATOM 0 HD12 ILE B 313 5.377 -4.392 3.804 1.00 0.00 H new ATOM 0 HD13 ILE B 313 6.836 -3.386 3.968 1.00 0.00 H new ATOM 2080 N MET B 314 4.846 -0.625 6.948 1.00 0.00 N ATOM 2081 CA MET B 314 4.319 0.308 7.939 1.00 0.00 C ATOM 2082 C MET B 314 3.298 -0.376 8.864 1.00 0.00 C ATOM 2083 O MET B 314 2.658 -1.351 8.471 1.00 0.00 O ATOM 2084 CB MET B 314 3.658 1.494 7.233 1.00 0.00 C ATOM 2085 CG MET B 314 4.738 2.401 6.632 1.00 0.00 C ATOM 2086 SD MET B 314 4.048 3.312 5.230 1.00 0.00 S ATOM 2087 CE MET B 314 4.252 2.008 3.993 1.00 0.00 C ATOM 0 H MET B 314 4.467 -0.507 6.008 1.00 0.00 H new ATOM 0 HA MET B 314 5.151 0.658 8.550 1.00 0.00 H new ATOM 0 HB2 MET B 314 2.990 1.137 6.449 1.00 0.00 H new ATOM 0 HB3 MET B 314 3.048 2.057 7.939 1.00 0.00 H new ATOM 0 HG2 MET B 314 5.105 3.097 7.387 1.00 0.00 H new ATOM 0 HG3 MET B 314 5.590 1.804 6.308 1.00 0.00 H new ATOM 0 HE1 MET B 314 3.450 2.075 3.258 1.00 0.00 H new ATOM 0 HE2 MET B 314 5.213 2.128 3.494 1.00 0.00 H new ATOM 0 HE3 MET B 314 4.215 1.034 4.481 1.00 0.00 H new ATOM 2097 N PRO B 315 3.138 0.123 10.078 1.00 0.00 N ATOM 2098 CA PRO B 315 2.169 -0.444 11.073 1.00 0.00 C ATOM 2099 C PRO B 315 0.750 -0.539 10.508 1.00 0.00 C ATOM 2100 O PRO B 315 0.302 0.347 9.782 1.00 0.00 O ATOM 2101 CB PRO B 315 2.220 0.550 12.249 1.00 0.00 C ATOM 2102 CG PRO B 315 3.547 1.225 12.144 1.00 0.00 C ATOM 2103 CD PRO B 315 3.864 1.282 10.653 1.00 0.00 C ATOM 0 HA PRO B 315 2.432 -1.463 11.358 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.406 1.273 12.187 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.117 0.034 13.204 1.00 0.00 H new ATOM 0 HG2 PRO B 315 3.513 2.225 12.576 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.313 0.670 12.686 1.00 0.00 H new ATOM 0 HD2 PRO B 315 3.529 2.220 10.211 1.00 0.00 H new ATOM 0 HD3 PRO B 315 4.936 1.209 10.471 1.00 0.00 H new ATOM 2111 N GLY B 316 0.052 -1.622 10.843 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.314 -1.819 10.366 1.00 0.00 C ATOM 2113 C GLY B 316 -2.316 -1.096 11.263 1.00 0.00 C ATOM 2114 O GLY B 316 -2.095 -0.949 12.465 1.00 0.00 O ATOM 0 H GLY B 316 0.406 -2.371 11.438 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.403 -1.450 9.344 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.545 -2.884 10.342 1.00 0.00 H new ATOM 2118 N SER B 317 -3.418 -0.651 10.673 1.00 0.00 N ATOM 2119 CA SER B 317 -4.449 0.053 11.429 1.00 0.00 C ATOM 2120 C SER B 317 -5.080 -0.872 12.469 1.00 0.00 C ATOM 2121 O SER B 317 -5.380 -0.455 13.588 1.00 0.00 O ATOM 2122 CB SER B 317 -5.530 0.572 10.481 1.00 0.00 C ATOM 2123 OG SER B 317 -4.966 1.548 9.617 1.00 0.00 O ATOM 0 H SER B 317 -3.621 -0.763 9.680 1.00 0.00 H new ATOM 0 HA SER B 317 -3.984 0.894 11.943 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.944 -0.251 9.898 1.00 0.00 H new ATOM 0 HB3 SER B 317 -6.352 1.005 11.051 1.00 0.00 H new ATOM 0 HG SER B 317 -5.656 1.882 9.006 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.279 -2.132 12.092 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.879 -3.110 12.997 1.00 0.00 C ATOM 2131 C ARG B 318 -4.884 -3.521 14.081 1.00 0.00 C ATOM 2132 O ARG B 318 -5.185 -4.367 14.923 1.00 0.00 O ATOM 2133 CB ARG B 318 -6.318 -4.349 12.215 1.00 0.00 C ATOM 2134 CG ARG B 318 -7.527 -4.000 11.351 1.00 0.00 C ATOM 2135 CD ARG B 318 -7.879 -5.187 10.465 1.00 0.00 C ATOM 2136 NE ARG B 318 -9.046 -4.878 9.645 1.00 0.00 N ATOM 2137 CZ ARG B 318 -9.467 -5.717 8.705 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -8.834 -6.841 8.502 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -10.513 -5.419 7.983 1.00 0.00 N ATOM 0 H ARG B 318 -5.036 -2.499 11.172 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.748 -2.651 13.469 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -5.500 -4.706 11.589 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -6.569 -5.157 12.903 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -8.376 -3.740 11.983 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.308 -3.127 10.737 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -7.032 -5.436 9.825 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.081 -6.063 11.082 1.00 0.00 H new ATOM 0 HE ARG B 318 -9.547 -4.003 9.796 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -8.016 -7.075 9.065 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -9.157 -7.485 7.780 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -11.008 -4.541 8.140 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -10.835 -6.064 7.262 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.701 -2.916 14.051 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.666 -3.229 15.031 1.00 0.00 C ATOM 2155 C TRP B 319 -3.138 -2.918 16.447 1.00 0.00 C ATOM 2156 O TRP B 319 -2.531 -3.345 17.428 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.397 -2.434 14.728 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.327 -2.809 15.706 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.159 -4.040 16.246 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.717 -1.974 16.268 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.921 -4.012 17.101 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.496 -2.761 17.150 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.065 -0.624 16.100 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.575 -2.232 17.838 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.156 -0.082 16.795 1.00 0.00 C ATOM 2166 CH2 TRP B 319 2.911 -0.884 17.661 1.00 0.00 C ATOM 0 H TRP B 319 -3.436 -2.211 13.364 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.452 -4.296 14.964 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -1.062 -2.637 13.711 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.602 -1.365 14.789 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.773 -4.904 16.040 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.253 -4.817 17.632 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.490 0.000 15.432 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.153 -2.854 18.506 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 2.415 0.958 16.662 1.00 0.00 H new ATOM 0 HH2 TRP B 319 3.752 -0.463 18.192 1.00 0.00 H new ATOM 2177 N ASP B 320 -4.218 -2.163 16.546 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.769 -1.797 17.848 1.00 0.00 C ATOM 2179 C ASP B 320 -3.700 -1.148 18.728 1.00 0.00 C ATOM 2180 O ASP B 320 -3.954 -0.805 19.882 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.319 -3.044 18.544 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.567 -3.537 17.822 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -7.117 -2.775 17.044 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.955 -4.668 18.059 1.00 0.00 O ATOM 0 H ASP B 320 -4.732 -1.791 15.747 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.573 -1.078 17.692 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -4.562 -3.828 18.555 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -5.556 -2.816 19.583 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.499 -0.985 18.174 1.00 0.00 N ATOM 2190 CA GLY B 321 -1.398 -0.379 18.916 1.00 0.00 C ATOM 2191 C GLY B 321 -0.877 -1.330 19.991 1.00 0.00 C ATOM 2192 O GLY B 321 -0.172 -0.914 20.910 1.00 0.00 O ATOM 0 H GLY B 321 -2.266 -1.262 17.220 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.591 -0.121 18.231 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.733 0.550 19.378 1.00 0.00 H new ATOM 2196 N VAL B 322 -1.228 -2.608 19.870 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.789 -3.610 20.835 1.00 0.00 C ATOM 2198 C VAL B 322 0.688 -3.943 20.632 1.00 0.00 C ATOM 2199 O VAL B 322 1.167 -4.021 19.503 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.625 -4.884 20.689 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.048 -5.984 21.584 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -3.069 -4.596 21.106 1.00 0.00 C ATOM 0 H VAL B 322 -1.812 -2.972 19.117 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.924 -3.201 21.836 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.603 -5.213 19.650 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.645 -6.890 21.478 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.019 -6.191 21.289 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -1.068 -5.656 22.623 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.665 -5.503 21.002 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -3.089 -4.265 22.144 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.483 -3.815 20.469 1.00 0.00 H new ATOM 2212 N HIS B 323 1.403 -4.135 21.735 1.00 0.00 N ATOM 2213 CA HIS B 323 2.825 -4.459 21.664 1.00 0.00 C ATOM 2214 C HIS B 323 3.031 -5.853 21.073 1.00 0.00 C ATOM 2215 O HIS B 323 2.230 -6.759 21.299 1.00 0.00 O ATOM 2216 CB HIS B 323 3.442 -4.396 23.062 1.00 0.00 C ATOM 2217 CG HIS B 323 2.669 -5.293 23.991 1.00 0.00 C ATOM 2218 ND1 HIS B 323 1.496 -4.886 24.605 1.00 0.00 N ATOM 2219 CD2 HIS B 323 2.890 -6.579 24.419 1.00 0.00 C ATOM 2220 CE1 HIS B 323 1.058 -5.907 25.363 1.00 0.00 C ATOM 2221 NE2 HIS B 323 1.871 -6.964 25.287 1.00 0.00 N ATOM 0 H HIS B 323 1.027 -4.073 22.681 1.00 0.00 H new ATOM 0 HA HIS B 323 3.314 -3.730 21.017 1.00 0.00 H new ATOM 0 HB2 HIS B 323 4.486 -4.706 23.025 1.00 0.00 H new ATOM 0 HB3 HIS B 323 3.427 -3.371 23.432 1.00 0.00 H new ATOM 0 HD2 HIS B 323 3.726 -7.197 24.127 1.00 0.00 H new ATOM 0 HE1 HIS B 323 0.159 -5.876 25.960 1.00 0.00 H new ATOM 0 HE2 HIS B 323 1.768 -7.860 25.762 1.00 0.00 H new ATOM 2230 N ARG B 324 4.115 -6.019 20.314 1.00 0.00 N ATOM 2231 CA ARG B 324 4.423 -7.306 19.683 1.00 0.00 C ATOM 2232 C ARG B 324 5.922 -7.604 19.773 1.00 0.00 C ATOM 2233 O ARG B 324 6.744 -6.692 19.818 1.00 0.00 O ATOM 2234 CB ARG B 324 3.975 -7.296 18.205 1.00 0.00 C ATOM 2235 CG ARG B 324 4.026 -5.859 17.654 1.00 0.00 C ATOM 2236 CD ARG B 324 5.454 -5.315 17.760 1.00 0.00 C ATOM 2237 NE ARG B 324 5.645 -4.204 16.834 1.00 0.00 N ATOM 2238 CZ ARG B 324 6.600 -3.300 17.033 1.00 0.00 C ATOM 2239 NH1 ARG B 324 7.382 -3.398 18.072 1.00 0.00 N ATOM 2240 NH2 ARG B 324 6.751 -2.315 16.191 1.00 0.00 N ATOM 0 H ARG B 324 4.793 -5.282 20.121 1.00 0.00 H new ATOM 0 HA ARG B 324 3.880 -8.088 20.213 1.00 0.00 H new ATOM 0 HB2 ARG B 324 4.622 -7.945 17.615 1.00 0.00 H new ATOM 0 HB3 ARG B 324 2.963 -7.692 18.119 1.00 0.00 H new ATOM 0 HG2 ARG B 324 3.698 -5.846 16.615 1.00 0.00 H new ATOM 0 HG3 ARG B 324 3.341 -5.221 18.212 1.00 0.00 H new ATOM 0 HD2 ARG B 324 5.649 -4.984 18.780 1.00 0.00 H new ATOM 0 HD3 ARG B 324 6.169 -6.108 17.540 1.00 0.00 H new ATOM 0 HE ARG B 324 5.036 -4.119 16.020 1.00 0.00 H new ATOM 0 HH11 ARG B 324 7.261 -4.167 18.731 1.00 0.00 H new ATOM 0 HH12 ARG B 324 8.115 -2.705 18.226 1.00 0.00 H new ATOM 0 HH21 ARG B 324 6.137 -2.238 15.380 1.00 0.00 H new ATOM 0 HH22 ARG B 324 7.483 -1.622 16.343 1.00 0.00 H new ATOM 2254 N SER B 325 6.268 -8.887 19.796 1.00 0.00 N ATOM 2255 CA SER B 325 7.668 -9.292 19.874 1.00 0.00 C ATOM 2256 C SER B 325 8.306 -9.297 18.489 1.00 0.00 C ATOM 2257 O SER B 325 7.609 -9.323 17.476 1.00 0.00 O ATOM 2258 CB SER B 325 7.775 -10.682 20.493 1.00 0.00 C ATOM 2259 OG SER B 325 7.191 -11.632 19.613 1.00 0.00 O ATOM 0 H SER B 325 5.604 -9.660 19.762 1.00 0.00 H new ATOM 0 HA SER B 325 8.198 -8.574 20.500 1.00 0.00 H new ATOM 0 HB2 SER B 325 8.820 -10.932 20.676 1.00 0.00 H new ATOM 0 HB3 SER B 325 7.269 -10.703 21.458 1.00 0.00 H new ATOM 0 HG SER B 325 6.817 -12.373 20.133 1.00 0.00 H new ATOM 2286 N PHE B 328 10.299 -4.659 18.012 1.00 0.00 N ATOM 2287 CA PHE B 328 10.710 -3.504 18.803 1.00 0.00 C ATOM 2288 C PHE B 328 11.614 -2.587 17.985 1.00 0.00 C ATOM 2289 O PHE B 328 11.468 -1.365 18.017 1.00 0.00 O ATOM 2290 CB PHE B 328 11.449 -3.966 20.060 1.00 0.00 C ATOM 2291 CG PHE B 328 11.719 -2.776 20.951 1.00 0.00 C ATOM 2292 CD1 PHE B 328 10.734 -2.333 21.842 1.00 0.00 C ATOM 2293 CD2 PHE B 328 12.954 -2.121 20.889 1.00 0.00 C ATOM 2294 CE1 PHE B 328 10.983 -1.230 22.668 1.00 0.00 C ATOM 2295 CE2 PHE B 328 13.203 -1.018 21.715 1.00 0.00 C ATOM 2296 CZ PHE B 328 12.216 -0.574 22.605 1.00 0.00 C ATOM 0 HA PHE B 328 9.817 -2.950 19.092 1.00 0.00 H new ATOM 0 HB2 PHE B 328 10.853 -4.706 20.594 1.00 0.00 H new ATOM 0 HB3 PHE B 328 12.387 -4.449 19.787 1.00 0.00 H new ATOM 0 HD1 PHE B 328 9.783 -2.842 21.892 1.00 0.00 H new ATOM 0 HD2 PHE B 328 13.715 -2.466 20.204 1.00 0.00 H new ATOM 0 HE1 PHE B 328 10.223 -0.886 23.354 1.00 0.00 H new ATOM 0 HE2 PHE B 328 14.155 -0.510 21.666 1.00 0.00 H new ATOM 0 HZ PHE B 328 12.408 0.276 23.243 1.00 0.00 H new ATOM 2306 N GLU B 329 12.550 -3.185 17.254 1.00 0.00 N ATOM 2307 CA GLU B 329 13.477 -2.415 16.434 1.00 0.00 C ATOM 2308 C GLU B 329 12.719 -1.572 15.412 1.00 0.00 C ATOM 2309 O GLU B 329 13.245 -0.591 14.890 1.00 0.00 O ATOM 2310 CB GLU B 329 14.441 -3.356 15.706 1.00 0.00 C ATOM 2311 CG GLU B 329 13.662 -4.205 14.696 1.00 0.00 C ATOM 2312 CD GLU B 329 14.562 -5.298 14.130 1.00 0.00 C ATOM 2313 OE1 GLU B 329 14.986 -6.145 14.898 1.00 0.00 O ATOM 2314 OE2 GLU B 329 14.815 -5.271 12.936 1.00 0.00 O ATOM 0 H GLU B 329 12.686 -4.195 17.213 1.00 0.00 H new ATOM 0 HA GLU B 329 14.042 -1.751 17.088 1.00 0.00 H new ATOM 0 HB2 GLU B 329 15.212 -2.780 15.195 1.00 0.00 H new ATOM 0 HB3 GLU B 329 14.949 -4.000 16.424 1.00 0.00 H new ATOM 0 HG2 GLU B 329 12.792 -4.652 15.178 1.00 0.00 H new ATOM 0 HG3 GLU B 329 13.290 -3.574 13.889 1.00 0.00 H new ATOM 2321 N GLU B 330 11.482 -1.968 15.129 1.00 0.00 N ATOM 2322 CA GLU B 330 10.664 -1.252 14.157 1.00 0.00 C ATOM 2323 C GLU B 330 10.525 0.215 14.550 1.00 0.00 C ATOM 2324 O GLU B 330 10.353 1.082 13.694 1.00 0.00 O ATOM 2325 CB GLU B 330 9.275 -1.892 14.067 1.00 0.00 C ATOM 2326 CG GLU B 330 8.521 -1.313 12.866 1.00 0.00 C ATOM 2327 CD GLU B 330 9.184 -1.765 11.568 1.00 0.00 C ATOM 2328 OE1 GLU B 330 9.931 -2.726 11.611 1.00 0.00 O ATOM 2329 OE2 GLU B 330 8.933 -1.140 10.550 1.00 0.00 O ATOM 0 H GLU B 330 11.027 -2.775 15.556 1.00 0.00 H new ATOM 0 HA GLU B 330 11.154 -1.312 13.185 1.00 0.00 H new ATOM 0 HB2 GLU B 330 9.367 -2.973 13.965 1.00 0.00 H new ATOM 0 HB3 GLU B 330 8.717 -1.705 14.984 1.00 0.00 H new ATOM 0 HG2 GLU B 330 7.481 -1.640 12.886 1.00 0.00 H new ATOM 0 HG3 GLU B 330 8.514 -0.224 12.921 1.00 0.00 H new ATOM 2336 N LYS B 331 10.597 0.485 15.848 1.00 0.00 N ATOM 2337 CA LYS B 331 10.473 1.851 16.340 1.00 0.00 C ATOM 2338 C LYS B 331 11.446 2.773 15.613 1.00 0.00 C ATOM 2339 O LYS B 331 11.128 3.930 15.332 1.00 0.00 O ATOM 2340 CB LYS B 331 10.759 1.890 17.843 1.00 0.00 C ATOM 2341 CG LYS B 331 12.228 1.516 18.102 1.00 0.00 C ATOM 2342 CD LYS B 331 12.411 1.103 19.571 1.00 0.00 C ATOM 2343 CE LYS B 331 12.346 2.342 20.466 1.00 0.00 C ATOM 2344 NZ LYS B 331 13.435 3.285 20.086 1.00 0.00 N ATOM 0 H LYS B 331 10.739 -0.218 16.573 1.00 0.00 H new ATOM 0 HA LYS B 331 9.456 2.195 16.153 1.00 0.00 H new ATOM 0 HB2 LYS B 331 10.553 2.885 18.236 1.00 0.00 H new ATOM 0 HB3 LYS B 331 10.100 1.197 18.366 1.00 0.00 H new ATOM 0 HG2 LYS B 331 12.525 0.698 17.445 1.00 0.00 H new ATOM 0 HG3 LYS B 331 12.874 2.362 17.870 1.00 0.00 H new ATOM 0 HD2 LYS B 331 11.635 0.393 19.859 1.00 0.00 H new ATOM 0 HD3 LYS B 331 13.369 0.599 19.701 1.00 0.00 H new ATOM 0 HE2 LYS B 331 11.376 2.828 20.362 1.00 0.00 H new ATOM 0 HE3 LYS B 331 12.448 2.054 21.512 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 13.720 3.840 20.918 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 14.252 2.747 19.732 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 13.094 3.927 19.342 1.00 0.00 H new ATOM 2358 N TRP B 332 12.633 2.254 15.307 1.00 0.00 N ATOM 2359 CA TRP B 332 13.644 3.040 14.609 1.00 0.00 C ATOM 2360 C TRP B 332 13.147 3.442 13.225 1.00 0.00 C ATOM 2361 O TRP B 332 13.303 4.589 12.808 1.00 0.00 O ATOM 2362 CB TRP B 332 14.935 2.230 14.476 1.00 0.00 C ATOM 2363 CG TRP B 332 15.980 3.069 13.813 1.00 0.00 C ATOM 2364 CD1 TRP B 332 16.760 3.975 14.443 1.00 0.00 C ATOM 2365 CD2 TRP B 332 16.375 3.091 12.411 1.00 0.00 C ATOM 2366 NE1 TRP B 332 17.609 4.555 13.519 1.00 0.00 N ATOM 2367 CE2 TRP B 332 17.410 4.044 12.252 1.00 0.00 C ATOM 2368 CE3 TRP B 332 15.942 2.386 11.274 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 17.992 4.290 11.007 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 16.526 2.631 10.020 1.00 0.00 C ATOM 2371 CH2 TRP B 332 17.549 3.580 9.887 1.00 0.00 C ATOM 0 H TRP B 332 12.916 1.300 15.530 1.00 0.00 H new ATOM 0 HA TRP B 332 13.841 3.942 15.188 1.00 0.00 H new ATOM 0 HB2 TRP B 332 15.280 1.910 15.459 1.00 0.00 H new ATOM 0 HB3 TRP B 332 14.753 1.328 13.892 1.00 0.00 H new ATOM 0 HD1 TRP B 332 16.726 4.208 15.497 1.00 0.00 H new ATOM 0 HE1 TRP B 332 18.298 5.272 13.745 1.00 0.00 H new ATOM 0 HE3 TRP B 332 15.155 1.652 11.365 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 18.779 5.023 10.910 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 16.185 2.085 9.153 1.00 0.00 H new ATOM 0 HH2 TRP B 332 17.995 3.763 8.920 1.00 0.00 H new ATOM 2382 N PHE B 333 12.550 2.489 12.518 1.00 0.00 N ATOM 2383 CA PHE B 333 12.032 2.754 11.180 1.00 0.00 C ATOM 2384 C PHE B 333 10.893 3.765 11.241 1.00 0.00 C ATOM 2385 O PHE B 333 10.742 4.595 10.346 1.00 0.00 O ATOM 2386 CB PHE B 333 11.530 1.454 10.548 1.00 0.00 C ATOM 2387 CG PHE B 333 12.709 0.582 10.179 1.00 0.00 C ATOM 2388 CD1 PHE B 333 13.321 -0.213 11.156 1.00 0.00 C ATOM 2389 CD2 PHE B 333 13.185 0.570 8.865 1.00 0.00 C ATOM 2390 CE1 PHE B 333 14.412 -1.020 10.816 1.00 0.00 C ATOM 2391 CE2 PHE B 333 14.276 -0.239 8.525 1.00 0.00 C ATOM 2392 CZ PHE B 333 14.890 -1.033 9.500 1.00 0.00 C ATOM 0 H PHE B 333 12.413 1.533 12.845 1.00 0.00 H new ATOM 0 HA PHE B 333 12.837 3.165 10.572 1.00 0.00 H new ATOM 0 HB2 PHE B 333 10.879 0.927 11.245 1.00 0.00 H new ATOM 0 HB3 PHE B 333 10.936 1.674 9.661 1.00 0.00 H new ATOM 0 HD1 PHE B 333 12.951 -0.203 12.171 1.00 0.00 H new ATOM 0 HD2 PHE B 333 12.712 1.184 8.113 1.00 0.00 H new ATOM 0 HE1 PHE B 333 14.886 -1.633 11.569 1.00 0.00 H new ATOM 0 HE2 PHE B 333 14.644 -0.250 7.510 1.00 0.00 H new ATOM 0 HZ PHE B 333 15.732 -1.656 9.237 1.00 0.00 H new ATOM 2402 N ALA B 334 10.094 3.686 12.303 1.00 0.00 N ATOM 2403 CA ALA B 334 8.966 4.597 12.461 1.00 0.00 C ATOM 2404 C ALA B 334 9.445 6.043 12.477 1.00 0.00 C ATOM 2405 O ALA B 334 8.887 6.896 11.789 1.00 0.00 O ATOM 2406 CB ALA B 334 8.231 4.292 13.767 1.00 0.00 C ATOM 0 H ALA B 334 10.205 3.009 13.058 1.00 0.00 H new ATOM 0 HA ALA B 334 8.289 4.457 11.618 1.00 0.00 H new ATOM 0 HB1 ALA B 334 7.390 4.976 13.879 1.00 0.00 H new ATOM 0 HB2 ALA B 334 7.864 3.266 13.747 1.00 0.00 H new ATOM 0 HB3 ALA B 334 8.914 4.417 14.607 1.00 0.00 H new ATOM 2412 N LYS B 335 10.485 6.309 13.259 1.00 0.00 N ATOM 2413 CA LYS B 335 11.040 7.652 13.345 1.00 0.00 C ATOM 2414 C LYS B 335 11.681 8.044 12.021 1.00 0.00 C ATOM 2415 O LYS B 335 11.603 9.199 11.598 1.00 0.00 O ATOM 2416 CB LYS B 335 12.080 7.722 14.468 1.00 0.00 C ATOM 2417 CG LYS B 335 11.384 7.592 15.834 1.00 0.00 C ATOM 2418 CD LYS B 335 10.617 8.887 16.159 1.00 0.00 C ATOM 2419 CE LYS B 335 10.352 8.969 17.666 1.00 0.00 C ATOM 2420 NZ LYS B 335 9.508 7.814 18.085 1.00 0.00 N ATOM 0 H LYS B 335 10.958 5.616 13.839 1.00 0.00 H new ATOM 0 HA LYS B 335 10.231 8.349 13.565 1.00 0.00 H new ATOM 0 HB2 LYS B 335 12.814 6.925 14.346 1.00 0.00 H new ATOM 0 HB3 LYS B 335 12.623 8.666 14.415 1.00 0.00 H new ATOM 0 HG2 LYS B 335 10.697 6.746 15.822 1.00 0.00 H new ATOM 0 HG3 LYS B 335 12.123 7.392 16.610 1.00 0.00 H new ATOM 0 HD2 LYS B 335 11.193 9.753 15.834 1.00 0.00 H new ATOM 0 HD3 LYS B 335 9.674 8.909 15.613 1.00 0.00 H new ATOM 0 HE2 LYS B 335 11.295 8.962 18.213 1.00 0.00 H new ATOM 0 HE3 LYS B 335 9.851 9.906 17.908 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 9.145 7.979 19.046 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 8.710 7.711 17.427 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 10.079 6.945 18.076 1.00 0.00 H new ATOM 2434 N GLN B 336 12.319 7.077 11.375 1.00 0.00 N ATOM 2435 CA GLN B 336 12.978 7.334 10.100 1.00 0.00 C ATOM 2436 C GLN B 336 11.966 7.806 9.059 1.00 0.00 C ATOM 2437 O GLN B 336 12.234 8.735 8.300 1.00 0.00 O ATOM 2438 CB GLN B 336 13.672 6.059 9.603 1.00 0.00 C ATOM 2439 CG GLN B 336 14.474 6.369 8.334 1.00 0.00 C ATOM 2440 CD GLN B 336 15.566 7.388 8.642 1.00 0.00 C ATOM 2441 OE1 GLN B 336 16.398 7.161 9.521 1.00 0.00 O ATOM 2442 NE2 GLN B 336 15.611 8.505 7.970 1.00 0.00 N ATOM 0 H GLN B 336 12.395 6.116 11.708 1.00 0.00 H new ATOM 0 HA GLN B 336 13.721 8.117 10.247 1.00 0.00 H new ATOM 0 HB2 GLN B 336 14.333 5.668 10.376 1.00 0.00 H new ATOM 0 HB3 GLN B 336 12.931 5.287 9.397 1.00 0.00 H new ATOM 0 HG2 GLN B 336 14.919 5.454 7.943 1.00 0.00 H new ATOM 0 HG3 GLN B 336 13.811 6.757 7.561 1.00 0.00 H new ATOM 0 HE21 GLN B 336 14.921 8.691 7.242 1.00 0.00 H new ATOM 0 HE22 GLN B 336 16.337 9.193 8.172 1.00 0.00 H new ATOM 2451 N ASN B 337 10.807 7.160 9.029 1.00 0.00 N ATOM 2452 CA ASN B 337 9.763 7.520 8.077 1.00 0.00 C ATOM 2453 C ASN B 337 9.183 8.896 8.404 1.00 0.00 C ATOM 2454 O ASN B 337 8.834 9.665 7.508 1.00 0.00 O ATOM 2455 CB ASN B 337 8.647 6.475 8.102 1.00 0.00 C ATOM 2456 CG ASN B 337 7.744 6.647 6.885 1.00 0.00 C ATOM 2457 OD1 ASN B 337 8.224 6.936 5.790 1.00 0.00 O ATOM 2458 ND2 ASN B 337 6.454 6.486 7.013 1.00 0.00 N ATOM 0 H ASN B 337 10.567 6.387 9.650 1.00 0.00 H new ATOM 0 HA ASN B 337 10.206 7.554 7.082 1.00 0.00 H new ATOM 0 HB2 ASN B 337 9.076 5.473 8.108 1.00 0.00 H new ATOM 0 HB3 ASN B 337 8.062 6.577 9.016 1.00 0.00 H new ATOM 0 HD21 ASN B 337 5.843 6.600 6.204 1.00 0.00 H new ATOM 0 HD22 ASN B 337 6.058 6.246 7.922 1.00 0.00 H new ATOM 2465 N GLU B 338 9.079 9.198 9.695 1.00 0.00 N ATOM 2466 CA GLU B 338 8.524 10.477 10.130 1.00 0.00 C ATOM 2467 C GLU B 338 9.339 11.642 9.570 1.00 0.00 C ATOM 2468 O GLU B 338 8.782 12.629 9.090 1.00 0.00 O ATOM 2469 CB GLU B 338 8.514 10.549 11.658 1.00 0.00 C ATOM 2470 CG GLU B 338 7.882 11.870 12.105 1.00 0.00 C ATOM 2471 CD GLU B 338 7.743 11.894 13.623 1.00 0.00 C ATOM 2472 OE1 GLU B 338 8.154 10.933 14.252 1.00 0.00 O ATOM 2473 OE2 GLU B 338 7.225 12.873 14.136 1.00 0.00 O ATOM 0 H GLU B 338 9.369 8.580 10.453 1.00 0.00 H new ATOM 0 HA GLU B 338 7.504 10.552 9.754 1.00 0.00 H new ATOM 0 HB2 GLU B 338 7.954 9.709 12.068 1.00 0.00 H new ATOM 0 HB3 GLU B 338 9.531 10.472 12.043 1.00 0.00 H new ATOM 0 HG2 GLU B 338 8.497 12.707 11.775 1.00 0.00 H new ATOM 0 HG3 GLU B 338 6.904 11.990 11.640 1.00 0.00 H new