USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 939 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 44 CYS SG : rot 34:sc= -0.455 USER MOD Set 1.2: A 60 MET CE :methyl 154:sc= -0.126 (180deg=-0.681) USER MOD Set 2.1: A 11 GLN : amide:sc= 0.326 K(o=0.77,f=-2.5!) USER MOD Set 2.2: A 12 ASN : amide:sc= 0.439 K(o=0.77,f=-3) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 70:sc= 0.252 USER MOD Single : A 21 LYS NZ :NH3+ -170:sc= 1.15 (180deg=1.01) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.351 K(o=0.35,f=-5.6!) USER MOD Single : A 38 ASN : amide:sc= 0.591 K(o=0.59,f=0) USER MOD Single : A 39 CYS SG : rot -6:sc= -0.142 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0.545 K(o=0.55,f=-3.9!) USER MOD Single : A 49 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot -135:sc= 0.00406 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0.36 X(o=0.36,f=0) USER MOD Single : A 64 CYS SG : rot -30:sc= 0.0846 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.0756 USER MOD Single : A 66 CYS SG : rot -80:sc= 0.0967 USER MOD Single : A 70 HIS : no HE2:sc= 0.0758 X(o=0.076,f=-0.37) USER MOD Single : A 74 THR OG1 : rot -97:sc= 1.34 USER MOD Single : A 75 GLN : amide:sc= 2.21 K(o=2.2,f=-6.8!) USER MOD Single : A 81 GLN : amide:sc= 0.581 K(o=0.58,f=0) USER MOD Single : A 84 GLN : amide:sc= 0.528 K(o=0.53,f=-0.0061) USER MOD Single : A 93 LYS NZ :NH3+ 176:sc= 1.22 (180deg=1.13) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 87:sc= 1.31 USER MOD Single : A 105 CYS SG : rot 180:sc=-0.00217 USER MOD Single : A 108 CYS SG : rot 32:sc= -0.398 USER MOD Single : A 116 LYS NZ :NH3+ 175:sc= 2.01 (180deg=1.96) USER MOD Single : A 117 ASN : amide:sc= 0.616 K(o=0.62,f=-3.3!) USER MOD Single : A 124 MET CE :methyl 145:sc= -0.204 (180deg=-0.449) USER MOD Single : A 128 ASN : amide:sc= -0.353 X(o=-0.35,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 148 N PRO A 10 -35.611 -14.435 -39.379 1.00 0.00 N ATOM 149 CA PRO A 10 -34.287 -14.986 -39.074 1.00 0.00 C ATOM 150 C PRO A 10 -34.239 -15.560 -37.651 1.00 0.00 C ATOM 151 O PRO A 10 -34.225 -14.837 -36.653 1.00 0.00 O ATOM 152 CB PRO A 10 -33.287 -13.844 -39.292 1.00 0.00 C ATOM 153 CG PRO A 10 -34.142 -12.577 -39.232 1.00 0.00 C ATOM 154 CD PRO A 10 -35.495 -13.037 -39.766 1.00 0.00 C ATOM 0 HA PRO A 10 -34.040 -15.826 -39.723 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -32.514 -13.839 -38.523 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -32.780 -13.937 -40.253 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -34.221 -12.194 -38.215 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -33.720 -11.778 -39.842 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -36.306 -12.444 -39.343 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -35.549 -12.924 -40.849 1.00 0.00 H new ATOM 162 N GLN A 11 -34.198 -16.888 -37.557 1.00 0.00 N ATOM 163 CA GLN A 11 -34.388 -17.624 -36.306 1.00 0.00 C ATOM 164 C GLN A 11 -33.297 -17.363 -35.256 1.00 0.00 C ATOM 165 O GLN A 11 -33.572 -17.448 -34.061 1.00 0.00 O ATOM 166 CB GLN A 11 -34.584 -19.124 -36.606 1.00 0.00 C ATOM 167 CG GLN A 11 -33.322 -19.911 -37.009 1.00 0.00 C ATOM 168 CD GLN A 11 -32.648 -19.431 -38.295 1.00 0.00 C ATOM 169 OE1 GLN A 11 -33.282 -19.085 -39.283 1.00 0.00 O ATOM 170 NE2 GLN A 11 -31.335 -19.355 -38.325 1.00 0.00 N ATOM 0 H GLN A 11 -34.029 -17.494 -38.360 1.00 0.00 H new ATOM 0 HA GLN A 11 -35.296 -17.242 -35.840 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -35.014 -19.596 -35.723 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -35.317 -19.220 -37.407 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -32.600 -19.854 -36.194 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -33.588 -20.962 -37.126 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -30.789 -19.639 -37.511 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -30.863 -19.012 -39.162 1.00 0.00 H new ATOM 179 N ASN A 12 -32.080 -16.997 -35.677 1.00 0.00 N ATOM 180 CA ASN A 12 -30.947 -16.794 -34.768 1.00 0.00 C ATOM 181 C ASN A 12 -31.160 -15.534 -33.911 1.00 0.00 C ATOM 182 O ASN A 12 -31.066 -15.581 -32.686 1.00 0.00 O ATOM 183 CB ASN A 12 -29.641 -16.717 -35.585 1.00 0.00 C ATOM 184 CG ASN A 12 -29.088 -18.071 -36.011 1.00 0.00 C ATOM 185 OD1 ASN A 12 -29.714 -19.116 -35.888 1.00 0.00 O ATOM 186 ND2 ASN A 12 -27.894 -18.096 -36.556 1.00 0.00 N ATOM 0 H ASN A 12 -31.854 -16.833 -36.658 1.00 0.00 H new ATOM 0 HA ASN A 12 -30.873 -17.639 -34.083 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -29.818 -16.113 -36.475 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -28.886 -16.199 -34.994 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -27.496 -18.980 -36.872 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -27.364 -17.231 -36.663 1.00 0.00 H new ATOM 193 N THR A 13 -31.497 -14.410 -34.554 1.00 0.00 N ATOM 194 CA THR A 13 -31.764 -13.121 -33.885 1.00 0.00 C ATOM 195 C THR A 13 -33.150 -13.081 -33.231 1.00 0.00 C ATOM 196 O THR A 13 -33.334 -12.510 -32.151 1.00 0.00 O ATOM 197 CB THR A 13 -31.586 -11.977 -34.893 1.00 0.00 C ATOM 198 OG1 THR A 13 -31.366 -10.745 -34.240 1.00 0.00 O ATOM 199 CG2 THR A 13 -32.779 -11.812 -35.826 1.00 0.00 C ATOM 0 H THR A 13 -31.595 -14.364 -35.568 1.00 0.00 H new ATOM 0 HA THR A 13 -31.044 -13.001 -33.075 1.00 0.00 H new ATOM 0 HB THR A 13 -30.715 -12.253 -35.487 1.00 0.00 H new ATOM 0 HG1 THR A 13 -31.255 -10.036 -34.908 1.00 0.00 H new ATOM 0 HG21 THR A 13 -32.592 -10.988 -36.514 1.00 0.00 H new ATOM 0 HG22 THR A 13 -32.927 -12.731 -36.393 1.00 0.00 H new ATOM 0 HG23 THR A 13 -33.673 -11.599 -35.240 1.00 0.00 H new ATOM 207 N PHE A 14 -34.128 -13.758 -33.843 1.00 0.00 N ATOM 208 CA PHE A 14 -35.452 -13.949 -33.261 1.00 0.00 C ATOM 209 C PHE A 14 -35.341 -14.697 -31.930 1.00 0.00 C ATOM 210 O PHE A 14 -35.958 -14.294 -30.946 1.00 0.00 O ATOM 211 CB PHE A 14 -36.305 -14.717 -34.270 1.00 0.00 C ATOM 212 CG PHE A 14 -37.751 -14.907 -33.858 1.00 0.00 C ATOM 213 CD1 PHE A 14 -38.703 -13.910 -34.144 1.00 0.00 C ATOM 214 CD2 PHE A 14 -38.146 -16.079 -33.182 1.00 0.00 C ATOM 215 CE1 PHE A 14 -40.045 -14.082 -33.756 1.00 0.00 C ATOM 216 CE2 PHE A 14 -39.487 -16.249 -32.792 1.00 0.00 C ATOM 217 CZ PHE A 14 -40.436 -15.251 -33.079 1.00 0.00 C ATOM 0 H PHE A 14 -34.018 -14.189 -34.761 1.00 0.00 H new ATOM 0 HA PHE A 14 -35.923 -12.989 -33.049 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -36.279 -14.190 -35.224 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -35.856 -15.697 -34.435 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -38.403 -13.011 -34.662 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -37.419 -16.847 -32.963 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -40.774 -13.317 -33.978 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -39.788 -17.146 -32.272 1.00 0.00 H new ATOM 0 HZ PHE A 14 -41.465 -15.383 -32.779 1.00 0.00 H new ATOM 227 N LEU A 15 -34.472 -15.713 -31.869 1.00 0.00 N ATOM 228 CA LEU A 15 -34.154 -16.410 -30.619 1.00 0.00 C ATOM 229 C LEU A 15 -33.321 -15.538 -29.669 1.00 0.00 C ATOM 230 O LEU A 15 -33.662 -15.454 -28.500 1.00 0.00 O ATOM 231 CB LEU A 15 -33.487 -17.766 -30.903 1.00 0.00 C ATOM 232 CG LEU A 15 -33.024 -18.498 -29.628 1.00 0.00 C ATOM 233 CD1 LEU A 15 -34.150 -18.746 -28.616 1.00 0.00 C ATOM 234 CD2 LEU A 15 -32.404 -19.844 -29.996 1.00 0.00 C ATOM 0 H LEU A 15 -33.972 -16.073 -32.682 1.00 0.00 H new ATOM 0 HA LEU A 15 -35.093 -16.610 -30.102 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -34.188 -18.402 -31.444 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -32.628 -17.611 -31.556 1.00 0.00 H new ATOM 0 HG LEU A 15 -32.296 -17.839 -29.155 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -33.749 -19.265 -27.745 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -34.577 -17.792 -28.305 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -34.926 -19.357 -29.077 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -32.079 -20.355 -29.090 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -33.143 -20.456 -30.513 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -31.546 -19.683 -30.649 1.00 0.00 H new ATOM 246 N ASP A 16 -32.283 -14.842 -30.134 1.00 0.00 N ATOM 247 CA ASP A 16 -31.499 -13.866 -29.351 1.00 0.00 C ATOM 248 C ASP A 16 -32.375 -12.866 -28.572 1.00 0.00 C ATOM 249 O ASP A 16 -32.083 -12.502 -27.431 1.00 0.00 O ATOM 250 CB ASP A 16 -30.547 -13.118 -30.285 1.00 0.00 C ATOM 251 CG ASP A 16 -29.586 -12.219 -29.502 1.00 0.00 C ATOM 252 OD1 ASP A 16 -28.510 -12.698 -29.070 1.00 0.00 O ATOM 253 OD2 ASP A 16 -29.924 -11.027 -29.328 1.00 0.00 O ATOM 0 H ASP A 16 -31.949 -14.939 -31.093 1.00 0.00 H new ATOM 0 HA ASP A 16 -30.938 -14.427 -28.604 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -29.977 -13.835 -30.876 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -31.123 -12.514 -30.986 1.00 0.00 H new ATOM 258 N THR A 17 -33.460 -12.407 -29.193 1.00 0.00 N ATOM 259 CA THR A 17 -34.480 -11.577 -28.523 1.00 0.00 C ATOM 260 C THR A 17 -35.130 -12.299 -27.332 1.00 0.00 C ATOM 261 O THR A 17 -35.261 -11.731 -26.246 1.00 0.00 O ATOM 262 CB THR A 17 -35.545 -11.098 -29.525 1.00 0.00 C ATOM 263 OG1 THR A 17 -34.937 -10.375 -30.578 1.00 0.00 O ATOM 264 CG2 THR A 17 -36.573 -10.162 -28.885 1.00 0.00 C ATOM 0 H THR A 17 -33.664 -12.596 -30.174 1.00 0.00 H new ATOM 0 HA THR A 17 -33.966 -10.703 -28.123 1.00 0.00 H new ATOM 0 HB THR A 17 -36.044 -11.998 -29.885 1.00 0.00 H new ATOM 0 HG1 THR A 17 -34.416 -10.988 -31.138 1.00 0.00 H new ATOM 0 HG21 THR A 17 -37.301 -9.854 -29.635 1.00 0.00 H new ATOM 0 HG22 THR A 17 -37.084 -10.682 -28.075 1.00 0.00 H new ATOM 0 HG23 THR A 17 -36.067 -9.282 -28.488 1.00 0.00 H new ATOM 272 N ILE A 18 -35.476 -13.579 -27.492 1.00 0.00 N ATOM 273 CA ILE A 18 -36.014 -14.425 -26.414 1.00 0.00 C ATOM 274 C ILE A 18 -34.942 -14.713 -25.357 1.00 0.00 C ATOM 275 O ILE A 18 -35.254 -14.714 -24.165 1.00 0.00 O ATOM 276 CB ILE A 18 -36.579 -15.750 -26.970 1.00 0.00 C ATOM 277 CG1 ILE A 18 -37.575 -15.587 -28.131 1.00 0.00 C ATOM 278 CG2 ILE A 18 -37.217 -16.610 -25.867 1.00 0.00 C ATOM 279 CD1 ILE A 18 -38.867 -14.838 -27.778 1.00 0.00 C ATOM 0 H ILE A 18 -35.391 -14.067 -28.384 1.00 0.00 H new ATOM 0 HA ILE A 18 -36.829 -13.875 -25.944 1.00 0.00 H new ATOM 0 HB ILE A 18 -35.704 -16.258 -27.376 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -37.078 -15.059 -28.945 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -37.837 -16.576 -28.506 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -37.602 -17.533 -26.302 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -36.467 -16.849 -25.113 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -38.035 -16.059 -25.403 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -39.503 -14.774 -28.661 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -39.394 -15.374 -26.988 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -38.623 -13.833 -27.434 1.00 0.00 H new ATOM 291 N ILE A 19 -33.672 -14.867 -25.762 1.00 0.00 N ATOM 292 CA ILE A 19 -32.556 -14.964 -24.824 1.00 0.00 C ATOM 293 C ILE A 19 -32.572 -13.741 -23.922 1.00 0.00 C ATOM 294 O ILE A 19 -32.682 -13.903 -22.718 1.00 0.00 O ATOM 295 CB ILE A 19 -31.172 -15.090 -25.500 1.00 0.00 C ATOM 296 CG1 ILE A 19 -31.025 -16.282 -26.465 1.00 0.00 C ATOM 297 CG2 ILE A 19 -30.081 -15.173 -24.419 1.00 0.00 C ATOM 298 CD1 ILE A 19 -31.500 -17.619 -25.903 1.00 0.00 C ATOM 0 H ILE A 19 -33.397 -14.927 -26.742 1.00 0.00 H new ATOM 0 HA ILE A 19 -32.697 -15.884 -24.258 1.00 0.00 H new ATOM 0 HB ILE A 19 -31.063 -14.197 -26.115 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -31.585 -16.066 -27.375 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -29.977 -16.375 -26.750 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -29.104 -15.262 -24.894 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -30.106 -14.272 -23.807 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -30.259 -16.044 -23.789 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -31.358 -18.399 -26.651 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -30.924 -17.864 -25.010 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -32.557 -17.551 -25.646 1.00 0.00 H new ATOM 310 N ARG A 20 -32.570 -12.524 -24.484 1.00 0.00 N ATOM 311 CA ARG A 20 -32.667 -11.271 -23.712 1.00 0.00 C ATOM 312 C ARG A 20 -33.953 -11.171 -22.900 1.00 0.00 C ATOM 313 O ARG A 20 -33.945 -10.556 -21.837 1.00 0.00 O ATOM 314 CB ARG A 20 -32.519 -10.072 -24.646 1.00 0.00 C ATOM 315 CG ARG A 20 -31.039 -9.857 -24.982 1.00 0.00 C ATOM 316 CD ARG A 20 -30.895 -8.776 -26.048 1.00 0.00 C ATOM 317 NE ARG A 20 -31.334 -9.290 -27.357 1.00 0.00 N ATOM 318 CZ ARG A 20 -31.954 -8.653 -28.328 1.00 0.00 C ATOM 319 NH1 ARG A 20 -32.498 -7.478 -28.179 1.00 0.00 N ATOM 320 NH2 ARG A 20 -32.030 -9.225 -29.488 1.00 0.00 N ATOM 0 H ARG A 20 -32.501 -12.377 -25.491 1.00 0.00 H new ATOM 0 HA ARG A 20 -31.851 -11.273 -22.990 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -33.089 -10.239 -25.560 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -32.928 -9.179 -24.174 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -30.493 -9.568 -24.084 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -30.599 -10.789 -25.337 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -31.488 -7.904 -25.774 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -29.857 -8.449 -26.107 1.00 0.00 H new ATOM 0 HE ARG A 20 -31.130 -10.273 -27.535 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -32.455 -7.007 -27.275 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -32.967 -7.029 -28.966 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -31.615 -10.146 -29.631 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -32.505 -8.754 -30.259 1.00 0.00 H new ATOM 334 N LYS A 21 -35.028 -11.825 -23.340 1.00 0.00 N ATOM 335 CA LYS A 21 -36.275 -11.938 -22.553 1.00 0.00 C ATOM 336 C LYS A 21 -36.090 -12.747 -21.258 1.00 0.00 C ATOM 337 O LYS A 21 -36.626 -12.340 -20.226 1.00 0.00 O ATOM 338 CB LYS A 21 -37.416 -12.527 -23.403 1.00 0.00 C ATOM 339 CG LYS A 21 -38.811 -12.056 -22.956 1.00 0.00 C ATOM 340 CD LYS A 21 -39.114 -10.614 -23.394 1.00 0.00 C ATOM 341 CE LYS A 21 -40.454 -10.148 -22.811 1.00 0.00 C ATOM 342 NZ LYS A 21 -40.727 -8.727 -23.142 1.00 0.00 N ATOM 0 H LYS A 21 -35.068 -12.292 -24.246 1.00 0.00 H new ATOM 0 HA LYS A 21 -36.546 -10.924 -22.258 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -37.263 -12.250 -24.446 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -37.374 -13.615 -23.352 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -39.566 -12.724 -23.370 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -38.884 -12.126 -21.871 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -38.315 -9.951 -23.062 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -39.144 -10.556 -24.482 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -41.258 -10.774 -23.199 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -40.445 -10.275 -21.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -41.548 -8.395 -22.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -39.896 -8.149 -22.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -40.928 -8.640 -24.159 1.00 0.00 H new ATOM 356 N PHE A 22 -35.328 -13.850 -21.289 1.00 0.00 N ATOM 357 CA PHE A 22 -35.059 -14.695 -20.105 1.00 0.00 C ATOM 358 C PHE A 22 -33.640 -14.580 -19.494 1.00 0.00 C ATOM 359 O PHE A 22 -33.339 -15.265 -18.514 1.00 0.00 O ATOM 360 CB PHE A 22 -35.485 -16.154 -20.363 1.00 0.00 C ATOM 361 CG PHE A 22 -34.628 -16.991 -21.304 1.00 0.00 C ATOM 362 CD1 PHE A 22 -33.396 -17.529 -20.878 1.00 0.00 C ATOM 363 CD2 PHE A 22 -35.113 -17.324 -22.584 1.00 0.00 C ATOM 364 CE1 PHE A 22 -32.645 -18.359 -21.729 1.00 0.00 C ATOM 365 CE2 PHE A 22 -34.367 -18.160 -23.434 1.00 0.00 C ATOM 366 CZ PHE A 22 -33.133 -18.678 -23.008 1.00 0.00 C ATOM 0 H PHE A 22 -34.876 -14.187 -22.139 1.00 0.00 H new ATOM 0 HA PHE A 22 -35.688 -14.281 -19.317 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -35.524 -16.666 -19.402 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -36.501 -16.141 -20.758 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -33.026 -17.301 -19.889 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -36.064 -16.935 -22.915 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -31.694 -18.751 -21.400 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -34.744 -18.404 -24.416 1.00 0.00 H new ATOM 0 HZ PHE A 22 -32.561 -19.320 -23.661 1.00 0.00 H new ATOM 376 N GLU A 23 -32.776 -13.709 -20.027 1.00 0.00 N ATOM 377 CA GLU A 23 -31.324 -13.632 -19.757 1.00 0.00 C ATOM 378 C GLU A 23 -30.962 -13.475 -18.257 1.00 0.00 C ATOM 379 O GLU A 23 -29.911 -13.945 -17.815 1.00 0.00 O ATOM 380 CB GLU A 23 -30.746 -12.461 -20.590 1.00 0.00 C ATOM 381 CG GLU A 23 -29.236 -12.248 -20.421 1.00 0.00 C ATOM 382 CD GLU A 23 -28.724 -11.157 -21.379 1.00 0.00 C ATOM 383 OE1 GLU A 23 -28.826 -9.953 -21.040 1.00 0.00 O ATOM 384 OE2 GLU A 23 -28.203 -11.496 -22.470 1.00 0.00 O ATOM 0 H GLU A 23 -33.080 -12.999 -20.694 1.00 0.00 H new ATOM 0 HA GLU A 23 -30.880 -14.584 -20.049 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -30.960 -12.641 -21.644 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -31.264 -11.543 -20.312 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -29.018 -11.965 -19.391 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -28.709 -13.183 -20.613 1.00 0.00 H new ATOM 450 N LYS A 28 -36.477 -4.985 -15.339 1.00 0.00 N ATOM 451 CA LYS A 28 -37.012 -3.614 -15.468 1.00 0.00 C ATOM 452 C LYS A 28 -36.168 -2.518 -14.801 1.00 0.00 C ATOM 453 O LYS A 28 -35.621 -2.739 -13.721 1.00 0.00 O ATOM 454 CB LYS A 28 -38.462 -3.570 -14.941 1.00 0.00 C ATOM 455 CG LYS A 28 -39.348 -4.779 -15.329 1.00 0.00 C ATOM 456 CD LYS A 28 -39.542 -5.797 -14.190 1.00 0.00 C ATOM 457 CE LYS A 28 -40.728 -6.738 -14.467 1.00 0.00 C ATOM 458 NZ LYS A 28 -40.444 -7.731 -15.540 1.00 0.00 N ATOM 0 HA LYS A 28 -36.978 -3.385 -16.533 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -38.433 -3.497 -13.854 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -38.937 -2.661 -15.309 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -40.324 -4.415 -15.648 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -38.901 -5.286 -16.185 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -38.632 -6.384 -14.067 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -39.709 -5.267 -13.252 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -40.987 -7.267 -13.550 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -41.597 -6.144 -14.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -41.278 -8.336 -15.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -40.223 -7.232 -16.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -39.632 -8.319 -15.263 1.00 0.00 H new ATOM 472 N PHE A 29 -36.141 -1.316 -15.398 1.00 0.00 N ATOM 473 CA PHE A 29 -35.379 -0.166 -14.869 1.00 0.00 C ATOM 474 C PHE A 29 -35.672 1.177 -15.556 1.00 0.00 C ATOM 475 O PHE A 29 -36.196 1.264 -16.674 1.00 0.00 O ATOM 476 CB PHE A 29 -33.849 -0.420 -14.926 1.00 0.00 C ATOM 477 CG PHE A 29 -33.190 -0.559 -16.291 1.00 0.00 C ATOM 478 CD1 PHE A 29 -32.877 0.572 -17.072 1.00 0.00 C ATOM 479 CD2 PHE A 29 -32.795 -1.832 -16.741 1.00 0.00 C ATOM 480 CE1 PHE A 29 -32.222 0.418 -18.310 1.00 0.00 C ATOM 481 CE2 PHE A 29 -32.138 -1.988 -17.974 1.00 0.00 C ATOM 482 CZ PHE A 29 -31.854 -0.861 -18.762 1.00 0.00 C ATOM 0 H PHE A 29 -36.645 -1.111 -16.261 1.00 0.00 H new ATOM 0 HA PHE A 29 -35.721 -0.083 -13.838 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -33.357 0.399 -14.401 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -33.642 -1.330 -14.363 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -33.140 1.559 -16.721 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -32.999 -2.700 -16.132 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -32.002 1.286 -18.914 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -31.852 -2.972 -18.314 1.00 0.00 H new ATOM 0 HZ PHE A 29 -31.354 -0.977 -19.712 1.00 0.00 H new ATOM 492 N ILE A 30 -35.264 2.239 -14.857 1.00 0.00 N ATOM 493 CA ILE A 30 -35.210 3.614 -15.357 1.00 0.00 C ATOM 494 C ILE A 30 -33.795 4.171 -15.263 1.00 0.00 C ATOM 495 O ILE A 30 -32.923 3.580 -14.635 1.00 0.00 O ATOM 496 CB ILE A 30 -36.219 4.523 -14.623 1.00 0.00 C ATOM 497 CG1 ILE A 30 -36.315 4.325 -13.097 1.00 0.00 C ATOM 498 CG2 ILE A 30 -37.585 4.319 -15.277 1.00 0.00 C ATOM 499 CD1 ILE A 30 -34.974 4.453 -12.365 1.00 0.00 C ATOM 0 H ILE A 30 -34.950 2.161 -13.890 1.00 0.00 H new ATOM 0 HA ILE A 30 -35.495 3.596 -16.409 1.00 0.00 H new ATOM 0 HB ILE A 30 -35.855 5.545 -14.727 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -37.011 5.058 -12.689 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -36.735 3.340 -12.895 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -38.324 4.949 -14.781 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -37.528 4.589 -16.331 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -37.880 3.274 -15.186 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -35.127 4.301 -11.297 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -34.280 3.702 -12.743 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -34.561 5.447 -12.534 1.00 0.00 H new ATOM 511 N ILE A 31 -33.583 5.325 -15.877 1.00 0.00 N ATOM 512 CA ILE A 31 -32.361 6.111 -15.824 1.00 0.00 C ATOM 513 C ILE A 31 -32.740 7.485 -15.316 1.00 0.00 C ATOM 514 O ILE A 31 -33.454 8.235 -15.983 1.00 0.00 O ATOM 515 CB ILE A 31 -31.687 6.230 -17.207 1.00 0.00 C ATOM 516 CG1 ILE A 31 -31.687 4.916 -18.014 1.00 0.00 C ATOM 517 CG2 ILE A 31 -30.271 6.806 -17.026 1.00 0.00 C ATOM 518 CD1 ILE A 31 -30.766 3.868 -17.402 1.00 0.00 C ATOM 0 H ILE A 31 -34.299 5.762 -16.458 1.00 0.00 H new ATOM 0 HA ILE A 31 -31.641 5.622 -15.167 1.00 0.00 H new ATOM 0 HB ILE A 31 -32.282 6.914 -17.812 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -32.702 4.522 -18.064 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -31.374 5.120 -19.038 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -29.787 6.894 -17.999 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -30.335 7.790 -16.563 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -29.687 6.142 -16.388 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -30.798 2.960 -18.004 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -29.746 4.251 -17.377 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -31.094 3.643 -16.387 1.00 0.00 H new ATOM 530 N ALA A 32 -32.236 7.809 -14.138 1.00 0.00 N ATOM 531 CA ALA A 32 -32.409 9.125 -13.539 1.00 0.00 C ATOM 532 C ALA A 32 -31.069 9.773 -13.221 1.00 0.00 C ATOM 533 O ALA A 32 -30.069 9.090 -12.984 1.00 0.00 O ATOM 534 CB ALA A 32 -33.333 9.052 -12.322 1.00 0.00 C ATOM 0 H ALA A 32 -31.692 7.164 -13.565 1.00 0.00 H new ATOM 0 HA ALA A 32 -32.895 9.772 -14.269 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -33.447 10.047 -11.892 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -34.309 8.675 -12.628 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -32.902 8.382 -11.578 1.00 0.00 H new ATOM 540 N ASN A 33 -31.048 11.103 -13.205 1.00 0.00 N ATOM 541 CA ASN A 33 -29.849 11.842 -12.890 1.00 0.00 C ATOM 542 C ASN A 33 -29.736 11.982 -11.359 1.00 0.00 C ATOM 543 O ASN A 33 -30.635 12.512 -10.704 1.00 0.00 O ATOM 544 CB ASN A 33 -29.967 13.118 -13.724 1.00 0.00 C ATOM 545 CG ASN A 33 -28.792 14.055 -13.642 1.00 0.00 C ATOM 546 OD1 ASN A 33 -27.914 13.950 -12.798 1.00 0.00 O ATOM 547 ND2 ASN A 33 -28.777 15.003 -14.547 1.00 0.00 N ATOM 0 H ASN A 33 -31.859 11.686 -13.410 1.00 0.00 H new ATOM 0 HA ASN A 33 -28.901 11.372 -13.151 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -30.114 12.838 -14.767 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -30.861 13.656 -13.409 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -28.016 15.682 -14.561 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -29.526 15.061 -15.237 1.00 0.00 H new ATOM 554 N ALA A 34 -28.645 11.476 -10.775 1.00 0.00 N ATOM 555 CA ALA A 34 -28.407 11.531 -9.325 1.00 0.00 C ATOM 556 C ALA A 34 -27.910 12.914 -8.851 1.00 0.00 C ATOM 557 O ALA A 34 -27.808 13.168 -7.648 1.00 0.00 O ATOM 558 CB ALA A 34 -27.416 10.419 -8.950 1.00 0.00 C ATOM 0 H ALA A 34 -27.898 11.015 -11.295 1.00 0.00 H new ATOM 0 HA ALA A 34 -29.356 11.373 -8.812 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -27.228 10.446 -7.877 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -27.836 9.450 -9.221 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -26.479 10.571 -9.486 1.00 0.00 H new ATOM 564 N ARG A 35 -27.571 13.802 -9.798 1.00 0.00 N ATOM 565 CA ARG A 35 -26.932 15.115 -9.566 1.00 0.00 C ATOM 566 C ARG A 35 -27.905 16.307 -9.604 1.00 0.00 C ATOM 567 O ARG A 35 -27.470 17.458 -9.540 1.00 0.00 O ATOM 568 CB ARG A 35 -25.745 15.301 -10.538 1.00 0.00 C ATOM 569 CG ARG A 35 -24.757 14.118 -10.616 1.00 0.00 C ATOM 570 CD ARG A 35 -24.152 13.690 -9.268 1.00 0.00 C ATOM 571 NE ARG A 35 -23.396 14.779 -8.611 1.00 0.00 N ATOM 572 CZ ARG A 35 -22.152 15.157 -8.852 1.00 0.00 C ATOM 573 NH1 ARG A 35 -21.410 14.585 -9.760 1.00 0.00 N ATOM 574 NH2 ARG A 35 -21.620 16.133 -8.174 1.00 0.00 N ATOM 0 H ARG A 35 -27.740 13.622 -10.788 1.00 0.00 H new ATOM 0 HA ARG A 35 -26.558 15.106 -8.542 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -26.141 15.487 -11.536 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -25.193 16.193 -10.243 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -25.271 13.263 -11.055 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -23.946 14.385 -11.293 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -24.951 13.356 -8.605 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -23.491 12.838 -9.425 1.00 0.00 H new ATOM 0 HE ARG A 35 -23.893 15.299 -7.888 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -21.785 13.816 -10.315 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -20.455 14.907 -9.915 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -22.163 16.609 -7.454 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -20.660 16.421 -8.363 1.00 0.00 H new ATOM 588 N VAL A 36 -29.210 16.042 -9.720 1.00 0.00 N ATOM 589 CA VAL A 36 -30.289 17.037 -9.890 1.00 0.00 C ATOM 590 C VAL A 36 -31.301 16.976 -8.745 1.00 0.00 C ATOM 591 O VAL A 36 -31.710 15.902 -8.308 1.00 0.00 O ATOM 592 CB VAL A 36 -30.996 16.885 -11.256 1.00 0.00 C ATOM 593 CG1 VAL A 36 -30.085 17.365 -12.389 1.00 0.00 C ATOM 594 CG2 VAL A 36 -31.448 15.464 -11.539 1.00 0.00 C ATOM 0 H VAL A 36 -29.566 15.086 -9.698 1.00 0.00 H new ATOM 0 HA VAL A 36 -29.818 18.020 -9.866 1.00 0.00 H new ATOM 0 HB VAL A 36 -31.890 17.506 -11.205 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -30.600 17.250 -13.343 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -29.835 18.415 -12.235 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -29.170 16.772 -12.397 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -31.937 15.425 -12.513 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -30.583 14.801 -11.540 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -32.149 15.145 -10.768 1.00 0.00 H new ATOM 604 N GLU A 37 -31.759 18.141 -8.291 1.00 0.00 N ATOM 605 CA GLU A 37 -32.695 18.271 -7.156 1.00 0.00 C ATOM 606 C GLU A 37 -34.101 17.723 -7.465 1.00 0.00 C ATOM 607 O GLU A 37 -34.825 17.290 -6.567 1.00 0.00 O ATOM 608 CB GLU A 37 -32.750 19.734 -6.686 1.00 0.00 C ATOM 609 CG GLU A 37 -33.316 20.718 -7.722 1.00 0.00 C ATOM 610 CD GLU A 37 -33.290 22.162 -7.182 1.00 0.00 C ATOM 611 OE1 GLU A 37 -34.275 22.590 -6.532 1.00 0.00 O ATOM 612 OE2 GLU A 37 -32.287 22.883 -7.410 1.00 0.00 O ATOM 0 H GLU A 37 -31.493 19.037 -8.700 1.00 0.00 H new ATOM 0 HA GLU A 37 -32.311 17.651 -6.346 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -33.357 19.789 -5.782 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -31.744 20.052 -6.414 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -32.734 20.659 -8.641 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -34.339 20.438 -7.974 1.00 0.00 H new ATOM 619 N ASN A 38 -34.460 17.685 -8.752 1.00 0.00 N ATOM 620 CA ASN A 38 -35.688 17.078 -9.267 1.00 0.00 C ATOM 621 C ASN A 38 -35.599 15.533 -9.338 1.00 0.00 C ATOM 622 O ASN A 38 -36.616 14.880 -9.574 1.00 0.00 O ATOM 623 CB ASN A 38 -35.969 17.720 -10.646 1.00 0.00 C ATOM 624 CG ASN A 38 -37.439 17.755 -11.049 1.00 0.00 C ATOM 625 OD1 ASN A 38 -38.023 18.810 -11.250 1.00 0.00 O ATOM 626 ND2 ASN A 38 -38.088 16.625 -11.203 1.00 0.00 N ATOM 0 H ASN A 38 -33.882 18.091 -9.488 1.00 0.00 H new ATOM 0 HA ASN A 38 -36.518 17.272 -8.588 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -35.584 18.740 -10.641 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -35.412 17.172 -11.406 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -39.068 16.634 -11.487 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -37.613 15.738 -11.039 1.00 0.00 H new ATOM 633 N CYS A 39 -34.400 14.944 -9.185 1.00 0.00 N ATOM 634 CA CYS A 39 -34.122 13.501 -9.316 1.00 0.00 C ATOM 635 C CYS A 39 -34.758 12.882 -10.579 1.00 0.00 C ATOM 636 O CYS A 39 -35.306 11.778 -10.531 1.00 0.00 O ATOM 637 CB CYS A 39 -34.538 12.776 -8.024 1.00 0.00 C ATOM 638 SG CYS A 39 -33.789 13.571 -6.571 1.00 0.00 S ATOM 0 H CYS A 39 -33.563 15.481 -8.957 1.00 0.00 H new ATOM 0 HA CYS A 39 -33.048 13.370 -9.452 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -35.624 12.784 -7.930 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -34.230 11.731 -8.072 1.00 0.00 H new ATOM 0 HG CYS A 39 -32.959 14.493 -6.960 1.00 0.00 H new ATOM 644 N ALA A 40 -34.760 13.621 -11.694 1.00 0.00 N ATOM 645 CA ALA A 40 -35.581 13.285 -12.853 1.00 0.00 C ATOM 646 C ALA A 40 -35.085 12.091 -13.687 1.00 0.00 C ATOM 647 O ALA A 40 -33.880 11.865 -13.836 1.00 0.00 O ATOM 648 CB ALA A 40 -35.770 14.545 -13.705 1.00 0.00 C ATOM 0 H ALA A 40 -34.196 14.462 -11.814 1.00 0.00 H new ATOM 0 HA ALA A 40 -36.540 12.937 -12.470 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -36.382 14.307 -14.575 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -36.265 15.314 -13.112 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -34.797 14.911 -14.035 1.00 0.00 H new ATOM 654 N VAL A 41 -36.050 11.394 -14.301 1.00 0.00 N ATOM 655 CA VAL A 41 -35.919 10.240 -15.192 1.00 0.00 C ATOM 656 C VAL A 41 -35.560 10.741 -16.590 1.00 0.00 C ATOM 657 O VAL A 41 -36.421 11.053 -17.412 1.00 0.00 O ATOM 658 CB VAL A 41 -37.221 9.405 -15.180 1.00 0.00 C ATOM 659 CG1 VAL A 41 -37.170 8.207 -16.135 1.00 0.00 C ATOM 660 CG2 VAL A 41 -37.510 8.832 -13.784 1.00 0.00 C ATOM 0 H VAL A 41 -37.029 11.649 -14.173 1.00 0.00 H new ATOM 0 HA VAL A 41 -35.122 9.580 -14.850 1.00 0.00 H new ATOM 0 HB VAL A 41 -37.999 10.101 -15.495 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -38.111 7.660 -16.083 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -37.012 8.560 -17.154 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -36.351 7.548 -15.848 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -38.432 8.251 -13.813 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -36.685 8.189 -13.477 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -37.618 9.649 -13.071 1.00 0.00 H new ATOM 670 N ILE A 42 -34.259 10.851 -16.841 1.00 0.00 N ATOM 671 CA ILE A 42 -33.678 11.279 -18.119 1.00 0.00 C ATOM 672 C ILE A 42 -33.869 10.224 -19.229 1.00 0.00 C ATOM 673 O ILE A 42 -33.888 10.576 -20.409 1.00 0.00 O ATOM 674 CB ILE A 42 -32.186 11.637 -17.916 1.00 0.00 C ATOM 675 CG1 ILE A 42 -31.370 10.420 -17.426 1.00 0.00 C ATOM 676 CG2 ILE A 42 -32.044 12.826 -16.944 1.00 0.00 C ATOM 677 CD1 ILE A 42 -29.875 10.686 -17.298 1.00 0.00 C ATOM 0 H ILE A 42 -33.551 10.638 -16.138 1.00 0.00 H new ATOM 0 HA ILE A 42 -34.209 12.169 -18.457 1.00 0.00 H new ATOM 0 HB ILE A 42 -31.779 11.931 -18.883 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -31.756 10.103 -16.457 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -31.523 9.591 -18.117 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -30.989 13.064 -16.813 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -32.564 13.693 -17.351 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -32.479 12.562 -15.980 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -29.373 9.783 -16.949 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -29.472 10.973 -18.269 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -29.709 11.493 -16.584 1.00 0.00 H new ATOM 689 N TYR A 43 -34.042 8.948 -18.859 1.00 0.00 N ATOM 690 CA TYR A 43 -34.384 7.841 -19.779 1.00 0.00 C ATOM 691 C TYR A 43 -35.085 6.673 -19.074 1.00 0.00 C ATOM 692 O TYR A 43 -35.032 6.553 -17.855 1.00 0.00 O ATOM 693 CB TYR A 43 -33.163 7.356 -20.588 1.00 0.00 C ATOM 694 CG TYR A 43 -33.539 6.465 -21.762 1.00 0.00 C ATOM 695 CD1 TYR A 43 -34.316 6.988 -22.816 1.00 0.00 C ATOM 696 CD2 TYR A 43 -33.179 5.102 -21.768 1.00 0.00 C ATOM 697 CE1 TYR A 43 -34.741 6.149 -23.864 1.00 0.00 C ATOM 698 CE2 TYR A 43 -33.592 4.263 -22.822 1.00 0.00 C ATOM 699 CZ TYR A 43 -34.381 4.785 -23.872 1.00 0.00 C ATOM 700 OH TYR A 43 -34.793 3.982 -24.892 1.00 0.00 O ATOM 0 H TYR A 43 -33.947 8.644 -17.890 1.00 0.00 H new ATOM 0 HA TYR A 43 -35.102 8.257 -20.486 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -32.613 8.221 -20.958 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -32.490 6.810 -19.927 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -34.586 8.034 -22.820 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -32.584 4.699 -20.961 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -35.345 6.551 -24.664 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -33.306 3.222 -22.828 1.00 0.00 H new ATOM 0 HH TYR A 43 -34.459 3.072 -24.747 1.00 0.00 H new ATOM 710 N CYS A 44 -35.797 5.823 -19.815 1.00 0.00 N ATOM 711 CA CYS A 44 -36.581 4.720 -19.257 1.00 0.00 C ATOM 712 C CYS A 44 -36.550 3.458 -20.138 1.00 0.00 C ATOM 713 O CYS A 44 -36.623 3.556 -21.369 1.00 0.00 O ATOM 714 CB CYS A 44 -38.006 5.232 -18.989 1.00 0.00 C ATOM 715 SG CYS A 44 -38.662 6.117 -20.433 1.00 0.00 S ATOM 0 H CYS A 44 -35.846 5.882 -20.832 1.00 0.00 H new ATOM 0 HA CYS A 44 -36.133 4.398 -18.317 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -38.658 4.393 -18.745 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -38.002 5.894 -18.123 1.00 0.00 H new ATOM 0 HG CYS A 44 -38.202 5.574 -21.521 1.00 0.00 H new ATOM 721 N ASN A 45 -36.457 2.265 -19.528 1.00 0.00 N ATOM 722 CA ASN A 45 -36.448 0.996 -20.267 1.00 0.00 C ATOM 723 C ASN A 45 -37.852 0.480 -20.618 1.00 0.00 C ATOM 724 O ASN A 45 -38.834 0.768 -19.936 1.00 0.00 O ATOM 725 CB ASN A 45 -35.640 -0.051 -19.484 1.00 0.00 C ATOM 726 CG ASN A 45 -35.177 -1.202 -20.358 1.00 0.00 C ATOM 727 OD1 ASN A 45 -35.773 -2.268 -20.363 1.00 0.00 O ATOM 728 ND2 ASN A 45 -34.167 -1.009 -21.172 1.00 0.00 N ATOM 0 H ASN A 45 -36.387 2.155 -18.516 1.00 0.00 H new ATOM 0 HA ASN A 45 -35.966 1.183 -21.226 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -34.772 0.429 -19.031 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -36.250 -0.441 -18.669 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -33.878 -1.750 -21.811 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -33.670 -0.118 -21.166 1.00 0.00 H new ATOM 735 N ASP A 46 -37.928 -0.375 -21.638 1.00 0.00 N ATOM 736 CA ASP A 46 -39.152 -1.102 -21.998 1.00 0.00 C ATOM 737 C ASP A 46 -39.620 -2.016 -20.853 1.00 0.00 C ATOM 738 O ASP A 46 -40.819 -2.204 -20.658 1.00 0.00 O ATOM 739 CB ASP A 46 -38.911 -1.904 -23.285 1.00 0.00 C ATOM 740 CG ASP A 46 -38.568 -0.977 -24.456 1.00 0.00 C ATOM 741 OD1 ASP A 46 -39.491 -0.492 -25.150 1.00 0.00 O ATOM 742 OD2 ASP A 46 -37.375 -0.639 -24.636 1.00 0.00 O ATOM 0 H ASP A 46 -37.136 -0.586 -22.245 1.00 0.00 H new ATOM 0 HA ASP A 46 -39.949 -0.380 -22.174 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -38.098 -2.613 -23.128 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -39.800 -2.486 -23.526 1.00 0.00 H new ATOM 747 N GLY A 47 -38.697 -2.496 -20.014 1.00 0.00 N ATOM 748 CA GLY A 47 -39.015 -3.208 -18.780 1.00 0.00 C ATOM 749 C GLY A 47 -39.948 -2.422 -17.849 1.00 0.00 C ATOM 750 O GLY A 47 -40.979 -2.960 -17.456 1.00 0.00 O ATOM 0 H GLY A 47 -37.695 -2.398 -20.178 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -39.480 -4.162 -19.029 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -38.090 -3.433 -18.250 1.00 0.00 H new ATOM 754 N PHE A 48 -39.669 -1.145 -17.538 1.00 0.00 N ATOM 755 CA PHE A 48 -40.606 -0.286 -16.778 1.00 0.00 C ATOM 756 C PHE A 48 -41.989 -0.247 -17.465 1.00 0.00 C ATOM 757 O PHE A 48 -43.034 -0.286 -16.806 1.00 0.00 O ATOM 758 CB PHE A 48 -40.047 1.156 -16.611 1.00 0.00 C ATOM 759 CG PHE A 48 -41.032 2.258 -17.000 1.00 0.00 C ATOM 760 CD1 PHE A 48 -42.086 2.598 -16.125 1.00 0.00 C ATOM 761 CD2 PHE A 48 -41.016 2.804 -18.299 1.00 0.00 C ATOM 762 CE1 PHE A 48 -43.146 3.407 -16.572 1.00 0.00 C ATOM 763 CE2 PHE A 48 -42.073 3.617 -18.745 1.00 0.00 C ATOM 764 CZ PHE A 48 -43.146 3.907 -17.886 1.00 0.00 C ATOM 0 H PHE A 48 -38.800 -0.679 -17.800 1.00 0.00 H new ATOM 0 HA PHE A 48 -40.719 -0.721 -15.785 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -39.749 1.300 -15.572 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -39.147 1.257 -17.218 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -42.078 2.235 -15.108 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -40.185 2.596 -18.957 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -43.961 3.645 -15.905 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -42.060 4.018 -19.748 1.00 0.00 H new ATOM 0 HZ PHE A 48 -43.969 4.513 -18.234 1.00 0.00 H new ATOM 774 N CYS A 49 -41.990 -0.170 -18.797 1.00 0.00 N ATOM 775 CA CYS A 49 -43.222 -0.140 -19.584 1.00 0.00 C ATOM 776 C CYS A 49 -44.058 -1.415 -19.354 1.00 0.00 C ATOM 777 O CYS A 49 -45.269 -1.342 -19.162 1.00 0.00 O ATOM 778 CB CYS A 49 -42.888 0.127 -21.060 1.00 0.00 C ATOM 779 SG CYS A 49 -44.363 0.741 -21.919 1.00 0.00 S ATOM 0 H CYS A 49 -41.139 -0.127 -19.358 1.00 0.00 H new ATOM 0 HA CYS A 49 -43.854 0.683 -19.250 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -42.082 0.857 -21.134 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -42.534 -0.788 -21.534 1.00 0.00 H new ATOM 0 HG CYS A 49 -44.076 0.968 -23.166 1.00 0.00 H new ATOM 785 N GLU A 50 -43.409 -2.582 -19.276 1.00 0.00 N ATOM 786 CA GLU A 50 -44.063 -3.869 -18.990 1.00 0.00 C ATOM 787 C GLU A 50 -44.427 -4.029 -17.505 1.00 0.00 C ATOM 788 O GLU A 50 -45.419 -4.679 -17.175 1.00 0.00 O ATOM 789 CB GLU A 50 -43.167 -5.036 -19.434 1.00 0.00 C ATOM 790 CG GLU A 50 -42.863 -4.994 -20.937 1.00 0.00 C ATOM 791 CD GLU A 50 -42.084 -6.242 -21.390 1.00 0.00 C ATOM 792 OE1 GLU A 50 -40.833 -6.261 -21.311 1.00 0.00 O ATOM 793 OE2 GLU A 50 -42.709 -7.224 -21.859 1.00 0.00 O ATOM 0 H GLU A 50 -42.401 -2.663 -19.411 1.00 0.00 H new ATOM 0 HA GLU A 50 -44.993 -3.882 -19.558 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -42.232 -5.007 -18.875 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -43.655 -5.980 -19.190 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -43.796 -4.923 -21.496 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -42.285 -4.099 -21.167 1.00 0.00 H new ATOM 800 N LEU A 51 -43.663 -3.410 -16.604 1.00 0.00 N ATOM 801 CA LEU A 51 -43.905 -3.406 -15.163 1.00 0.00 C ATOM 802 C LEU A 51 -45.214 -2.695 -14.810 1.00 0.00 C ATOM 803 O LEU A 51 -46.092 -3.284 -14.180 1.00 0.00 O ATOM 804 CB LEU A 51 -42.722 -2.696 -14.490 1.00 0.00 C ATOM 805 CG LEU A 51 -42.808 -2.582 -12.961 1.00 0.00 C ATOM 806 CD1 LEU A 51 -42.798 -3.937 -12.256 1.00 0.00 C ATOM 807 CD2 LEU A 51 -41.649 -1.744 -12.451 1.00 0.00 C ATOM 0 H LEU A 51 -42.832 -2.881 -16.867 1.00 0.00 H new ATOM 0 HA LEU A 51 -43.995 -4.433 -14.810 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -41.806 -3.228 -14.747 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -42.636 -1.693 -14.908 1.00 0.00 H new ATOM 0 HG LEU A 51 -43.763 -2.109 -12.732 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -42.861 -3.787 -11.178 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -43.651 -4.528 -12.591 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -41.875 -4.465 -12.495 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -41.709 -1.662 -11.366 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -40.708 -2.218 -12.728 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -41.697 -0.749 -12.893 1.00 0.00 H new ATOM 819 N CYS A 52 -45.350 -1.440 -15.243 1.00 0.00 N ATOM 820 CA CYS A 52 -46.461 -0.564 -14.862 1.00 0.00 C ATOM 821 C CYS A 52 -47.560 -0.493 -15.937 1.00 0.00 C ATOM 822 O CYS A 52 -48.698 -0.131 -15.640 1.00 0.00 O ATOM 823 CB CYS A 52 -45.899 0.822 -14.522 1.00 0.00 C ATOM 824 SG CYS A 52 -44.666 0.725 -13.187 1.00 0.00 S ATOM 0 H CYS A 52 -44.684 -0.998 -15.876 1.00 0.00 H new ATOM 0 HA CYS A 52 -46.951 -0.984 -13.983 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -45.443 1.260 -15.410 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -46.712 1.483 -14.222 1.00 0.00 H new ATOM 0 HG CYS A 52 -44.212 1.915 -12.929 1.00 0.00 H new ATOM 830 N GLY A 53 -47.246 -0.846 -17.186 1.00 0.00 N ATOM 831 CA GLY A 53 -48.212 -0.841 -18.297 1.00 0.00 C ATOM 832 C GLY A 53 -48.541 0.545 -18.880 1.00 0.00 C ATOM 833 O GLY A 53 -49.539 0.669 -19.595 1.00 0.00 O ATOM 0 H GLY A 53 -46.310 -1.146 -17.461 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -47.822 -1.470 -19.098 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -49.138 -1.301 -17.953 1.00 0.00 H new ATOM 837 N TYR A 54 -47.748 1.581 -18.572 1.00 0.00 N ATOM 838 CA TYR A 54 -47.939 2.955 -19.064 1.00 0.00 C ATOM 839 C TYR A 54 -47.189 3.197 -20.395 1.00 0.00 C ATOM 840 O TYR A 54 -47.368 2.448 -21.357 1.00 0.00 O ATOM 841 CB TYR A 54 -47.610 3.960 -17.937 1.00 0.00 C ATOM 842 CG TYR A 54 -48.518 3.868 -16.723 1.00 0.00 C ATOM 843 CD1 TYR A 54 -49.891 4.157 -16.850 1.00 0.00 C ATOM 844 CD2 TYR A 54 -47.990 3.516 -15.466 1.00 0.00 C ATOM 845 CE1 TYR A 54 -50.742 4.049 -15.733 1.00 0.00 C ATOM 846 CE2 TYR A 54 -48.840 3.389 -14.348 1.00 0.00 C ATOM 847 CZ TYR A 54 -50.223 3.644 -14.485 1.00 0.00 C ATOM 848 OH TYR A 54 -51.059 3.508 -13.423 1.00 0.00 O ATOM 0 H TYR A 54 -46.937 1.486 -17.960 1.00 0.00 H new ATOM 0 HA TYR A 54 -48.986 3.115 -19.321 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -46.580 3.802 -17.617 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -47.667 4.971 -18.341 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -50.292 4.462 -17.805 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -46.930 3.343 -15.358 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -51.793 4.276 -15.832 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -48.435 3.098 -13.390 1.00 0.00 H new ATOM 0 HH TYR A 54 -50.655 3.925 -12.633 1.00 0.00 H new ATOM 858 N SER A 55 -46.387 4.263 -20.480 1.00 0.00 N ATOM 859 CA SER A 55 -45.652 4.715 -21.670 1.00 0.00 C ATOM 860 C SER A 55 -44.498 5.631 -21.250 1.00 0.00 C ATOM 861 O SER A 55 -44.589 6.313 -20.228 1.00 0.00 O ATOM 862 CB SER A 55 -46.587 5.460 -22.631 1.00 0.00 C ATOM 863 OG SER A 55 -45.866 5.929 -23.760 1.00 0.00 O ATOM 0 H SER A 55 -46.223 4.869 -19.676 1.00 0.00 H new ATOM 0 HA SER A 55 -45.251 3.842 -22.184 1.00 0.00 H new ATOM 0 HB2 SER A 55 -47.390 4.797 -22.954 1.00 0.00 H new ATOM 0 HB3 SER A 55 -47.054 6.299 -22.116 1.00 0.00 H new ATOM 0 HG SER A 55 -46.476 6.401 -24.365 1.00 0.00 H new ATOM 869 N ARG A 56 -43.403 5.657 -22.016 1.00 0.00 N ATOM 870 CA ARG A 56 -42.232 6.528 -21.769 1.00 0.00 C ATOM 871 C ARG A 56 -42.624 7.996 -21.570 1.00 0.00 C ATOM 872 O ARG A 56 -42.129 8.646 -20.654 1.00 0.00 O ATOM 873 CB ARG A 56 -41.235 6.422 -22.937 1.00 0.00 C ATOM 874 CG ARG A 56 -40.604 5.026 -23.083 1.00 0.00 C ATOM 875 CD ARG A 56 -39.362 5.098 -23.990 1.00 0.00 C ATOM 876 NE ARG A 56 -38.392 4.029 -23.690 1.00 0.00 N ATOM 877 CZ ARG A 56 -38.365 2.793 -24.147 1.00 0.00 C ATOM 878 NH1 ARG A 56 -39.282 2.300 -24.928 1.00 0.00 N ATOM 879 NH2 ARG A 56 -37.382 2.024 -23.798 1.00 0.00 N ATOM 0 H ARG A 56 -43.296 5.066 -22.841 1.00 0.00 H new ATOM 0 HA ARG A 56 -41.769 6.179 -20.846 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -41.746 6.679 -23.865 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -40.443 7.157 -22.795 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -40.326 4.640 -22.102 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -41.331 4.332 -23.504 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -39.671 5.024 -25.033 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -38.881 6.068 -23.868 1.00 0.00 H new ATOM 0 HE ARG A 56 -37.643 4.279 -23.044 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -40.072 2.878 -25.216 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -39.211 1.336 -25.252 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -36.651 2.379 -23.182 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -37.340 1.064 -24.139 1.00 0.00 H new ATOM 893 N ALA A 57 -43.578 8.495 -22.354 1.00 0.00 N ATOM 894 CA ALA A 57 -44.088 9.868 -22.266 1.00 0.00 C ATOM 895 C ALA A 57 -44.724 10.204 -20.897 1.00 0.00 C ATOM 896 O ALA A 57 -44.800 11.373 -20.515 1.00 0.00 O ATOM 897 CB ALA A 57 -45.094 10.057 -23.408 1.00 0.00 C ATOM 0 H ALA A 57 -44.030 7.946 -23.085 1.00 0.00 H new ATOM 0 HA ALA A 57 -43.251 10.560 -22.360 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -45.496 11.070 -23.375 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -44.594 9.896 -24.363 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -45.908 9.340 -23.299 1.00 0.00 H new ATOM 903 N GLU A 58 -45.140 9.187 -20.137 1.00 0.00 N ATOM 904 CA GLU A 58 -45.715 9.304 -18.794 1.00 0.00 C ATOM 905 C GLU A 58 -44.634 9.356 -17.698 1.00 0.00 C ATOM 906 O GLU A 58 -44.917 9.825 -16.596 1.00 0.00 O ATOM 907 CB GLU A 58 -46.679 8.129 -18.539 1.00 0.00 C ATOM 908 CG GLU A 58 -47.750 7.926 -19.625 1.00 0.00 C ATOM 909 CD GLU A 58 -48.870 8.980 -19.530 1.00 0.00 C ATOM 910 OE1 GLU A 58 -49.865 8.751 -18.798 1.00 0.00 O ATOM 911 OE2 GLU A 58 -48.773 10.041 -20.193 1.00 0.00 O ATOM 0 H GLU A 58 -45.083 8.219 -20.454 1.00 0.00 H new ATOM 0 HA GLU A 58 -46.261 10.246 -18.748 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -46.096 7.212 -18.447 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -47.177 8.287 -17.582 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -47.284 7.979 -20.609 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -48.180 6.929 -19.529 1.00 0.00 H new ATOM 918 N VAL A 59 -43.408 8.877 -17.977 1.00 0.00 N ATOM 919 CA VAL A 59 -42.245 8.944 -17.061 1.00 0.00 C ATOM 920 C VAL A 59 -41.186 9.986 -17.435 1.00 0.00 C ATOM 921 O VAL A 59 -40.442 10.423 -16.556 1.00 0.00 O ATOM 922 CB VAL A 59 -41.598 7.563 -16.844 1.00 0.00 C ATOM 923 CG1 VAL A 59 -42.517 6.663 -16.016 1.00 0.00 C ATOM 924 CG2 VAL A 59 -41.238 6.852 -18.145 1.00 0.00 C ATOM 0 H VAL A 59 -43.189 8.422 -18.863 1.00 0.00 H new ATOM 0 HA VAL A 59 -42.672 9.286 -16.118 1.00 0.00 H new ATOM 0 HB VAL A 59 -40.668 7.750 -16.308 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -42.043 5.692 -15.873 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -42.699 7.124 -15.045 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -43.464 6.531 -16.539 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -40.787 5.886 -17.919 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -42.140 6.701 -18.739 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -40.530 7.460 -18.708 1.00 0.00 H new ATOM 934 N MET A 60 -41.148 10.445 -18.693 1.00 0.00 N ATOM 935 CA MET A 60 -40.143 11.355 -19.243 1.00 0.00 C ATOM 936 C MET A 60 -39.952 12.575 -18.349 1.00 0.00 C ATOM 937 O MET A 60 -40.793 13.472 -18.299 1.00 0.00 O ATOM 938 CB MET A 60 -40.566 11.811 -20.657 1.00 0.00 C ATOM 939 CG MET A 60 -39.916 11.002 -21.780 1.00 0.00 C ATOM 940 SD MET A 60 -38.123 11.241 -21.934 1.00 0.00 S ATOM 941 CE MET A 60 -37.533 9.624 -21.365 1.00 0.00 C ATOM 0 H MET A 60 -41.850 10.178 -19.383 1.00 0.00 H new ATOM 0 HA MET A 60 -39.196 10.818 -19.296 1.00 0.00 H new ATOM 0 HB2 MET A 60 -41.650 11.734 -20.746 1.00 0.00 H new ATOM 0 HB3 MET A 60 -40.309 12.863 -20.783 1.00 0.00 H new ATOM 0 HG2 MET A 60 -40.116 9.944 -21.612 1.00 0.00 H new ATOM 0 HG3 MET A 60 -40.389 11.270 -22.725 1.00 0.00 H new ATOM 0 HE1 MET A 60 -36.558 9.417 -21.805 1.00 0.00 H new ATOM 0 HE2 MET A 60 -37.447 9.630 -20.278 1.00 0.00 H new ATOM 0 HE3 MET A 60 -38.240 8.851 -21.669 1.00 0.00 H new ATOM 951 N GLN A 61 -38.812 12.610 -17.667 1.00 0.00 N ATOM 952 CA GLN A 61 -38.321 13.750 -16.900 1.00 0.00 C ATOM 953 C GLN A 61 -39.136 14.028 -15.616 1.00 0.00 C ATOM 954 O GLN A 61 -39.036 15.116 -15.042 1.00 0.00 O ATOM 955 CB GLN A 61 -38.100 14.956 -17.845 1.00 0.00 C ATOM 956 CG GLN A 61 -37.307 14.600 -19.131 1.00 0.00 C ATOM 957 CD GLN A 61 -37.784 15.374 -20.360 1.00 0.00 C ATOM 958 OE1 GLN A 61 -37.948 16.589 -20.355 1.00 0.00 O ATOM 959 NE2 GLN A 61 -38.042 14.691 -21.460 1.00 0.00 N ATOM 0 H GLN A 61 -38.178 11.812 -17.632 1.00 0.00 H new ATOM 0 HA GLN A 61 -37.342 13.509 -16.485 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -39.069 15.368 -18.128 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -37.567 15.738 -17.304 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -36.249 14.805 -18.967 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -37.398 13.531 -19.324 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -37.909 13.680 -21.475 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -38.374 15.175 -22.294 1.00 0.00 H new ATOM 968 N ARG A 62 -39.918 13.044 -15.131 1.00 0.00 N ATOM 969 CA ARG A 62 -40.534 13.068 -13.790 1.00 0.00 C ATOM 970 C ARG A 62 -39.525 12.614 -12.725 1.00 0.00 C ATOM 971 O ARG A 62 -38.557 11.944 -13.085 1.00 0.00 O ATOM 972 CB ARG A 62 -41.764 12.137 -13.742 1.00 0.00 C ATOM 973 CG ARG A 62 -43.085 12.786 -14.177 1.00 0.00 C ATOM 974 CD ARG A 62 -43.500 12.485 -15.621 1.00 0.00 C ATOM 975 NE ARG A 62 -42.975 13.476 -16.570 1.00 0.00 N ATOM 976 CZ ARG A 62 -43.473 14.659 -16.879 1.00 0.00 C ATOM 977 NH1 ARG A 62 -44.552 15.139 -16.325 1.00 0.00 N ATOM 978 NH2 ARG A 62 -42.865 15.381 -17.770 1.00 0.00 N ATOM 0 H ARG A 62 -40.142 12.203 -15.663 1.00 0.00 H new ATOM 0 HA ARG A 62 -40.845 14.092 -13.584 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -41.573 11.274 -14.380 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -41.878 11.762 -12.725 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -43.877 12.450 -13.508 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -43.001 13.866 -14.055 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -43.143 11.494 -15.900 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -44.588 12.463 -15.687 1.00 0.00 H new ATOM 0 HE ARG A 62 -42.115 13.217 -17.052 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -45.049 14.594 -15.620 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -44.899 16.059 -16.597 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -42.018 15.032 -18.218 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -43.234 16.298 -18.022 1.00 0.00 H new ATOM 992 N PRO A 63 -39.734 12.908 -11.427 1.00 0.00 N ATOM 993 CA PRO A 63 -38.917 12.359 -10.344 1.00 0.00 C ATOM 994 C PRO A 63 -38.881 10.822 -10.333 1.00 0.00 C ATOM 995 O PRO A 63 -39.906 10.159 -10.509 1.00 0.00 O ATOM 996 CB PRO A 63 -39.519 12.898 -9.040 1.00 0.00 C ATOM 997 CG PRO A 63 -40.270 14.154 -9.477 1.00 0.00 C ATOM 998 CD PRO A 63 -40.752 13.797 -10.881 1.00 0.00 C ATOM 0 HA PRO A 63 -37.879 12.665 -10.475 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -40.188 12.172 -8.578 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -38.745 13.129 -8.308 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -41.102 14.379 -8.810 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -39.621 15.030 -9.484 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -41.725 13.307 -10.849 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -40.865 14.690 -11.496 1.00 0.00 H new ATOM 1006 N CYS A 64 -37.707 10.255 -10.053 1.00 0.00 N ATOM 1007 CA CYS A 64 -37.499 8.823 -9.799 1.00 0.00 C ATOM 1008 C CYS A 64 -38.154 8.336 -8.480 1.00 0.00 C ATOM 1009 O CYS A 64 -38.234 7.136 -8.219 1.00 0.00 O ATOM 1010 CB CYS A 64 -35.980 8.604 -9.829 1.00 0.00 C ATOM 1011 SG CYS A 64 -35.552 6.844 -9.791 1.00 0.00 S ATOM 0 H CYS A 64 -36.844 10.795 -9.994 1.00 0.00 H new ATOM 0 HA CYS A 64 -37.993 8.222 -10.562 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -35.565 9.059 -10.728 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -35.523 9.107 -8.977 1.00 0.00 H new ATOM 0 HG CYS A 64 -36.460 6.191 -9.129 1.00 0.00 H new ATOM 1017 N THR A 65 -38.632 9.264 -7.645 1.00 0.00 N ATOM 1018 CA THR A 65 -39.296 9.061 -6.357 1.00 0.00 C ATOM 1019 C THR A 65 -40.581 8.259 -6.529 1.00 0.00 C ATOM 1020 O THR A 65 -41.617 8.792 -6.931 1.00 0.00 O ATOM 1021 CB THR A 65 -39.596 10.405 -5.660 1.00 0.00 C ATOM 1022 OG1 THR A 65 -38.561 11.342 -5.874 1.00 0.00 O ATOM 1023 CG2 THR A 65 -39.737 10.213 -4.152 1.00 0.00 C ATOM 0 H THR A 65 -38.558 10.256 -7.872 1.00 0.00 H new ATOM 0 HA THR A 65 -38.613 8.495 -5.723 1.00 0.00 H new ATOM 0 HB THR A 65 -40.527 10.776 -6.089 1.00 0.00 H new ATOM 0 HG1 THR A 65 -38.782 12.183 -5.421 1.00 0.00 H new ATOM 0 HG21 THR A 65 -39.948 11.173 -3.681 1.00 0.00 H new ATOM 0 HG22 THR A 65 -40.554 9.521 -3.948 1.00 0.00 H new ATOM 0 HG23 THR A 65 -38.809 9.807 -3.749 1.00 0.00 H new ATOM 1031 N CYS A 66 -40.497 6.964 -6.231 1.00 0.00 N ATOM 1032 CA CYS A 66 -41.577 5.964 -6.351 1.00 0.00 C ATOM 1033 C CYS A 66 -42.929 6.350 -5.709 1.00 0.00 C ATOM 1034 O CYS A 66 -43.939 5.711 -5.993 1.00 0.00 O ATOM 1035 CB CYS A 66 -41.110 4.612 -5.787 1.00 0.00 C ATOM 1036 SG CYS A 66 -39.510 4.110 -6.486 1.00 0.00 S ATOM 0 H CYS A 66 -39.632 6.554 -5.880 1.00 0.00 H new ATOM 0 HA CYS A 66 -41.776 5.905 -7.421 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -41.028 4.679 -4.702 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -41.858 3.849 -6.004 1.00 0.00 H new ATOM 0 HG CYS A 66 -39.695 3.586 -7.661 1.00 0.00 H new ATOM 1042 N ASP A 67 -42.978 7.396 -4.879 1.00 0.00 N ATOM 1043 CA ASP A 67 -44.214 8.038 -4.409 1.00 0.00 C ATOM 1044 C ASP A 67 -45.137 8.436 -5.585 1.00 0.00 C ATOM 1045 O ASP A 67 -46.349 8.233 -5.524 1.00 0.00 O ATOM 1046 CB ASP A 67 -43.821 9.285 -3.602 1.00 0.00 C ATOM 1047 CG ASP A 67 -45.045 9.996 -3.001 1.00 0.00 C ATOM 1048 OD1 ASP A 67 -45.570 9.522 -1.965 1.00 0.00 O ATOM 1049 OD2 ASP A 67 -45.460 11.048 -3.544 1.00 0.00 O ATOM 0 H ASP A 67 -42.137 7.834 -4.504 1.00 0.00 H new ATOM 0 HA ASP A 67 -44.771 7.334 -3.791 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -43.140 8.998 -2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -43.281 9.978 -4.247 1.00 0.00 H new ATOM 1054 N PHE A 68 -44.559 8.887 -6.708 1.00 0.00 N ATOM 1055 CA PHE A 68 -45.256 9.150 -7.982 1.00 0.00 C ATOM 1056 C PHE A 68 -46.032 7.924 -8.521 1.00 0.00 C ATOM 1057 O PHE A 68 -46.981 8.068 -9.295 1.00 0.00 O ATOM 1058 CB PHE A 68 -44.195 9.614 -8.997 1.00 0.00 C ATOM 1059 CG PHE A 68 -44.702 9.873 -10.406 1.00 0.00 C ATOM 1060 CD1 PHE A 68 -45.548 10.968 -10.666 1.00 0.00 C ATOM 1061 CD2 PHE A 68 -44.332 9.014 -11.461 1.00 0.00 C ATOM 1062 CE1 PHE A 68 -46.034 11.194 -11.966 1.00 0.00 C ATOM 1063 CE2 PHE A 68 -44.814 9.243 -12.763 1.00 0.00 C ATOM 1064 CZ PHE A 68 -45.670 10.329 -13.015 1.00 0.00 C ATOM 0 H PHE A 68 -43.560 9.086 -6.759 1.00 0.00 H new ATOM 0 HA PHE A 68 -46.013 9.917 -7.817 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -43.735 10.528 -8.622 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -43.410 8.859 -9.046 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -45.825 11.637 -9.864 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -43.676 8.177 -11.269 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -46.687 12.032 -12.160 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -44.526 8.584 -13.569 1.00 0.00 H new ATOM 0 HZ PHE A 68 -46.048 10.500 -14.012 1.00 0.00 H new ATOM 1074 N LEU A 69 -45.648 6.722 -8.082 1.00 0.00 N ATOM 1075 CA LEU A 69 -46.196 5.419 -8.455 1.00 0.00 C ATOM 1076 C LEU A 69 -46.852 4.701 -7.245 1.00 0.00 C ATOM 1077 O LEU A 69 -47.021 3.480 -7.274 1.00 0.00 O ATOM 1078 CB LEU A 69 -45.056 4.612 -9.133 1.00 0.00 C ATOM 1079 CG LEU A 69 -45.402 3.785 -10.390 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -46.420 2.679 -10.134 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -45.900 4.655 -11.547 1.00 0.00 C ATOM 0 H LEU A 69 -44.889 6.630 -7.406 1.00 0.00 H new ATOM 0 HA LEU A 69 -47.014 5.527 -9.167 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -44.265 5.312 -9.401 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -44.641 3.932 -8.390 1.00 0.00 H new ATOM 0 HG LEU A 69 -44.457 3.319 -10.668 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -46.614 2.141 -11.062 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -46.026 1.988 -9.389 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -47.349 3.117 -9.768 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -46.129 4.023 -12.405 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -46.799 5.189 -11.240 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -45.127 5.373 -11.821 1.00 0.00 H new ATOM 1093 N HIS A 70 -47.228 5.414 -6.166 1.00 0.00 N ATOM 1094 CA HIS A 70 -47.886 4.773 -5.015 1.00 0.00 C ATOM 1095 C HIS A 70 -49.338 4.378 -5.348 1.00 0.00 C ATOM 1096 O HIS A 70 -50.057 5.116 -6.027 1.00 0.00 O ATOM 1097 CB HIS A 70 -47.811 5.632 -3.738 1.00 0.00 C ATOM 1098 CG HIS A 70 -48.954 6.603 -3.518 1.00 0.00 C ATOM 1099 ND1 HIS A 70 -49.064 7.903 -4.022 1.00 0.00 N ATOM 1100 CD2 HIS A 70 -50.065 6.331 -2.769 1.00 0.00 C ATOM 1101 CE1 HIS A 70 -50.237 8.380 -3.570 1.00 0.00 C ATOM 1102 NE2 HIS A 70 -50.859 7.457 -2.816 1.00 0.00 N ATOM 0 H HIS A 70 -47.089 6.420 -6.069 1.00 0.00 H new ATOM 0 HA HIS A 70 -47.331 3.858 -4.805 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -47.758 4.964 -2.878 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -46.880 6.198 -3.760 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -48.391 8.391 -4.613 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -50.279 5.412 -2.243 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -50.625 9.365 -3.783 1.00 0.00 H new ATOM 1110 N GLY A 71 -49.778 3.227 -4.841 1.00 0.00 N ATOM 1111 CA GLY A 71 -51.130 2.682 -5.004 1.00 0.00 C ATOM 1112 C GLY A 71 -51.717 2.123 -3.698 1.00 0.00 C ATOM 1113 O GLY A 71 -51.124 2.305 -2.628 1.00 0.00 O ATOM 0 H GLY A 71 -49.178 2.621 -4.281 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -51.787 3.464 -5.385 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -51.108 1.891 -5.753 1.00 0.00 H new ATOM 1117 N PRO A 72 -52.864 1.415 -3.755 1.00 0.00 N ATOM 1118 CA PRO A 72 -53.623 1.009 -2.561 1.00 0.00 C ATOM 1119 C PRO A 72 -52.919 0.023 -1.608 1.00 0.00 C ATOM 1120 O PRO A 72 -53.398 -0.190 -0.491 1.00 0.00 O ATOM 1121 CB PRO A 72 -54.920 0.393 -3.103 1.00 0.00 C ATOM 1122 CG PRO A 72 -55.102 1.062 -4.462 1.00 0.00 C ATOM 1123 CD PRO A 72 -53.665 1.193 -4.954 1.00 0.00 C ATOM 0 HA PRO A 72 -53.769 1.888 -1.934 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -54.839 -0.690 -3.198 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -55.764 0.593 -2.443 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -55.709 0.457 -5.135 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -55.592 2.032 -4.376 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -53.346 0.293 -5.479 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -53.563 2.023 -5.654 1.00 0.00 H new ATOM 1131 N ARG A 73 -51.778 -0.554 -2.016 1.00 0.00 N ATOM 1132 CA ARG A 73 -50.917 -1.438 -1.204 1.00 0.00 C ATOM 1133 C ARG A 73 -49.567 -0.820 -0.807 1.00 0.00 C ATOM 1134 O ARG A 73 -48.797 -1.470 -0.098 1.00 0.00 O ATOM 1135 CB ARG A 73 -50.767 -2.798 -1.918 1.00 0.00 C ATOM 1136 CG ARG A 73 -52.075 -3.605 -1.841 1.00 0.00 C ATOM 1137 CD ARG A 73 -51.961 -4.944 -2.577 1.00 0.00 C ATOM 1138 NE ARG A 73 -53.183 -5.753 -2.389 1.00 0.00 N ATOM 1139 CZ ARG A 73 -53.763 -6.565 -3.257 1.00 0.00 C ATOM 1140 NH1 ARG A 73 -53.319 -6.750 -4.468 1.00 0.00 N ATOM 1141 NH2 ARG A 73 -54.829 -7.228 -2.912 1.00 0.00 N ATOM 0 H ARG A 73 -51.412 -0.414 -2.958 1.00 0.00 H new ATOM 0 HA ARG A 73 -51.416 -1.590 -0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -50.495 -2.638 -2.961 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -49.957 -3.366 -1.461 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -52.330 -3.785 -0.797 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -52.888 -3.021 -2.272 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -51.797 -4.767 -3.640 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -51.095 -5.494 -2.208 1.00 0.00 H new ATOM 0 HE ARG A 73 -53.635 -5.676 -1.478 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -52.485 -6.256 -4.786 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -53.805 -7.389 -5.097 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -55.215 -7.121 -1.974 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -55.278 -7.855 -3.580 1.00 0.00 H new ATOM 1155 N THR A 74 -49.248 0.407 -1.235 1.00 0.00 N ATOM 1156 CA THR A 74 -47.934 1.024 -0.970 1.00 0.00 C ATOM 1157 C THR A 74 -47.828 1.574 0.451 1.00 0.00 C ATOM 1158 O THR A 74 -48.738 2.236 0.955 1.00 0.00 O ATOM 1159 CB THR A 74 -47.573 2.127 -1.977 1.00 0.00 C ATOM 1160 OG1 THR A 74 -47.870 1.739 -3.297 1.00 0.00 O ATOM 1161 CG2 THR A 74 -46.080 2.463 -1.959 1.00 0.00 C ATOM 0 H THR A 74 -49.883 0.999 -1.770 1.00 0.00 H new ATOM 0 HA THR A 74 -47.214 0.214 -1.087 1.00 0.00 H new ATOM 0 HB THR A 74 -48.164 2.991 -1.675 1.00 0.00 H new ATOM 0 HG1 THR A 74 -47.060 1.393 -3.727 1.00 0.00 H new ATOM 0 HG21 THR A 74 -45.875 3.248 -2.687 1.00 0.00 H new ATOM 0 HG22 THR A 74 -45.797 2.808 -0.965 1.00 0.00 H new ATOM 0 HG23 THR A 74 -45.504 1.573 -2.212 1.00 0.00 H new ATOM 1169 N GLN A 75 -46.673 1.341 1.075 1.00 0.00 N ATOM 1170 CA GLN A 75 -46.315 1.910 2.372 1.00 0.00 C ATOM 1171 C GLN A 75 -45.766 3.333 2.204 1.00 0.00 C ATOM 1172 O GLN A 75 -44.849 3.606 1.420 1.00 0.00 O ATOM 1173 CB GLN A 75 -45.285 1.020 3.071 1.00 0.00 C ATOM 1174 CG GLN A 75 -45.809 -0.349 3.528 1.00 0.00 C ATOM 1175 CD GLN A 75 -44.657 -1.315 3.804 1.00 0.00 C ATOM 1176 OE1 GLN A 75 -44.079 -1.330 4.884 1.00 0.00 O ATOM 1177 NE2 GLN A 75 -44.261 -2.120 2.843 1.00 0.00 N ATOM 0 H GLN A 75 -45.947 0.740 0.685 1.00 0.00 H new ATOM 0 HA GLN A 75 -47.212 1.960 2.989 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -44.445 0.863 2.394 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -44.898 1.552 3.940 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -46.411 -0.229 4.429 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -46.462 -0.766 2.761 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -44.739 -2.112 1.942 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -43.476 -2.753 2.999 1.00 0.00 H new ATOM 1186 N ARG A 76 -46.281 4.245 3.023 1.00 0.00 N ATOM 1187 CA ARG A 76 -45.860 5.657 3.036 1.00 0.00 C ATOM 1188 C ARG A 76 -44.449 5.806 3.593 1.00 0.00 C ATOM 1189 O ARG A 76 -43.644 6.528 3.017 1.00 0.00 O ATOM 1190 CB ARG A 76 -46.882 6.535 3.771 1.00 0.00 C ATOM 1191 CG ARG A 76 -48.344 6.347 3.319 1.00 0.00 C ATOM 1192 CD ARG A 76 -48.533 6.483 1.799 1.00 0.00 C ATOM 1193 NE ARG A 76 -49.943 6.285 1.409 1.00 0.00 N ATOM 1194 CZ ARG A 76 -50.882 7.208 1.283 1.00 0.00 C ATOM 1195 NH1 ARG A 76 -50.652 8.473 1.503 1.00 0.00 N ATOM 1196 NH2 ARG A 76 -52.090 6.872 0.934 1.00 0.00 N ATOM 0 H ARG A 76 -47.009 4.031 3.705 1.00 0.00 H new ATOM 0 HA ARG A 76 -45.828 6.013 2.006 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -46.817 6.326 4.839 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -46.606 7.581 3.634 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -48.691 5.363 3.635 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -48.970 7.083 3.823 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -48.201 7.470 1.477 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -47.907 5.753 1.287 1.00 0.00 H new ATOM 0 HE ARG A 76 -50.226 5.325 1.214 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -49.721 8.781 1.783 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -51.403 9.154 1.395 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -52.316 5.893 0.756 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -52.811 7.587 0.838 1.00 0.00 H new ATOM 1210 N ARG A 77 -44.111 5.044 4.642 1.00 0.00 N ATOM 1211 CA ARG A 77 -42.738 4.900 5.169 1.00 0.00 C ATOM 1212 C ARG A 77 -41.730 4.408 4.127 1.00 0.00 C ATOM 1213 O ARG A 77 -40.581 4.845 4.130 1.00 0.00 O ATOM 1214 CB ARG A 77 -42.743 3.988 6.408 1.00 0.00 C ATOM 1215 CG ARG A 77 -43.197 2.535 6.169 1.00 0.00 C ATOM 1216 CD ARG A 77 -43.241 1.727 7.469 1.00 0.00 C ATOM 1217 NE ARG A 77 -43.488 0.298 7.203 1.00 0.00 N ATOM 1218 CZ ARG A 77 -43.557 -0.682 8.085 1.00 0.00 C ATOM 1219 NH1 ARG A 77 -43.419 -0.487 9.366 1.00 0.00 N ATOM 1220 NH2 ARG A 77 -43.773 -1.893 7.666 1.00 0.00 N ATOM 0 H ARG A 77 -44.796 4.497 5.163 1.00 0.00 H new ATOM 0 HA ARG A 77 -42.403 5.898 5.452 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -41.737 3.970 6.827 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -43.394 4.433 7.161 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -44.185 2.535 5.708 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -42.517 2.054 5.466 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -42.298 1.842 8.003 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -44.025 2.119 8.117 1.00 0.00 H new ATOM 0 HE ARG A 77 -43.621 0.037 6.226 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -43.250 0.453 9.723 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -43.480 -1.275 10.011 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -43.886 -2.075 6.669 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -43.829 -2.661 8.334 1.00 0.00 H new ATOM 1234 N ALA A 78 -42.157 3.527 3.227 1.00 0.00 N ATOM 1235 CA ALA A 78 -41.340 3.047 2.110 1.00 0.00 C ATOM 1236 C ALA A 78 -41.090 4.171 1.090 1.00 0.00 C ATOM 1237 O ALA A 78 -39.941 4.485 0.753 1.00 0.00 O ATOM 1238 CB ALA A 78 -42.026 1.832 1.469 1.00 0.00 C ATOM 0 H ALA A 78 -43.092 3.119 3.251 1.00 0.00 H new ATOM 0 HA ALA A 78 -40.362 2.737 2.479 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -41.422 1.470 0.637 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -42.132 1.041 2.211 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -43.011 2.121 1.104 1.00 0.00 H new ATOM 1244 N ALA A 79 -42.170 4.846 0.673 1.00 0.00 N ATOM 1245 CA ALA A 79 -42.067 5.958 -0.277 1.00 0.00 C ATOM 1246 C ALA A 79 -41.254 7.138 0.295 1.00 0.00 C ATOM 1247 O ALA A 79 -40.481 7.777 -0.422 1.00 0.00 O ATOM 1248 CB ALA A 79 -43.485 6.383 -0.667 1.00 0.00 C ATOM 0 H ALA A 79 -43.121 4.641 0.978 1.00 0.00 H new ATOM 0 HA ALA A 79 -41.523 5.629 -1.162 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -43.435 7.211 -1.375 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -44.003 5.542 -1.128 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -44.028 6.699 0.224 1.00 0.00 H new ATOM 1254 N ALA A 80 -41.371 7.377 1.604 1.00 0.00 N ATOM 1255 CA ALA A 80 -40.635 8.400 2.331 1.00 0.00 C ATOM 1256 C ALA A 80 -39.138 8.078 2.419 1.00 0.00 C ATOM 1257 O ALA A 80 -38.331 8.915 2.021 1.00 0.00 O ATOM 1258 CB ALA A 80 -41.262 8.559 3.717 1.00 0.00 C ATOM 0 H ALA A 80 -42.003 6.843 2.201 1.00 0.00 H new ATOM 0 HA ALA A 80 -40.705 9.344 1.790 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -40.721 9.323 4.275 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -42.305 8.856 3.612 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -41.207 7.611 4.252 1.00 0.00 H new ATOM 1264 N GLN A 81 -38.748 6.885 2.892 1.00 0.00 N ATOM 1265 CA GLN A 81 -37.355 6.399 2.853 1.00 0.00 C ATOM 1266 C GLN A 81 -36.720 6.529 1.461 1.00 0.00 C ATOM 1267 O GLN A 81 -35.575 6.973 1.340 1.00 0.00 O ATOM 1268 CB GLN A 81 -37.287 4.948 3.350 1.00 0.00 C ATOM 1269 CG GLN A 81 -37.380 4.869 4.880 1.00 0.00 C ATOM 1270 CD GLN A 81 -37.529 3.428 5.357 1.00 0.00 C ATOM 1271 OE1 GLN A 81 -36.590 2.779 5.801 1.00 0.00 O ATOM 1272 NE2 GLN A 81 -38.719 2.874 5.270 1.00 0.00 N ATOM 0 H GLN A 81 -39.395 6.221 3.317 1.00 0.00 H new ATOM 0 HA GLN A 81 -36.773 7.035 3.520 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -38.099 4.372 2.906 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -36.354 4.492 3.018 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -36.487 5.310 5.323 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -38.230 5.457 5.225 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -39.505 3.409 4.901 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -38.856 1.909 5.571 1.00 0.00 H new ATOM 1281 N ILE A 82 -37.473 6.226 0.397 1.00 0.00 N ATOM 1282 CA ILE A 82 -36.985 6.431 -0.971 1.00 0.00 C ATOM 1283 C ILE A 82 -36.743 7.910 -1.251 1.00 0.00 C ATOM 1284 O ILE A 82 -35.647 8.266 -1.673 1.00 0.00 O ATOM 1285 CB ILE A 82 -37.934 5.775 -1.980 1.00 0.00 C ATOM 1286 CG1 ILE A 82 -37.643 4.264 -1.944 1.00 0.00 C ATOM 1287 CG2 ILE A 82 -37.747 6.365 -3.388 1.00 0.00 C ATOM 1288 CD1 ILE A 82 -38.787 3.449 -2.522 1.00 0.00 C ATOM 0 H ILE A 82 -38.416 5.841 0.456 1.00 0.00 H new ATOM 0 HA ILE A 82 -36.018 5.940 -1.082 1.00 0.00 H new ATOM 0 HB ILE A 82 -38.975 5.965 -1.718 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -36.731 4.057 -2.505 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -37.461 3.954 -0.915 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -38.434 5.879 -4.080 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -37.952 7.435 -3.364 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -36.722 6.200 -3.719 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -38.538 2.389 -2.476 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -39.693 3.634 -1.945 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -38.952 3.738 -3.560 1.00 0.00 H new ATOM 1300 N ALA A 83 -37.708 8.782 -0.953 1.00 0.00 N ATOM 1301 CA ALA A 83 -37.518 10.228 -1.062 1.00 0.00 C ATOM 1302 C ALA A 83 -36.258 10.700 -0.318 1.00 0.00 C ATOM 1303 O ALA A 83 -35.504 11.503 -0.864 1.00 0.00 O ATOM 1304 CB ALA A 83 -38.770 10.943 -0.552 1.00 0.00 C ATOM 0 H ALA A 83 -38.636 8.508 -0.632 1.00 0.00 H new ATOM 0 HA ALA A 83 -37.366 10.480 -2.112 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -38.631 12.021 -0.632 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -39.630 10.642 -1.151 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -38.942 10.676 0.491 1.00 0.00 H new ATOM 1310 N GLN A 84 -35.980 10.139 0.869 1.00 0.00 N ATOM 1311 CA GLN A 84 -34.759 10.434 1.634 1.00 0.00 C ATOM 1312 C GLN A 84 -33.496 9.992 0.878 1.00 0.00 C ATOM 1313 O GLN A 84 -32.498 10.724 0.833 1.00 0.00 O ATOM 1314 CB GLN A 84 -34.771 9.831 3.053 1.00 0.00 C ATOM 1315 CG GLN A 84 -35.999 10.075 3.940 1.00 0.00 C ATOM 1316 CD GLN A 84 -36.606 11.470 3.817 1.00 0.00 C ATOM 1317 OE1 GLN A 84 -36.091 12.454 4.330 1.00 0.00 O ATOM 1318 NE2 GLN A 84 -37.722 11.603 3.131 1.00 0.00 N ATOM 0 H GLN A 84 -36.597 9.467 1.326 1.00 0.00 H new ATOM 0 HA GLN A 84 -34.739 11.518 1.747 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -34.640 8.753 2.957 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -33.898 10.212 3.583 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -36.762 9.338 3.691 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -35.719 9.906 4.980 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -38.157 10.787 2.701 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -38.152 12.522 3.030 1.00 0.00 H new ATOM 1327 N ALA A 85 -33.548 8.831 0.217 1.00 0.00 N ATOM 1328 CA ALA A 85 -32.433 8.337 -0.581 1.00 0.00 C ATOM 1329 C ALA A 85 -32.193 9.170 -1.847 1.00 0.00 C ATOM 1330 O ALA A 85 -31.050 9.285 -2.293 1.00 0.00 O ATOM 1331 CB ALA A 85 -32.657 6.851 -0.892 1.00 0.00 C ATOM 0 H ALA A 85 -34.361 8.215 0.223 1.00 0.00 H new ATOM 0 HA ALA A 85 -31.518 8.442 0.001 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -31.826 6.475 -1.489 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -32.717 6.289 0.040 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -33.587 6.732 -1.448 1.00 0.00 H new ATOM 1337 N LEU A 86 -33.245 9.789 -2.393 1.00 0.00 N ATOM 1338 CA LEU A 86 -33.142 10.583 -3.615 1.00 0.00 C ATOM 1339 C LEU A 86 -32.680 12.019 -3.329 1.00 0.00 C ATOM 1340 O LEU A 86 -31.811 12.529 -4.039 1.00 0.00 O ATOM 1341 CB LEU A 86 -34.448 10.532 -4.419 1.00 0.00 C ATOM 1342 CG LEU A 86 -35.027 9.136 -4.735 1.00 0.00 C ATOM 1343 CD1 LEU A 86 -35.733 9.195 -6.085 1.00 0.00 C ATOM 1344 CD2 LEU A 86 -34.026 7.981 -4.863 1.00 0.00 C ATOM 0 H LEU A 86 -34.186 9.752 -2.000 1.00 0.00 H new ATOM 0 HA LEU A 86 -32.367 10.135 -4.238 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -35.204 11.095 -3.872 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -34.284 11.052 -5.363 1.00 0.00 H new ATOM 0 HG LEU A 86 -35.662 8.922 -3.875 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -36.147 8.215 -6.322 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -36.538 9.929 -6.043 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -35.019 9.483 -6.857 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -34.562 7.058 -5.086 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -33.323 8.196 -5.668 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -33.480 7.867 -3.926 1.00 0.00 H new ATOM 1356 N LEU A 87 -33.171 12.646 -2.247 1.00 0.00 N ATOM 1357 CA LEU A 87 -32.610 13.926 -1.774 1.00 0.00 C ATOM 1358 C LEU A 87 -31.171 13.776 -1.267 1.00 0.00 C ATOM 1359 O LEU A 87 -30.390 14.726 -1.362 1.00 0.00 O ATOM 1360 CB LEU A 87 -33.500 14.640 -0.739 1.00 0.00 C ATOM 1361 CG LEU A 87 -33.893 13.875 0.535 1.00 0.00 C ATOM 1362 CD1 LEU A 87 -33.044 14.252 1.745 1.00 0.00 C ATOM 1363 CD2 LEU A 87 -35.343 14.200 0.916 1.00 0.00 C ATOM 0 H LEU A 87 -33.947 12.293 -1.687 1.00 0.00 H new ATOM 0 HA LEU A 87 -32.585 14.572 -2.652 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -32.989 15.553 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -34.419 14.942 -1.242 1.00 0.00 H new ATOM 0 HG LEU A 87 -33.746 12.821 0.301 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -33.371 13.678 2.612 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -31.997 14.032 1.538 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -33.157 15.316 1.951 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -35.613 13.654 1.820 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -35.441 15.271 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -36.007 13.907 0.103 1.00 0.00 H new ATOM 1375 N GLY A 88 -30.808 12.595 -0.757 1.00 0.00 N ATOM 1376 CA GLY A 88 -29.417 12.253 -0.456 1.00 0.00 C ATOM 1377 C GLY A 88 -29.110 12.163 1.035 1.00 0.00 C ATOM 1378 O GLY A 88 -27.938 12.237 1.410 1.00 0.00 O ATOM 0 H GLY A 88 -31.471 11.850 -0.542 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -29.179 11.298 -0.924 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -28.764 13.000 -0.907 1.00 0.00 H new ATOM 1382 N ALA A 89 -30.133 12.010 1.888 1.00 0.00 N ATOM 1383 CA ALA A 89 -29.931 11.698 3.307 1.00 0.00 C ATOM 1384 C ALA A 89 -29.033 10.449 3.459 1.00 0.00 C ATOM 1385 O ALA A 89 -28.032 10.472 4.178 1.00 0.00 O ATOM 1386 CB ALA A 89 -31.287 11.493 3.986 1.00 0.00 C ATOM 0 H ALA A 89 -31.112 12.098 1.616 1.00 0.00 H new ATOM 0 HA ALA A 89 -29.425 12.532 3.793 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -31.135 11.261 5.040 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -31.880 12.403 3.897 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -31.813 10.668 3.506 1.00 0.00 H new ATOM 1392 N GLU A 90 -29.380 9.374 2.738 1.00 0.00 N ATOM 1393 CA GLU A 90 -28.558 8.177 2.527 1.00 0.00 C ATOM 1394 C GLU A 90 -29.061 7.346 1.333 1.00 0.00 C ATOM 1395 O GLU A 90 -30.233 6.991 1.247 1.00 0.00 O ATOM 1396 CB GLU A 90 -28.483 7.292 3.783 1.00 0.00 C ATOM 1397 CG GLU A 90 -29.834 6.955 4.436 1.00 0.00 C ATOM 1398 CD GLU A 90 -29.625 6.152 5.735 1.00 0.00 C ATOM 1399 OE1 GLU A 90 -29.472 4.907 5.669 1.00 0.00 O ATOM 1400 OE2 GLU A 90 -29.617 6.756 6.835 1.00 0.00 O ATOM 0 H GLU A 90 -30.282 9.314 2.265 1.00 0.00 H new ATOM 0 HA GLU A 90 -27.553 8.536 2.306 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -27.983 6.360 3.520 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -27.857 7.792 4.522 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -30.378 7.874 4.654 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -30.446 6.380 3.741 1.00 0.00 H new ATOM 1407 N GLU A 91 -28.157 6.985 0.424 1.00 0.00 N ATOM 1408 CA GLU A 91 -28.403 6.065 -0.698 1.00 0.00 C ATOM 1409 C GLU A 91 -28.619 4.650 -0.135 1.00 0.00 C ATOM 1410 O GLU A 91 -27.734 4.074 0.505 1.00 0.00 O ATOM 1411 CB GLU A 91 -27.202 6.161 -1.651 1.00 0.00 C ATOM 1412 CG GLU A 91 -27.183 5.092 -2.747 1.00 0.00 C ATOM 1413 CD GLU A 91 -26.293 3.867 -2.447 1.00 0.00 C ATOM 1414 OE1 GLU A 91 -25.145 4.026 -1.971 1.00 0.00 O ATOM 1415 OE2 GLU A 91 -26.696 2.735 -2.808 1.00 0.00 O ATOM 0 H GLU A 91 -27.199 7.334 0.444 1.00 0.00 H new ATOM 0 HA GLU A 91 -29.300 6.323 -1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -27.202 7.145 -2.119 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -26.284 6.085 -1.069 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -28.203 4.748 -2.916 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -26.843 5.551 -3.675 1.00 0.00 H new ATOM 1422 N ARG A 92 -29.826 4.118 -0.346 1.00 0.00 N ATOM 1423 CA ARG A 92 -30.325 2.888 0.288 1.00 0.00 C ATOM 1424 C ARG A 92 -31.353 2.171 -0.596 1.00 0.00 C ATOM 1425 O ARG A 92 -32.201 2.817 -1.214 1.00 0.00 O ATOM 1426 CB ARG A 92 -30.924 3.281 1.662 1.00 0.00 C ATOM 1427 CG ARG A 92 -31.608 2.147 2.441 1.00 0.00 C ATOM 1428 CD ARG A 92 -30.654 1.031 2.892 1.00 0.00 C ATOM 1429 NE ARG A 92 -31.390 -0.234 3.078 1.00 0.00 N ATOM 1430 CZ ARG A 92 -31.109 -1.226 3.902 1.00 0.00 C ATOM 1431 NH1 ARG A 92 -30.093 -1.195 4.717 1.00 0.00 N ATOM 1432 NH2 ARG A 92 -31.862 -2.287 3.912 1.00 0.00 N ATOM 0 H ARG A 92 -30.504 4.541 -0.980 1.00 0.00 H new ATOM 0 HA ARG A 92 -29.508 2.180 0.425 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -30.126 3.692 2.281 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -31.650 4.079 1.506 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -32.098 2.568 3.319 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -32.389 1.712 1.818 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -29.867 0.895 2.150 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -30.167 1.316 3.825 1.00 0.00 H new ATOM 0 HE ARG A 92 -32.219 -0.357 2.497 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -29.478 -0.381 4.735 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -29.913 -1.984 5.337 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -32.664 -2.349 3.285 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -31.650 -3.057 4.547 1.00 0.00 H new ATOM 1446 N LYS A 93 -31.314 0.833 -0.588 1.00 0.00 N ATOM 1447 CA LYS A 93 -32.328 -0.055 -1.183 1.00 0.00 C ATOM 1448 C LYS A 93 -33.492 -0.267 -0.213 1.00 0.00 C ATOM 1449 O LYS A 93 -33.280 -0.591 0.958 1.00 0.00 O ATOM 1450 CB LYS A 93 -31.661 -1.365 -1.608 1.00 0.00 C ATOM 1451 CG LYS A 93 -32.583 -2.317 -2.374 1.00 0.00 C ATOM 1452 CD LYS A 93 -32.030 -3.745 -2.367 1.00 0.00 C ATOM 1453 CE LYS A 93 -30.650 -3.833 -3.033 1.00 0.00 C ATOM 1454 NZ LYS A 93 -30.187 -5.239 -3.141 1.00 0.00 N ATOM 0 H LYS A 93 -30.549 0.318 -0.152 1.00 0.00 H new ATOM 0 HA LYS A 93 -32.754 0.405 -2.075 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -30.797 -1.135 -2.231 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -31.287 -1.875 -0.720 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -33.576 -2.306 -1.925 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -32.694 -1.972 -3.402 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -31.959 -4.101 -1.339 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -32.725 -4.405 -2.886 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -30.695 -3.386 -4.026 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -29.929 -3.255 -2.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -29.284 -5.268 -3.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -30.056 -5.635 -2.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -30.896 -5.800 -3.655 1.00 0.00 H new ATOM 1468 N VAL A 94 -34.714 -0.092 -0.705 1.00 0.00 N ATOM 1469 CA VAL A 94 -35.969 -0.184 0.065 1.00 0.00 C ATOM 1470 C VAL A 94 -36.991 -0.990 -0.739 1.00 0.00 C ATOM 1471 O VAL A 94 -36.959 -0.997 -1.970 1.00 0.00 O ATOM 1472 CB VAL A 94 -36.529 1.224 0.408 1.00 0.00 C ATOM 1473 CG1 VAL A 94 -37.516 1.187 1.585 1.00 0.00 C ATOM 1474 CG2 VAL A 94 -35.451 2.251 0.793 1.00 0.00 C ATOM 0 H VAL A 94 -34.874 0.127 -1.688 1.00 0.00 H new ATOM 0 HA VAL A 94 -35.766 -0.689 1.009 1.00 0.00 H new ATOM 0 HB VAL A 94 -37.017 1.529 -0.518 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -37.880 2.195 1.787 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -38.357 0.541 1.334 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -37.012 0.799 2.470 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -35.923 3.207 1.018 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -34.910 1.899 1.671 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -34.755 2.376 -0.036 1.00 0.00 H new ATOM 1484 N GLU A 95 -37.926 -1.636 -0.050 1.00 0.00 N ATOM 1485 CA GLU A 95 -39.089 -2.273 -0.670 1.00 0.00 C ATOM 1486 C GLU A 95 -40.150 -1.210 -0.979 1.00 0.00 C ATOM 1487 O GLU A 95 -40.125 -0.137 -0.386 1.00 0.00 O ATOM 1488 CB GLU A 95 -39.635 -3.353 0.278 1.00 0.00 C ATOM 1489 CG GLU A 95 -40.247 -2.797 1.581 1.00 0.00 C ATOM 1490 CD GLU A 95 -40.803 -3.904 2.497 1.00 0.00 C ATOM 1491 OE1 GLU A 95 -40.036 -4.811 2.904 1.00 0.00 O ATOM 1492 OE2 GLU A 95 -42.006 -3.845 2.850 1.00 0.00 O ATOM 0 H GLU A 95 -37.900 -1.735 0.965 1.00 0.00 H new ATOM 0 HA GLU A 95 -38.806 -2.750 -1.609 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -40.393 -3.933 -0.248 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -38.828 -4.040 0.533 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -39.488 -2.231 2.121 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -41.048 -2.100 1.333 1.00 0.00 H new ATOM 1499 N ILE A 96 -41.073 -1.478 -1.901 1.00 0.00 N ATOM 1500 CA ILE A 96 -42.205 -0.594 -2.228 1.00 0.00 C ATOM 1501 C ILE A 96 -43.230 -1.346 -3.076 1.00 0.00 C ATOM 1502 O ILE A 96 -42.880 -2.249 -3.840 1.00 0.00 O ATOM 1503 CB ILE A 96 -41.833 0.713 -2.999 1.00 0.00 C ATOM 1504 CG1 ILE A 96 -40.486 0.725 -3.754 1.00 0.00 C ATOM 1505 CG2 ILE A 96 -41.922 1.953 -2.101 1.00 0.00 C ATOM 1506 CD1 ILE A 96 -40.369 -0.371 -4.807 1.00 0.00 C ATOM 0 H ILE A 96 -41.060 -2.333 -2.457 1.00 0.00 H new ATOM 0 HA ILE A 96 -42.599 -0.294 -1.257 1.00 0.00 H new ATOM 0 HB ILE A 96 -42.594 0.740 -3.779 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -40.357 1.695 -4.235 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -39.674 0.615 -3.035 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -41.655 2.839 -2.677 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -42.940 2.057 -1.725 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -41.234 1.845 -1.262 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -39.398 -0.302 -5.297 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -40.466 -1.346 -4.330 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -41.159 -0.249 -5.548 1.00 0.00 H new ATOM 1518 N ALA A 97 -44.501 -0.962 -2.943 1.00 0.00 N ATOM 1519 CA ALA A 97 -45.559 -1.487 -3.806 1.00 0.00 C ATOM 1520 C ALA A 97 -45.760 -0.600 -5.044 1.00 0.00 C ATOM 1521 O ALA A 97 -45.672 0.627 -4.950 1.00 0.00 O ATOM 1522 CB ALA A 97 -46.870 -1.689 -3.039 1.00 0.00 C ATOM 0 H ALA A 97 -44.822 -0.290 -2.246 1.00 0.00 H new ATOM 0 HA ALA A 97 -45.238 -2.469 -4.153 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -47.630 -2.080 -3.715 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -46.710 -2.396 -2.225 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -47.203 -0.735 -2.631 1.00 0.00 H new ATOM 1528 N PHE A 98 -46.091 -1.217 -6.177 1.00 0.00 N ATOM 1529 CA PHE A 98 -46.470 -0.536 -7.421 1.00 0.00 C ATOM 1530 C PHE A 98 -47.931 -0.819 -7.787 1.00 0.00 C ATOM 1531 O PHE A 98 -48.518 -1.798 -7.310 1.00 0.00 O ATOM 1532 CB PHE A 98 -45.541 -0.985 -8.561 1.00 0.00 C ATOM 1533 CG PHE A 98 -44.065 -0.692 -8.366 1.00 0.00 C ATOM 1534 CD1 PHE A 98 -43.625 0.624 -8.118 1.00 0.00 C ATOM 1535 CD2 PHE A 98 -43.122 -1.734 -8.475 1.00 0.00 C ATOM 1536 CE1 PHE A 98 -42.252 0.901 -8.000 1.00 0.00 C ATOM 1537 CE2 PHE A 98 -41.751 -1.456 -8.353 1.00 0.00 C ATOM 1538 CZ PHE A 98 -41.316 -0.139 -8.125 1.00 0.00 C ATOM 0 H PHE A 98 -46.104 -2.233 -6.261 1.00 0.00 H new ATOM 0 HA PHE A 98 -46.366 0.538 -7.269 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -45.663 -2.059 -8.702 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -45.869 -0.503 -9.482 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -44.345 1.422 -8.018 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -43.454 -2.746 -8.652 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -41.918 1.911 -7.814 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -41.030 -2.256 -8.434 1.00 0.00 H new ATOM 0 HZ PHE A 98 -40.260 0.074 -8.046 1.00 0.00 H new ATOM 1548 N TYR A 99 -48.504 0.008 -8.669 1.00 0.00 N ATOM 1549 CA TYR A 99 -49.801 -0.247 -9.304 1.00 0.00 C ATOM 1550 C TYR A 99 -49.737 -0.027 -10.823 1.00 0.00 C ATOM 1551 O TYR A 99 -49.080 0.897 -11.314 1.00 0.00 O ATOM 1552 CB TYR A 99 -50.937 0.558 -8.654 1.00 0.00 C ATOM 1553 CG TYR A 99 -51.046 2.010 -9.086 1.00 0.00 C ATOM 1554 CD1 TYR A 99 -50.122 2.963 -8.620 1.00 0.00 C ATOM 1555 CD2 TYR A 99 -52.068 2.401 -9.976 1.00 0.00 C ATOM 1556 CE1 TYR A 99 -50.210 4.304 -9.047 1.00 0.00 C ATOM 1557 CE2 TYR A 99 -52.170 3.743 -10.388 1.00 0.00 C ATOM 1558 CZ TYR A 99 -51.240 4.700 -9.928 1.00 0.00 C ATOM 1559 OH TYR A 99 -51.344 5.996 -10.333 1.00 0.00 O ATOM 0 H TYR A 99 -48.074 0.884 -8.965 1.00 0.00 H new ATOM 0 HA TYR A 99 -50.035 -1.299 -9.138 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -51.882 0.061 -8.874 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -50.806 0.529 -7.572 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -49.343 2.667 -7.933 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -52.773 1.670 -10.342 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -49.489 5.029 -8.700 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -52.962 4.041 -11.058 1.00 0.00 H new ATOM 0 HH TYR A 99 -52.109 6.089 -10.938 1.00 0.00 H new ATOM 1569 N ARG A 100 -50.408 -0.905 -11.574 1.00 0.00 N ATOM 1570 CA ARG A 100 -50.456 -0.904 -13.037 1.00 0.00 C ATOM 1571 C ARG A 100 -51.587 -0.046 -13.607 1.00 0.00 C ATOM 1572 O ARG A 100 -52.555 0.282 -12.918 1.00 0.00 O ATOM 1573 CB ARG A 100 -50.568 -2.342 -13.559 1.00 0.00 C ATOM 1574 CG ARG A 100 -49.499 -3.288 -12.997 1.00 0.00 C ATOM 1575 CD ARG A 100 -49.390 -4.551 -13.856 1.00 0.00 C ATOM 1576 NE ARG A 100 -48.606 -4.293 -15.077 1.00 0.00 N ATOM 1577 CZ ARG A 100 -49.020 -4.339 -16.332 1.00 0.00 C ATOM 1578 NH1 ARG A 100 -50.271 -4.441 -16.675 1.00 0.00 N ATOM 1579 NH2 ARG A 100 -48.164 -4.279 -17.306 1.00 0.00 N ATOM 0 H ARG A 100 -50.952 -1.664 -11.164 1.00 0.00 H new ATOM 0 HA ARG A 100 -49.525 -0.453 -13.379 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -51.554 -2.734 -13.310 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -50.495 -2.331 -14.646 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -48.536 -2.779 -12.966 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -49.749 -3.560 -11.972 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -48.920 -5.348 -13.279 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -50.387 -4.898 -14.126 1.00 0.00 H new ATOM 0 HE ARG A 100 -47.625 -4.049 -14.937 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -50.994 -4.490 -15.957 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -50.528 -4.472 -17.661 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -47.167 -4.196 -17.105 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -48.488 -4.315 -18.273 1.00 0.00 H new ATOM 1593 N LYS A 101 -51.503 0.209 -14.914 1.00 0.00 N ATOM 1594 CA LYS A 101 -52.495 0.906 -15.746 1.00 0.00 C ATOM 1595 C LYS A 101 -53.874 0.234 -15.719 1.00 0.00 C ATOM 1596 O LYS A 101 -54.896 0.915 -15.761 1.00 0.00 O ATOM 1597 CB LYS A 101 -51.881 0.993 -17.157 1.00 0.00 C ATOM 1598 CG LYS A 101 -52.780 1.642 -18.219 1.00 0.00 C ATOM 1599 CD LYS A 101 -53.544 0.573 -19.013 1.00 0.00 C ATOM 1600 CE LYS A 101 -54.519 1.232 -19.995 1.00 0.00 C ATOM 1601 NZ LYS A 101 -55.221 0.224 -20.833 1.00 0.00 N ATOM 0 H LYS A 101 -50.690 -0.083 -15.457 1.00 0.00 H new ATOM 0 HA LYS A 101 -52.698 1.904 -15.359 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -50.950 1.557 -17.097 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -51.623 -0.013 -17.487 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -53.486 2.319 -17.739 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -52.174 2.242 -18.898 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -52.840 -0.057 -19.557 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -54.090 -0.076 -18.329 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -55.252 1.819 -19.441 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -53.976 1.925 -20.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -55.872 0.707 -21.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -54.523 -0.319 -21.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -55.760 -0.422 -20.221 1.00 0.00 H new ATOM 1615 N ASP A 102 -53.909 -1.095 -15.601 1.00 0.00 N ATOM 1616 CA ASP A 102 -55.136 -1.893 -15.452 1.00 0.00 C ATOM 1617 C ASP A 102 -55.752 -1.853 -14.031 1.00 0.00 C ATOM 1618 O ASP A 102 -56.878 -2.316 -13.833 1.00 0.00 O ATOM 1619 CB ASP A 102 -54.847 -3.336 -15.893 1.00 0.00 C ATOM 1620 CG ASP A 102 -53.832 -4.025 -14.973 1.00 0.00 C ATOM 1621 OD1 ASP A 102 -54.219 -4.467 -13.870 1.00 0.00 O ATOM 1622 OD2 ASP A 102 -52.636 -4.079 -15.339 1.00 0.00 O ATOM 0 H ASP A 102 -53.063 -1.665 -15.606 1.00 0.00 H new ATOM 0 HA ASP A 102 -55.894 -1.443 -16.094 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -55.776 -3.906 -15.899 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -54.467 -3.334 -16.915 1.00 0.00 H new ATOM 1627 N GLY A 103 -55.035 -1.291 -13.047 1.00 0.00 N ATOM 1628 CA GLY A 103 -55.464 -1.152 -11.650 1.00 0.00 C ATOM 1629 C GLY A 103 -54.946 -2.226 -10.680 1.00 0.00 C ATOM 1630 O GLY A 103 -55.235 -2.136 -9.484 1.00 0.00 O ATOM 0 H GLY A 103 -54.105 -0.906 -13.210 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -55.142 -0.176 -11.287 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -56.554 -1.159 -11.622 1.00 0.00 H new ATOM 1634 N SER A 104 -54.176 -3.221 -11.140 1.00 0.00 N ATOM 1635 CA SER A 104 -53.573 -4.243 -10.256 1.00 0.00 C ATOM 1636 C SER A 104 -52.419 -3.655 -9.439 1.00 0.00 C ATOM 1637 O SER A 104 -51.621 -2.894 -9.983 1.00 0.00 O ATOM 1638 CB SER A 104 -53.056 -5.451 -11.049 1.00 0.00 C ATOM 1639 OG SER A 104 -54.098 -6.066 -11.780 1.00 0.00 O ATOM 0 H SER A 104 -53.951 -3.345 -12.127 1.00 0.00 H new ATOM 0 HA SER A 104 -54.364 -4.576 -9.584 1.00 0.00 H new ATOM 0 HB2 SER A 104 -52.269 -5.131 -11.732 1.00 0.00 H new ATOM 0 HB3 SER A 104 -52.611 -6.175 -10.366 1.00 0.00 H new ATOM 0 HG SER A 104 -54.195 -5.622 -12.648 1.00 0.00 H new ATOM 1645 N CYS A 105 -52.289 -4.012 -8.156 1.00 0.00 N ATOM 1646 CA CYS A 105 -51.242 -3.491 -7.264 1.00 0.00 C ATOM 1647 C CYS A 105 -50.578 -4.577 -6.396 1.00 0.00 C ATOM 1648 O CYS A 105 -51.244 -5.505 -5.928 1.00 0.00 O ATOM 1649 CB CYS A 105 -51.779 -2.307 -6.441 1.00 0.00 C ATOM 1650 SG CYS A 105 -53.157 -2.785 -5.357 1.00 0.00 S ATOM 0 H CYS A 105 -52.914 -4.678 -7.701 1.00 0.00 H new ATOM 0 HA CYS A 105 -50.434 -3.120 -7.895 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -50.972 -1.892 -5.837 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -52.109 -1.518 -7.117 1.00 0.00 H new ATOM 0 HG CYS A 105 -53.564 -1.747 -4.689 1.00 0.00 H new ATOM 1656 N PHE A 106 -49.257 -4.490 -6.219 1.00 0.00 N ATOM 1657 CA PHE A 106 -48.438 -5.516 -5.551 1.00 0.00 C ATOM 1658 C PHE A 106 -47.190 -4.943 -4.855 1.00 0.00 C ATOM 1659 O PHE A 106 -46.525 -4.057 -5.395 1.00 0.00 O ATOM 1660 CB PHE A 106 -48.039 -6.603 -6.571 1.00 0.00 C ATOM 1661 CG PHE A 106 -47.640 -6.093 -7.948 1.00 0.00 C ATOM 1662 CD1 PHE A 106 -46.351 -5.579 -8.188 1.00 0.00 C ATOM 1663 CD2 PHE A 106 -48.585 -6.109 -8.993 1.00 0.00 C ATOM 1664 CE1 PHE A 106 -46.017 -5.067 -9.456 1.00 0.00 C ATOM 1665 CE2 PHE A 106 -48.247 -5.608 -10.261 1.00 0.00 C ATOM 1666 CZ PHE A 106 -46.966 -5.080 -10.493 1.00 0.00 C ATOM 0 H PHE A 106 -48.712 -3.690 -6.541 1.00 0.00 H new ATOM 0 HA PHE A 106 -49.050 -5.951 -4.761 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -47.208 -7.175 -6.160 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -48.875 -7.293 -6.686 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -45.616 -5.578 -7.396 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -49.573 -6.508 -8.818 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -45.031 -4.664 -9.632 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -48.974 -5.629 -11.060 1.00 0.00 H new ATOM 0 HZ PHE A 106 -46.711 -4.685 -11.465 1.00 0.00 H new ATOM 1676 N LEU A 107 -46.850 -5.494 -3.682 1.00 0.00 N ATOM 1677 CA LEU A 107 -45.600 -5.267 -2.940 1.00 0.00 C ATOM 1678 C LEU A 107 -44.658 -6.462 -3.133 1.00 0.00 C ATOM 1679 O LEU A 107 -45.071 -7.618 -3.013 1.00 0.00 O ATOM 1680 CB LEU A 107 -45.944 -5.036 -1.447 1.00 0.00 C ATOM 1681 CG LEU A 107 -44.830 -4.652 -0.441 1.00 0.00 C ATOM 1682 CD1 LEU A 107 -43.726 -5.688 -0.246 1.00 0.00 C ATOM 1683 CD2 LEU A 107 -44.125 -3.346 -0.755 1.00 0.00 C ATOM 0 H LEU A 107 -47.471 -6.144 -3.199 1.00 0.00 H new ATOM 0 HA LEU A 107 -45.084 -4.383 -3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -46.700 -4.252 -1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -46.412 -5.949 -1.078 1.00 0.00 H new ATOM 0 HG LEU A 107 -45.418 -4.570 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -43.001 -5.316 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -44.160 -6.618 0.121 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -43.227 -5.871 -1.198 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -43.361 -3.154 -0.001 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -43.657 -3.412 -1.737 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -44.850 -2.532 -0.753 1.00 0.00 H new ATOM 1695 N CYS A 108 -43.385 -6.170 -3.391 1.00 0.00 N ATOM 1696 CA CYS A 108 -42.275 -7.125 -3.364 1.00 0.00 C ATOM 1697 C CYS A 108 -41.031 -6.478 -2.729 1.00 0.00 C ATOM 1698 O CYS A 108 -40.985 -5.260 -2.526 1.00 0.00 O ATOM 1699 CB CYS A 108 -42.016 -7.612 -4.794 1.00 0.00 C ATOM 1700 SG CYS A 108 -43.048 -9.073 -5.105 1.00 0.00 S ATOM 0 H CYS A 108 -43.085 -5.226 -3.634 1.00 0.00 H new ATOM 0 HA CYS A 108 -42.526 -7.988 -2.748 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -42.250 -6.824 -5.510 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -40.962 -7.859 -4.925 1.00 0.00 H new ATOM 0 HG CYS A 108 -44.152 -8.977 -4.425 1.00 0.00 H new ATOM 1706 N LEU A 109 -39.995 -7.273 -2.448 1.00 0.00 N ATOM 1707 CA LEU A 109 -38.691 -6.786 -1.982 1.00 0.00 C ATOM 1708 C LEU A 109 -37.896 -6.214 -3.174 1.00 0.00 C ATOM 1709 O LEU A 109 -36.832 -6.712 -3.539 1.00 0.00 O ATOM 1710 CB LEU A 109 -37.992 -7.925 -1.207 1.00 0.00 C ATOM 1711 CG LEU A 109 -36.657 -7.561 -0.524 1.00 0.00 C ATOM 1712 CD1 LEU A 109 -36.765 -6.343 0.398 1.00 0.00 C ATOM 1713 CD2 LEU A 109 -36.174 -8.749 0.308 1.00 0.00 C ATOM 0 H LEU A 109 -40.038 -8.288 -2.539 1.00 0.00 H new ATOM 0 HA LEU A 109 -38.785 -5.956 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -38.678 -8.293 -0.444 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -37.811 -8.749 -1.897 1.00 0.00 H new ATOM 0 HG LEU A 109 -35.955 -7.314 -1.321 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -35.793 -6.139 0.847 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -37.086 -5.477 -0.180 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -37.493 -6.545 1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -35.231 -8.495 0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -36.919 -8.988 1.067 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -36.028 -9.612 -0.341 1.00 0.00 H new ATOM 1725 N VAL A 110 -38.468 -5.190 -3.819 1.00 0.00 N ATOM 1726 CA VAL A 110 -37.963 -4.590 -5.068 1.00 0.00 C ATOM 1727 C VAL A 110 -36.520 -4.102 -4.886 1.00 0.00 C ATOM 1728 O VAL A 110 -36.146 -3.651 -3.800 1.00 0.00 O ATOM 1729 CB VAL A 110 -38.868 -3.438 -5.534 1.00 0.00 C ATOM 1730 CG1 VAL A 110 -38.431 -2.775 -6.848 1.00 0.00 C ATOM 1731 CG2 VAL A 110 -40.316 -3.903 -5.754 1.00 0.00 C ATOM 0 H VAL A 110 -39.319 -4.741 -3.480 1.00 0.00 H new ATOM 0 HA VAL A 110 -37.974 -5.360 -5.840 1.00 0.00 H new ATOM 0 HB VAL A 110 -38.788 -2.715 -4.722 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -39.126 -1.974 -7.100 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -37.429 -2.363 -6.732 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -38.428 -3.517 -7.646 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -40.923 -3.059 -6.083 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -40.336 -4.683 -6.515 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -40.717 -4.297 -4.820 1.00 0.00 H new ATOM 1741 N ASP A 111 -35.695 -4.149 -5.937 1.00 0.00 N ATOM 1742 CA ASP A 111 -34.246 -3.924 -5.776 1.00 0.00 C ATOM 1743 C ASP A 111 -33.859 -2.485 -6.169 1.00 0.00 C ATOM 1744 O ASP A 111 -33.166 -2.223 -7.151 1.00 0.00 O ATOM 1745 CB ASP A 111 -33.474 -5.030 -6.516 1.00 0.00 C ATOM 1746 CG ASP A 111 -32.115 -5.318 -5.870 1.00 0.00 C ATOM 1747 OD1 ASP A 111 -32.055 -6.176 -4.957 1.00 0.00 O ATOM 1748 OD2 ASP A 111 -31.101 -4.680 -6.229 1.00 0.00 O ATOM 0 H ASP A 111 -35.994 -4.337 -6.894 1.00 0.00 H new ATOM 0 HA ASP A 111 -33.961 -4.001 -4.727 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -34.070 -5.942 -6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -33.325 -4.735 -7.555 1.00 0.00 H new ATOM 1753 N VAL A 112 -34.287 -1.527 -5.338 1.00 0.00 N ATOM 1754 CA VAL A 112 -34.227 -0.088 -5.624 1.00 0.00 C ATOM 1755 C VAL A 112 -32.838 0.473 -5.284 1.00 0.00 C ATOM 1756 O VAL A 112 -32.680 1.212 -4.315 1.00 0.00 O ATOM 1757 CB VAL A 112 -35.376 0.616 -4.863 1.00 0.00 C ATOM 1758 CG1 VAL A 112 -35.588 2.066 -5.298 1.00 0.00 C ATOM 1759 CG2 VAL A 112 -36.717 -0.088 -5.095 1.00 0.00 C ATOM 0 H VAL A 112 -34.694 -1.736 -4.426 1.00 0.00 H new ATOM 0 HA VAL A 112 -34.369 0.099 -6.688 1.00 0.00 H new ATOM 0 HB VAL A 112 -35.070 0.577 -3.818 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -36.408 2.501 -4.726 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -34.677 2.637 -5.118 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -35.831 2.095 -6.360 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -37.501 0.433 -4.546 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -36.953 -0.080 -6.159 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -36.652 -1.118 -4.745 1.00 0.00 H new ATOM 1769 N VAL A 113 -31.814 0.107 -6.065 1.00 0.00 N ATOM 1770 CA VAL A 113 -30.400 0.471 -5.790 1.00 0.00 C ATOM 1771 C VAL A 113 -29.744 1.262 -6.950 1.00 0.00 C ATOM 1772 O VAL A 113 -29.843 0.819 -8.097 1.00 0.00 O ATOM 1773 CB VAL A 113 -29.587 -0.775 -5.382 1.00 0.00 C ATOM 1774 CG1 VAL A 113 -29.356 -1.786 -6.510 1.00 0.00 C ATOM 1775 CG2 VAL A 113 -28.232 -0.391 -4.782 1.00 0.00 C ATOM 0 H VAL A 113 -31.933 -0.452 -6.910 1.00 0.00 H new ATOM 0 HA VAL A 113 -30.398 1.157 -4.943 1.00 0.00 H new ATOM 0 HB VAL A 113 -30.212 -1.264 -4.635 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -28.776 -2.628 -6.131 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -30.317 -2.144 -6.880 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -28.810 -1.306 -7.323 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -27.687 -1.294 -4.506 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -27.655 0.171 -5.516 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -28.388 0.224 -3.895 1.00 0.00 H new ATOM 1785 N PRO A 114 -29.098 2.429 -6.709 1.00 0.00 N ATOM 1786 CA PRO A 114 -28.542 3.290 -7.768 1.00 0.00 C ATOM 1787 C PRO A 114 -27.096 2.907 -8.148 1.00 0.00 C ATOM 1788 O PRO A 114 -26.506 2.000 -7.548 1.00 0.00 O ATOM 1789 CB PRO A 114 -28.599 4.705 -7.201 1.00 0.00 C ATOM 1790 CG PRO A 114 -28.350 4.473 -5.721 1.00 0.00 C ATOM 1791 CD PRO A 114 -29.031 3.135 -5.433 1.00 0.00 C ATOM 0 HA PRO A 114 -29.113 3.186 -8.691 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -27.841 5.351 -7.644 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -29.565 5.176 -7.382 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -27.284 4.434 -5.498 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -28.773 5.274 -5.115 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -28.466 2.560 -4.699 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -30.028 3.287 -5.019 1.00 0.00 H new ATOM 1799 N VAL A 115 -26.489 3.635 -9.097 1.00 0.00 N ATOM 1800 CA VAL A 115 -25.179 3.318 -9.699 1.00 0.00 C ATOM 1801 C VAL A 115 -24.112 4.409 -9.489 1.00 0.00 C ATOM 1802 O VAL A 115 -24.355 5.621 -9.602 1.00 0.00 O ATOM 1803 CB VAL A 115 -25.311 2.966 -11.191 1.00 0.00 C ATOM 1804 CG1 VAL A 115 -26.009 1.614 -11.384 1.00 0.00 C ATOM 1805 CG2 VAL A 115 -26.033 4.027 -12.000 1.00 0.00 C ATOM 0 H VAL A 115 -26.905 4.484 -9.479 1.00 0.00 H new ATOM 0 HA VAL A 115 -24.824 2.439 -9.160 1.00 0.00 H new ATOM 0 HB VAL A 115 -24.289 2.910 -11.566 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -26.087 1.394 -12.449 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -25.430 0.832 -10.893 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -27.007 1.654 -10.948 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -26.090 3.714 -13.042 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -27.040 4.162 -11.606 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -25.488 4.969 -11.934 1.00 0.00 H new ATOM 1815 N LYS A 116 -22.896 3.934 -9.188 1.00 0.00 N ATOM 1816 CA LYS A 116 -21.734 4.705 -8.731 1.00 0.00 C ATOM 1817 C LYS A 116 -20.550 4.600 -9.694 1.00 0.00 C ATOM 1818 O LYS A 116 -20.481 3.691 -10.523 1.00 0.00 O ATOM 1819 CB LYS A 116 -21.295 4.273 -7.312 1.00 0.00 C ATOM 1820 CG LYS A 116 -22.396 4.287 -6.239 1.00 0.00 C ATOM 1821 CD LYS A 116 -23.155 2.957 -6.098 1.00 0.00 C ATOM 1822 CE LYS A 116 -24.241 3.102 -5.031 1.00 0.00 C ATOM 1823 NZ LYS A 116 -25.125 1.910 -4.966 1.00 0.00 N ATOM 0 H LYS A 116 -22.685 2.939 -9.262 1.00 0.00 H new ATOM 0 HA LYS A 116 -22.051 5.747 -8.703 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -20.883 3.265 -7.370 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -20.488 4.929 -6.986 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -21.948 4.541 -5.278 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -23.109 5.076 -6.476 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -23.602 2.678 -7.052 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -22.465 2.159 -5.824 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -23.774 3.260 -4.059 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -24.841 3.987 -5.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -25.792 2.015 -4.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -25.655 1.822 -5.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -24.548 1.057 -4.821 1.00 0.00 H new ATOM 1837 N ASN A 117 -19.607 5.527 -9.542 1.00 0.00 N ATOM 1838 CA ASN A 117 -18.313 5.513 -10.242 1.00 0.00 C ATOM 1839 C ASN A 117 -17.207 4.843 -9.397 1.00 0.00 C ATOM 1840 O ASN A 117 -17.450 4.426 -8.264 1.00 0.00 O ATOM 1841 CB ASN A 117 -17.964 6.940 -10.708 1.00 0.00 C ATOM 1842 CG ASN A 117 -17.327 7.797 -9.631 1.00 0.00 C ATOM 1843 OD1 ASN A 117 -16.116 7.934 -9.567 1.00 0.00 O ATOM 1844 ND2 ASN A 117 -18.088 8.370 -8.727 1.00 0.00 N ATOM 0 H ASN A 117 -19.717 6.326 -8.918 1.00 0.00 H new ATOM 0 HA ASN A 117 -18.391 4.892 -11.134 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -17.286 6.879 -11.559 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -18.872 7.430 -11.059 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -17.666 8.923 -7.981 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -19.101 8.262 -8.771 1.00 0.00 H new ATOM 1851 N GLU A 118 -15.980 4.767 -9.922 1.00 0.00 N ATOM 1852 CA GLU A 118 -14.827 4.131 -9.252 1.00 0.00 C ATOM 1853 C GLU A 118 -14.412 4.782 -7.913 1.00 0.00 C ATOM 1854 O GLU A 118 -13.805 4.120 -7.069 1.00 0.00 O ATOM 1855 CB GLU A 118 -13.639 4.054 -10.228 1.00 0.00 C ATOM 1856 CG GLU A 118 -13.077 5.421 -10.649 1.00 0.00 C ATOM 1857 CD GLU A 118 -11.913 5.252 -11.645 1.00 0.00 C ATOM 1858 OE1 GLU A 118 -10.741 5.145 -11.206 1.00 0.00 O ATOM 1859 OE2 GLU A 118 -12.158 5.229 -12.876 1.00 0.00 O ATOM 0 H GLU A 118 -15.750 5.150 -10.839 1.00 0.00 H new ATOM 0 HA GLU A 118 -15.152 3.128 -8.975 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -12.841 3.473 -9.766 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.952 3.512 -11.121 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.867 6.019 -11.104 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -12.732 5.964 -9.769 1.00 0.00 H new ATOM 1866 N ASP A 119 -14.779 6.047 -7.674 1.00 0.00 N ATOM 1867 CA ASP A 119 -14.637 6.728 -6.376 1.00 0.00 C ATOM 1868 C ASP A 119 -15.617 6.223 -5.294 1.00 0.00 C ATOM 1869 O ASP A 119 -15.396 6.442 -4.102 1.00 0.00 O ATOM 1870 CB ASP A 119 -14.784 8.243 -6.583 1.00 0.00 C ATOM 1871 CG ASP A 119 -14.182 9.054 -5.422 1.00 0.00 C ATOM 1872 OD1 ASP A 119 -12.951 8.969 -5.191 1.00 0.00 O ATOM 1873 OD2 ASP A 119 -14.931 9.809 -4.756 1.00 0.00 O ATOM 0 H ASP A 119 -15.193 6.641 -8.392 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.643 6.491 -5.996 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -14.295 8.529 -7.514 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.840 8.492 -6.688 1.00 0.00 H new ATOM 1878 N GLY A 120 -16.715 5.569 -5.699 1.00 0.00 N ATOM 1879 CA GLY A 120 -17.789 5.082 -4.827 1.00 0.00 C ATOM 1880 C GLY A 120 -18.982 6.038 -4.695 1.00 0.00 C ATOM 1881 O GLY A 120 -19.895 5.763 -3.915 1.00 0.00 O ATOM 0 H GLY A 120 -16.884 5.357 -6.682 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -18.146 4.126 -5.210 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -17.378 4.894 -3.835 1.00 0.00 H new ATOM 1885 N ALA A 121 -18.998 7.144 -5.451 1.00 0.00 N ATOM 1886 CA ALA A 121 -20.084 8.128 -5.448 1.00 0.00 C ATOM 1887 C ALA A 121 -21.141 7.857 -6.523 1.00 0.00 C ATOM 1888 O ALA A 121 -20.804 7.511 -7.661 1.00 0.00 O ATOM 1889 CB ALA A 121 -19.499 9.539 -5.567 1.00 0.00 C ATOM 0 H ALA A 121 -18.242 7.382 -6.093 1.00 0.00 H new ATOM 0 HA ALA A 121 -20.610 8.040 -4.498 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -20.308 10.270 -5.565 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.835 9.730 -4.724 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -18.937 9.623 -6.497 1.00 0.00 H new ATOM 1895 N VAL A 122 -22.414 8.048 -6.157 1.00 0.00 N ATOM 1896 CA VAL A 122 -23.595 7.826 -7.000 1.00 0.00 C ATOM 1897 C VAL A 122 -23.720 8.926 -8.052 1.00 0.00 C ATOM 1898 O VAL A 122 -24.163 10.042 -7.776 1.00 0.00 O ATOM 1899 CB VAL A 122 -24.858 7.599 -6.139 1.00 0.00 C ATOM 1900 CG1 VAL A 122 -25.228 8.730 -5.172 1.00 0.00 C ATOM 1901 CG2 VAL A 122 -26.068 7.273 -7.006 1.00 0.00 C ATOM 0 H VAL A 122 -22.660 8.376 -5.223 1.00 0.00 H new ATOM 0 HA VAL A 122 -23.474 6.902 -7.565 1.00 0.00 H new ATOM 0 HB VAL A 122 -24.582 6.751 -5.512 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -26.130 8.459 -4.623 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -24.410 8.891 -4.470 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -25.408 9.646 -5.735 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -26.940 7.119 -6.370 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -26.259 8.100 -7.690 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -25.872 6.367 -7.579 1.00 0.00 H new ATOM 1911 N ILE A 123 -23.286 8.609 -9.273 1.00 0.00 N ATOM 1912 CA ILE A 123 -23.384 9.517 -10.419 1.00 0.00 C ATOM 1913 C ILE A 123 -24.720 9.356 -11.140 1.00 0.00 C ATOM 1914 O ILE A 123 -25.228 10.348 -11.655 1.00 0.00 O ATOM 1915 CB ILE A 123 -22.159 9.441 -11.362 1.00 0.00 C ATOM 1916 CG1 ILE A 123 -22.185 8.357 -12.466 1.00 0.00 C ATOM 1917 CG2 ILE A 123 -20.853 9.386 -10.550 1.00 0.00 C ATOM 1918 CD1 ILE A 123 -22.289 6.895 -12.021 1.00 0.00 C ATOM 0 H ILE A 123 -22.855 7.712 -9.497 1.00 0.00 H new ATOM 0 HA ILE A 123 -23.362 10.533 -10.026 1.00 0.00 H new ATOM 0 HB ILE A 123 -22.214 10.368 -11.933 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -23.027 8.568 -13.125 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -21.279 8.463 -13.063 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -20.003 9.333 -11.231 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -20.769 10.282 -9.934 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -20.860 8.504 -9.909 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -22.297 6.247 -12.898 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -21.435 6.644 -11.392 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -23.210 6.751 -11.456 1.00 0.00 H new ATOM 1930 N MET A 124 -25.325 8.155 -11.125 1.00 0.00 N ATOM 1931 CA MET A 124 -26.617 7.933 -11.784 1.00 0.00 C ATOM 1932 C MET A 124 -27.569 7.125 -10.890 1.00 0.00 C ATOM 1933 O MET A 124 -27.192 6.258 -10.105 1.00 0.00 O ATOM 1934 CB MET A 124 -26.431 7.290 -13.177 1.00 0.00 C ATOM 1935 CG MET A 124 -26.037 8.276 -14.280 1.00 0.00 C ATOM 1936 SD MET A 124 -27.083 9.736 -14.513 1.00 0.00 S ATOM 1937 CE MET A 124 -25.759 10.943 -14.787 1.00 0.00 C ATOM 0 H MET A 124 -24.940 7.330 -10.666 1.00 0.00 H new ATOM 0 HA MET A 124 -27.085 8.904 -11.944 1.00 0.00 H new ATOM 0 HB2 MET A 124 -25.666 6.516 -13.108 1.00 0.00 H new ATOM 0 HB3 MET A 124 -27.360 6.796 -13.463 1.00 0.00 H new ATOM 0 HG2 MET A 124 -25.022 8.619 -14.077 1.00 0.00 H new ATOM 0 HG3 MET A 124 -26.007 7.730 -15.223 1.00 0.00 H new ATOM 0 HE1 MET A 124 -26.089 11.686 -15.513 1.00 0.00 H new ATOM 0 HE2 MET A 124 -25.517 11.437 -13.846 1.00 0.00 H new ATOM 0 HE3 MET A 124 -24.874 10.432 -15.167 1.00 0.00 H new ATOM 1947 N PHE A 125 -28.848 7.426 -11.027 1.00 0.00 N ATOM 1948 CA PHE A 125 -29.961 6.845 -10.282 1.00 0.00 C ATOM 1949 C PHE A 125 -30.667 5.854 -11.218 1.00 0.00 C ATOM 1950 O PHE A 125 -31.681 6.156 -11.846 1.00 0.00 O ATOM 1951 CB PHE A 125 -30.890 7.978 -9.784 1.00 0.00 C ATOM 1952 CG PHE A 125 -30.642 8.623 -8.429 1.00 0.00 C ATOM 1953 CD1 PHE A 125 -29.583 8.248 -7.575 1.00 0.00 C ATOM 1954 CD2 PHE A 125 -31.500 9.671 -8.038 1.00 0.00 C ATOM 1955 CE1 PHE A 125 -29.396 8.907 -6.346 1.00 0.00 C ATOM 1956 CE2 PHE A 125 -31.300 10.341 -6.819 1.00 0.00 C ATOM 1957 CZ PHE A 125 -30.249 9.957 -5.970 1.00 0.00 C ATOM 0 H PHE A 125 -29.161 8.125 -11.701 1.00 0.00 H new ATOM 0 HA PHE A 125 -29.630 6.306 -9.394 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -30.863 8.772 -10.531 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -31.906 7.584 -9.775 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -28.913 7.452 -7.866 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -32.318 9.961 -8.681 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -28.594 8.604 -5.690 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -31.955 11.152 -6.535 1.00 0.00 H new ATOM 0 HZ PHE A 125 -30.097 10.468 -5.031 1.00 0.00 H new ATOM 1967 N ILE A 126 -30.097 4.657 -11.347 1.00 0.00 N ATOM 1968 CA ILE A 126 -30.693 3.560 -12.129 1.00 0.00 C ATOM 1969 C ILE A 126 -31.386 2.594 -11.179 1.00 0.00 C ATOM 1970 O ILE A 126 -30.905 1.497 -10.885 1.00 0.00 O ATOM 1971 CB ILE A 126 -29.683 2.893 -13.075 1.00 0.00 C ATOM 1972 CG1 ILE A 126 -29.070 3.987 -13.969 1.00 0.00 C ATOM 1973 CG2 ILE A 126 -30.362 1.803 -13.937 1.00 0.00 C ATOM 1974 CD1 ILE A 126 -28.122 3.423 -15.013 1.00 0.00 C ATOM 0 H ILE A 126 -29.206 4.414 -10.913 1.00 0.00 H new ATOM 0 HA ILE A 126 -31.450 3.964 -12.801 1.00 0.00 H new ATOM 0 HB ILE A 126 -28.903 2.402 -12.492 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -29.870 4.534 -14.468 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -28.534 4.703 -13.346 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -29.623 1.348 -14.597 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -30.788 1.038 -13.287 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -31.154 2.253 -14.535 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -27.719 4.237 -15.616 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -27.305 2.899 -14.517 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -28.661 2.728 -15.657 1.00 0.00 H new ATOM 1986 N LEU A 127 -32.527 3.041 -10.657 1.00 0.00 N ATOM 1987 CA LEU A 127 -33.317 2.283 -9.695 1.00 0.00 C ATOM 1988 C LEU A 127 -34.105 1.199 -10.442 1.00 0.00 C ATOM 1989 O LEU A 127 -35.231 1.389 -10.895 1.00 0.00 O ATOM 1990 CB LEU A 127 -34.060 3.250 -8.727 1.00 0.00 C ATOM 1991 CG LEU A 127 -33.089 4.255 -8.044 1.00 0.00 C ATOM 1992 CD1 LEU A 127 -33.575 5.080 -6.851 1.00 0.00 C ATOM 1993 CD2 LEU A 127 -31.917 3.490 -7.469 1.00 0.00 C ATOM 0 H LEU A 127 -32.930 3.947 -10.894 1.00 0.00 H new ATOM 0 HA LEU A 127 -32.718 1.703 -8.994 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -34.821 3.801 -9.279 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -34.577 2.670 -7.963 1.00 0.00 H new ATOM 0 HG LEU A 127 -32.899 4.950 -8.862 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -32.769 5.725 -6.502 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -34.425 5.692 -7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -33.878 4.411 -6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -31.230 4.185 -6.988 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -32.278 2.770 -6.735 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -31.398 2.963 -8.270 1.00 0.00 H new ATOM 2005 N ASN A 128 -33.428 0.059 -10.620 1.00 0.00 N ATOM 2006 CA ASN A 128 -33.941 -1.159 -11.247 1.00 0.00 C ATOM 2007 C ASN A 128 -35.160 -1.679 -10.465 1.00 0.00 C ATOM 2008 O ASN A 128 -35.015 -2.287 -9.403 1.00 0.00 O ATOM 2009 CB ASN A 128 -32.831 -2.235 -11.250 1.00 0.00 C ATOM 2010 CG ASN A 128 -31.761 -2.087 -12.322 1.00 0.00 C ATOM 2011 OD1 ASN A 128 -31.709 -2.847 -13.276 1.00 0.00 O ATOM 2012 ND2 ASN A 128 -30.852 -1.145 -12.209 1.00 0.00 N ATOM 0 H ASN A 128 -32.460 -0.042 -10.315 1.00 0.00 H new ATOM 0 HA ASN A 128 -34.244 -0.939 -12.271 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -32.344 -2.229 -10.275 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -33.300 -3.212 -11.365 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -30.118 -1.057 -12.912 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -30.880 -0.501 -11.418 1.00 0.00 H new ATOM 2019 N PHE A 129 -36.377 -1.467 -10.974 1.00 0.00 N ATOM 2020 CA PHE A 129 -37.589 -1.868 -10.274 1.00 0.00 C ATOM 2021 C PHE A 129 -37.933 -3.335 -10.557 1.00 0.00 C ATOM 2022 O PHE A 129 -38.985 -3.664 -11.107 1.00 0.00 O ATOM 2023 CB PHE A 129 -38.741 -0.916 -10.588 1.00 0.00 C ATOM 2024 CG PHE A 129 -38.528 0.572 -10.346 1.00 0.00 C ATOM 2025 CD1 PHE A 129 -37.897 1.040 -9.175 1.00 0.00 C ATOM 2026 CD2 PHE A 129 -39.020 1.502 -11.285 1.00 0.00 C ATOM 2027 CE1 PHE A 129 -37.741 2.422 -8.961 1.00 0.00 C ATOM 2028 CE2 PHE A 129 -38.870 2.883 -11.065 1.00 0.00 C ATOM 2029 CZ PHE A 129 -38.224 3.344 -9.904 1.00 0.00 C ATOM 0 H PHE A 129 -36.544 -1.017 -11.874 1.00 0.00 H new ATOM 0 HA PHE A 129 -37.409 -1.797 -9.201 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -39.007 -1.049 -11.637 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -39.603 -1.230 -9.999 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -37.533 0.336 -8.441 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -39.515 1.152 -12.179 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -37.248 2.775 -8.068 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -39.251 3.589 -11.788 1.00 0.00 H new ATOM 0 HZ PHE A 129 -38.100 4.404 -9.738 1.00 0.00 H new ATOM 2039 N GLU A 130 -37.031 -4.238 -10.178 1.00 0.00 N ATOM 2040 CA GLU A 130 -37.285 -5.674 -10.296 1.00 0.00 C ATOM 2041 C GLU A 130 -38.161 -6.164 -9.143 1.00 0.00 C ATOM 2042 O GLU A 130 -37.882 -5.932 -7.973 1.00 0.00 O ATOM 2043 CB GLU A 130 -35.995 -6.489 -10.389 1.00 0.00 C ATOM 2044 CG GLU A 130 -34.984 -6.160 -9.288 1.00 0.00 C ATOM 2045 CD GLU A 130 -33.849 -7.196 -9.209 1.00 0.00 C ATOM 2046 OE1 GLU A 130 -34.103 -8.366 -8.841 1.00 0.00 O ATOM 2047 OE2 GLU A 130 -32.691 -6.839 -9.537 1.00 0.00 O ATOM 0 H GLU A 130 -36.119 -4.002 -9.787 1.00 0.00 H new ATOM 0 HA GLU A 130 -37.822 -5.829 -11.232 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -36.241 -7.550 -10.340 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -35.533 -6.313 -11.360 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -34.560 -5.173 -9.471 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -35.498 -6.113 -8.328 1.00 0.00 H new ATOM 2054 N VAL A 131 -39.236 -6.857 -9.483 1.00 0.00 N ATOM 2055 CA VAL A 131 -40.219 -7.395 -8.534 1.00 0.00 C ATOM 2056 C VAL A 131 -39.750 -8.781 -8.099 1.00 0.00 C ATOM 2057 O VAL A 131 -39.656 -9.687 -8.932 1.00 0.00 O ATOM 2058 CB VAL A 131 -41.590 -7.422 -9.220 1.00 0.00 C ATOM 2059 CG1 VAL A 131 -42.664 -8.212 -8.482 1.00 0.00 C ATOM 2060 CG2 VAL A 131 -42.122 -5.994 -9.408 1.00 0.00 C ATOM 0 H VAL A 131 -39.463 -7.071 -10.454 1.00 0.00 H new ATOM 0 HA VAL A 131 -40.310 -6.777 -7.641 1.00 0.00 H new ATOM 0 HB VAL A 131 -41.406 -7.925 -10.169 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -43.596 -8.172 -9.045 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -42.346 -9.250 -8.379 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -42.819 -7.780 -7.493 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -43.096 -6.030 -9.896 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -42.221 -5.512 -8.436 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -41.427 -5.425 -10.026 1.00 0.00 H new ATOM 2070 N VAL A 132 -39.400 -8.940 -6.818 1.00 0.00 N ATOM 2071 CA VAL A 132 -38.846 -10.200 -6.300 1.00 0.00 C ATOM 2072 C VAL A 132 -39.391 -10.536 -4.907 1.00 0.00 C ATOM 2073 O VAL A 132 -39.474 -9.673 -4.031 1.00 0.00 O ATOM 2074 CB VAL A 132 -37.300 -10.200 -6.398 1.00 0.00 C ATOM 2075 CG1 VAL A 132 -36.625 -9.075 -5.610 1.00 0.00 C ATOM 2076 CG2 VAL A 132 -36.698 -11.541 -5.963 1.00 0.00 C ATOM 0 H VAL A 132 -39.491 -8.207 -6.115 1.00 0.00 H new ATOM 0 HA VAL A 132 -39.187 -11.019 -6.933 1.00 0.00 H new ATOM 0 HB VAL A 132 -37.099 -10.029 -7.455 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -35.544 -9.145 -5.730 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -36.970 -8.111 -5.984 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -36.880 -9.167 -4.554 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -35.612 -11.497 -6.047 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -36.974 -11.745 -4.928 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -37.080 -12.336 -6.604 1.00 0.00 H new