USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1026 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 136 HIS : no HD1:sc= -3.21 K(o=-4,f=-11!) USER MOD Set 1.2: A 140 TYR OH : rot -87:sc= -0.801 USER MOD Set 2.1: A 116 GLN : amide:sc= -0.718 K(o=-3.5,f=-4.7) USER MOD Set 2.2: A 119 ASN : amide:sc= -2.81! C(o=-3.5!,f=-9!) USER MOD Set 3.1: A 100 HIS :FLIP no HD1:sc= -0.561 F(o=-3.9!,f=-2.7) USER MOD Set 3.2: A 101 ASN : amide:sc= -2.15! C(o=-2.7!,f=-4.4!) USER MOD Set 4.1: A 48 HIS : no HD1:sc= -7.37! C(o=-8.6!,f=-10!) USER MOD Set 4.2: A 56 MET CE :methyl -131:sc= -1.28 (180deg=-6.06!) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 18 GLN :FLIP amide:sc= -1.45 F(o=-2.9!,f=-1.4) USER MOD Single : A 22 ASN :FLIP amide:sc= -1.09 F(o=-2.7!,f=-1.1) USER MOD Single : A 23 THR OG1 : rot 72:sc= 1.11 USER MOD Single : A 24 TYR OH : rot -92:sc=0.000149 USER MOD Single : A 25 LYS NZ :NH3+ 153:sc= -0.117 (180deg=-0.433) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.452 X(o=-0.45,f=0) USER MOD Single : A 33 ASN : amide:sc= -4.73! C(o=-4.7!,f=-4.2!) USER MOD Single : A 35 THR OG1 : rot 97:sc= 0.639 USER MOD Single : A 45 SER OG : rot 180:sc= -1.28 USER MOD Single : A 46 GLN : amide:sc= 0.243 X(o=0.24,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= -0.241 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -4.27! C(o=-4.3!,f=-6!) USER MOD Single : A 58 GLN : amide:sc= -0.437 X(o=-0.44,f=-0.44) USER MOD Single : A 62 THR OG1 : rot -16:sc= -0.544 USER MOD Single : A 63 LYS NZ :NH3+ -124:sc= 0.28! (180deg=-2.3) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 CYS SG : rot 48:sc= -0.0785 USER MOD Single : A 83 ASN : amide:sc= -0.856 K(o=-0.86,f=-3.2!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 107:sc= 1.14 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 134:sc= 0.336 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot -166:sc= -3.83! USER MOD Single : A 107 GLN : amide:sc= -0.229 X(o=-0.23,f=0) USER MOD Single : A 110 GLN :FLIP amide:sc= 0 F(o=-0.55,f=0) USER MOD Single : A 111 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.68) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 HIS :FLIP no HD1:sc= 0.154 F(o=-1.4!,f=0.15) USER MOD Single : A 122 TYR OH : rot -96:sc= 0.0932 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot -154:sc= -1.29 USER MOD Single : A 128 MET CE :methyl -171:sc= -0.184 (180deg=-0.373) USER MOD Single : A 129 THR OG1 : rot 169:sc= 0.703! USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 177 N ARG A 9 -1.316 4.968 -9.073 1.00 0.00 N ATOM 178 CA ARG A 9 -1.639 5.946 -8.048 1.00 0.00 C ATOM 179 C ARG A 9 -3.152 6.164 -7.982 1.00 0.00 C ATOM 180 O ARG A 9 -3.700 6.422 -6.911 1.00 0.00 O ATOM 181 CB ARG A 9 -0.950 7.283 -8.325 1.00 0.00 C ATOM 182 CG ARG A 9 -1.612 8.415 -7.536 1.00 0.00 C ATOM 183 CD ARG A 9 -0.569 9.414 -7.031 1.00 0.00 C ATOM 184 NE ARG A 9 0.042 8.918 -5.778 1.00 0.00 N ATOM 185 CZ ARG A 9 0.935 9.614 -5.044 1.00 0.00 C ATOM 186 NH1 ARG A 9 1.330 10.846 -5.432 1.00 0.00 N ATOM 187 NH2 ARG A 9 1.417 9.074 -3.940 1.00 0.00 N ATOM 0 HA ARG A 9 -1.282 5.557 -7.094 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.104 7.216 -8.056 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -0.993 7.504 -9.391 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -2.336 8.928 -8.168 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -2.163 8.001 -6.692 1.00 0.00 H new ATOM 0 HD2 ARG A 9 0.202 9.561 -7.788 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -1.036 10.384 -6.859 1.00 0.00 H new ATOM 0 HE ARG A 9 -0.229 7.992 -5.448 1.00 0.00 H new ATOM 0 HH11 ARG A 9 0.953 11.257 -6.286 1.00 0.00 H new ATOM 0 HH12 ARG A 9 2.005 11.365 -4.871 1.00 0.00 H new ATOM 0 HH21 ARG A 9 1.114 8.143 -3.653 1.00 0.00 H new ATOM 0 HH22 ARG A 9 2.093 9.587 -3.374 1.00 0.00 H new ATOM 199 N ILE A 10 -3.786 6.053 -9.140 1.00 0.00 N ATOM 200 CA ILE A 10 -5.225 6.235 -9.227 1.00 0.00 C ATOM 201 C ILE A 10 -5.925 5.082 -8.506 1.00 0.00 C ATOM 202 O ILE A 10 -6.863 5.301 -7.742 1.00 0.00 O ATOM 203 CB ILE A 10 -5.656 6.401 -10.686 1.00 0.00 C ATOM 204 CG1 ILE A 10 -5.324 7.803 -11.200 1.00 0.00 C ATOM 205 CG2 ILE A 10 -7.138 6.063 -10.861 1.00 0.00 C ATOM 206 CD1 ILE A 10 -5.536 7.897 -12.712 1.00 0.00 C ATOM 0 H ILE A 10 -3.329 5.839 -10.027 1.00 0.00 H new ATOM 0 HA ILE A 10 -5.524 7.154 -8.724 1.00 0.00 H new ATOM 0 HB ILE A 10 -5.090 5.694 -11.292 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -5.951 8.537 -10.695 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -4.290 8.047 -10.958 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -7.419 6.189 -11.907 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -7.314 5.030 -10.560 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -7.739 6.729 -10.241 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -5.293 8.904 -13.052 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.889 7.178 -13.215 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -6.577 7.676 -12.948 1.00 0.00 H new ATOM 218 N LEU A 11 -5.441 3.878 -8.774 1.00 0.00 N ATOM 219 CA LEU A 11 -6.009 2.689 -8.160 1.00 0.00 C ATOM 220 C LEU A 11 -5.998 2.852 -6.639 1.00 0.00 C ATOM 221 O LEU A 11 -6.941 2.449 -5.961 1.00 0.00 O ATOM 222 CB LEU A 11 -5.284 1.435 -8.651 1.00 0.00 C ATOM 223 CG LEU A 11 -5.049 1.342 -10.160 1.00 0.00 C ATOM 224 CD1 LEU A 11 -4.766 -0.101 -10.583 1.00 0.00 C ATOM 225 CD2 LEU A 11 -6.221 1.947 -10.935 1.00 0.00 C ATOM 0 H LEU A 11 -4.662 3.700 -9.408 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.050 2.564 -8.459 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.318 1.378 -8.149 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.857 0.562 -8.338 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.164 1.929 -10.405 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -4.603 -0.139 -11.660 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.876 -0.463 -10.068 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.617 -0.730 -10.323 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -6.029 1.868 -12.005 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.136 1.408 -10.690 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.334 2.996 -10.663 1.00 0.00 H new ATOM 237 N LEU A 12 -4.918 3.443 -6.147 1.00 0.00 N ATOM 238 CA LEU A 12 -4.772 3.663 -4.718 1.00 0.00 C ATOM 239 C LEU A 12 -5.862 4.625 -4.241 1.00 0.00 C ATOM 240 O LEU A 12 -6.539 4.358 -3.249 1.00 0.00 O ATOM 241 CB LEU A 12 -3.352 4.131 -4.392 1.00 0.00 C ATOM 242 CG LEU A 12 -3.240 5.465 -3.651 1.00 0.00 C ATOM 243 CD1 LEU A 12 -3.638 5.312 -2.181 1.00 0.00 C ATOM 244 CD2 LEU A 12 -1.840 6.062 -3.806 1.00 0.00 C ATOM 0 H LEU A 12 -4.137 3.776 -6.712 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.909 2.730 -4.172 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.866 3.362 -3.791 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -2.793 4.208 -5.324 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.942 6.166 -4.103 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -3.549 6.275 -1.678 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -4.669 4.963 -2.118 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.980 4.589 -1.699 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.787 7.010 -3.270 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.103 5.372 -3.396 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -1.631 6.231 -4.862 1.00 0.00 H new ATOM 256 N PHE A 13 -5.997 5.724 -4.969 1.00 0.00 N ATOM 257 CA PHE A 13 -6.993 6.727 -4.632 1.00 0.00 C ATOM 258 C PHE A 13 -8.408 6.158 -4.757 1.00 0.00 C ATOM 259 O PHE A 13 -9.324 6.603 -4.067 1.00 0.00 O ATOM 260 CB PHE A 13 -6.828 7.875 -5.630 1.00 0.00 C ATOM 261 CG PHE A 13 -5.629 8.781 -5.342 1.00 0.00 C ATOM 262 CD1 PHE A 13 -5.389 9.209 -4.073 1.00 0.00 C ATOM 263 CD2 PHE A 13 -4.804 9.159 -6.355 1.00 0.00 C ATOM 264 CE1 PHE A 13 -4.277 10.050 -3.806 1.00 0.00 C ATOM 265 CE2 PHE A 13 -3.691 10.000 -6.088 1.00 0.00 C ATOM 266 CZ PHE A 13 -3.451 10.428 -4.819 1.00 0.00 C ATOM 0 H PHE A 13 -5.433 5.942 -5.791 1.00 0.00 H new ATOM 0 HA PHE A 13 -6.853 7.059 -3.603 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -6.724 7.460 -6.632 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -7.736 8.479 -5.627 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -6.044 8.909 -3.269 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -4.995 8.820 -7.362 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -4.087 10.390 -2.799 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -3.035 10.300 -6.892 1.00 0.00 H new ATOM 0 HZ PHE A 13 -2.605 11.068 -4.616 1.00 0.00 H new ATOM 276 N GLU A 14 -8.543 5.182 -5.644 1.00 0.00 N ATOM 277 CA GLU A 14 -9.831 4.548 -5.868 1.00 0.00 C ATOM 278 C GLU A 14 -10.264 3.771 -4.623 1.00 0.00 C ATOM 279 O GLU A 14 -11.315 4.051 -4.047 1.00 0.00 O ATOM 280 CB GLU A 14 -9.786 3.635 -7.095 1.00 0.00 C ATOM 281 CG GLU A 14 -9.531 4.442 -8.370 1.00 0.00 C ATOM 282 CD GLU A 14 -10.626 4.188 -9.408 1.00 0.00 C ATOM 283 OE1 GLU A 14 -10.467 3.123 -10.118 1.00 0.00 O ATOM 284 OE2 GLU A 14 -11.574 4.980 -9.516 1.00 0.00 O ATOM 0 H GLU A 14 -7.782 4.815 -6.215 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.569 5.327 -6.061 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.001 2.889 -6.969 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.728 3.094 -7.185 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.492 5.505 -8.130 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -8.560 4.173 -8.787 1.00 0.00 H new ATOM 291 N GLN A 15 -9.433 2.811 -4.244 1.00 0.00 N ATOM 292 CA GLN A 15 -9.718 1.992 -3.078 1.00 0.00 C ATOM 293 C GLN A 15 -10.022 2.879 -1.869 1.00 0.00 C ATOM 294 O GLN A 15 -10.764 2.478 -0.973 1.00 0.00 O ATOM 295 CB GLN A 15 -8.558 1.039 -2.782 1.00 0.00 C ATOM 296 CG GLN A 15 -7.399 1.778 -2.111 1.00 0.00 C ATOM 297 CD GLN A 15 -7.200 1.296 -0.672 1.00 0.00 C ATOM 298 OE1 GLN A 15 -7.578 1.950 0.287 1.00 0.00 O ATOM 299 NE2 GLN A 15 -6.589 0.119 -0.575 1.00 0.00 N ATOM 0 H GLN A 15 -8.562 2.582 -4.724 1.00 0.00 H new ATOM 0 HA GLN A 15 -10.599 1.385 -3.289 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -8.902 0.232 -2.136 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -8.214 0.581 -3.709 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -6.484 1.620 -2.681 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -7.596 2.850 -2.115 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -6.299 -0.376 -1.418 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -6.411 -0.289 0.343 1.00 0.00 H new ATOM 308 N ILE A 16 -9.435 4.066 -1.883 1.00 0.00 N ATOM 309 CA ILE A 16 -9.634 5.012 -0.798 1.00 0.00 C ATOM 310 C ILE A 16 -11.054 5.575 -0.872 1.00 0.00 C ATOM 311 O ILE A 16 -11.796 5.529 0.108 1.00 0.00 O ATOM 312 CB ILE A 16 -8.545 6.086 -0.818 1.00 0.00 C ATOM 313 CG1 ILE A 16 -7.271 5.589 -0.132 1.00 0.00 C ATOM 314 CG2 ILE A 16 -9.052 7.393 -0.205 1.00 0.00 C ATOM 315 CD1 ILE A 16 -6.025 6.189 -0.787 1.00 0.00 C ATOM 0 H ILE A 16 -8.821 4.395 -2.628 1.00 0.00 H new ATOM 0 HA ILE A 16 -9.539 4.512 0.166 1.00 0.00 H new ATOM 0 HB ILE A 16 -8.291 6.294 -1.857 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -7.295 5.856 0.925 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -7.226 4.501 -0.185 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -8.258 8.139 -0.232 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -9.909 7.754 -0.774 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -9.351 7.218 0.829 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.134 5.819 -0.280 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -5.991 5.900 -1.837 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -6.061 7.276 -0.711 1.00 0.00 H new ATOM 327 N ARG A 17 -11.391 6.093 -2.045 1.00 0.00 N ATOM 328 CA ARG A 17 -12.709 6.664 -2.259 1.00 0.00 C ATOM 329 C ARG A 17 -13.792 5.695 -1.781 1.00 0.00 C ATOM 330 O ARG A 17 -14.591 6.033 -0.908 1.00 0.00 O ATOM 331 CB ARG A 17 -12.937 6.982 -3.739 1.00 0.00 C ATOM 332 CG ARG A 17 -14.287 7.671 -3.949 1.00 0.00 C ATOM 333 CD ARG A 17 -14.994 7.125 -5.192 1.00 0.00 C ATOM 334 NE ARG A 17 -15.185 8.207 -6.183 1.00 0.00 N ATOM 335 CZ ARG A 17 -16.068 8.153 -7.202 1.00 0.00 C ATOM 336 NH1 ARG A 17 -16.851 7.066 -7.373 1.00 0.00 N ATOM 337 NH2 ARG A 17 -16.156 9.178 -8.029 1.00 0.00 N ATOM 0 H ARG A 17 -10.774 6.129 -2.856 1.00 0.00 H new ATOM 0 HA ARG A 17 -12.766 7.589 -1.686 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.136 7.624 -4.104 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -12.899 6.062 -4.323 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.917 7.520 -3.072 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.138 8.746 -4.053 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -14.405 6.319 -5.630 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -15.959 6.701 -4.914 1.00 0.00 H new ATOM 0 HE ARG A 17 -14.613 9.047 -6.090 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -16.777 6.278 -6.729 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -17.516 7.033 -8.146 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -15.561 9.996 -7.893 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -16.819 9.152 -8.804 1.00 0.00 H new ATOM 349 N GLN A 18 -13.784 4.510 -2.372 1.00 0.00 N ATOM 350 CA GLN A 18 -14.756 3.489 -2.017 1.00 0.00 C ATOM 351 C GLN A 18 -14.739 3.243 -0.507 1.00 0.00 C ATOM 352 O GLN A 18 -15.791 3.105 0.115 1.00 0.00 O ATOM 353 CB GLN A 18 -14.496 2.193 -2.787 1.00 0.00 C ATOM 354 CG GLN A 18 -12.999 1.886 -2.854 1.00 0.00 C ATOM 355 CD GLN A 18 -12.699 0.496 -2.289 1.00 0.00 C ATOM 356 OE1 GLN A 18 -13.007 0.358 -1.002 1.00 0.00 O flip ATOM 357 NE2 GLN A 18 -12.218 -0.391 -2.974 1.00 0.00 N flip ATOM 0 H GLN A 18 -13.120 4.233 -3.095 1.00 0.00 H new ATOM 0 HA GLN A 18 -15.747 3.846 -2.296 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -15.019 1.368 -2.304 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -14.899 2.278 -3.796 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.658 1.944 -3.888 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -12.444 2.638 -2.293 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -12.005 -0.218 -3.956 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -12.029 -1.306 -2.564 1.00 0.00 H new ATOM 366 N ASP A 19 -13.533 3.194 0.039 1.00 0.00 N ATOM 367 CA ASP A 19 -13.365 2.967 1.464 1.00 0.00 C ATOM 368 C ASP A 19 -13.997 4.125 2.239 1.00 0.00 C ATOM 369 O ASP A 19 -14.538 3.928 3.325 1.00 0.00 O ATOM 370 CB ASP A 19 -11.884 2.899 1.840 1.00 0.00 C ATOM 371 CG ASP A 19 -11.398 1.525 2.306 1.00 0.00 C ATOM 372 OD1 ASP A 19 -11.999 0.902 3.194 1.00 0.00 O ATOM 373 OD2 ASP A 19 -10.340 1.090 1.709 1.00 0.00 O ATOM 0 H ASP A 19 -12.662 3.308 -0.480 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.844 2.020 1.713 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.291 3.204 0.978 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -11.692 3.623 2.631 1.00 0.00 H new ATOM 378 N ALA A 20 -13.907 5.308 1.649 1.00 0.00 N ATOM 379 CA ALA A 20 -14.463 6.498 2.270 1.00 0.00 C ATOM 380 C ALA A 20 -15.987 6.376 2.323 1.00 0.00 C ATOM 381 O ALA A 20 -16.597 6.619 3.363 1.00 0.00 O ATOM 382 CB ALA A 20 -14.004 7.738 1.501 1.00 0.00 C ATOM 0 H ALA A 20 -13.457 5.468 0.748 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.104 6.599 3.294 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.421 8.630 1.967 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.916 7.795 1.518 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -14.347 7.674 0.469 1.00 0.00 H new ATOM 388 N GLU A 21 -16.558 6.001 1.188 1.00 0.00 N ATOM 389 CA GLU A 21 -18.000 5.844 1.092 1.00 0.00 C ATOM 390 C GLU A 21 -18.489 4.806 2.104 1.00 0.00 C ATOM 391 O GLU A 21 -19.511 5.007 2.759 1.00 0.00 O ATOM 392 CB GLU A 21 -18.416 5.462 -0.330 1.00 0.00 C ATOM 393 CG GLU A 21 -17.530 6.157 -1.366 1.00 0.00 C ATOM 394 CD GLU A 21 -18.342 6.564 -2.598 1.00 0.00 C ATOM 395 OE1 GLU A 21 -19.571 6.400 -2.611 1.00 0.00 O ATOM 396 OE2 GLU A 21 -17.652 7.068 -3.564 1.00 0.00 O ATOM 0 H GLU A 21 -16.049 5.801 0.327 1.00 0.00 H new ATOM 0 HA GLU A 21 -18.467 6.800 1.327 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -18.348 4.381 -0.455 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -19.458 5.737 -0.494 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -17.069 7.039 -0.922 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -16.721 5.490 -1.664 1.00 0.00 H new ATOM 403 N ASN A 22 -17.738 3.719 2.199 1.00 0.00 N ATOM 404 CA ASN A 22 -18.083 2.650 3.120 1.00 0.00 C ATOM 405 C ASN A 22 -17.733 3.078 4.547 1.00 0.00 C ATOM 406 O ASN A 22 -18.446 2.744 5.492 1.00 0.00 O ATOM 407 CB ASN A 22 -17.299 1.375 2.803 1.00 0.00 C ATOM 408 CG ASN A 22 -17.471 0.335 3.912 1.00 0.00 C ATOM 409 OD1 ASN A 22 -16.765 0.591 5.009 1.00 0.00 O flip ATOM 410 ND2 ASN A 22 -18.198 -0.636 3.779 1.00 0.00 N flip ATOM 0 H ASN A 22 -16.892 3.556 1.653 1.00 0.00 H new ATOM 0 HA ASN A 22 -19.150 2.451 3.021 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -17.641 0.960 1.855 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -16.242 1.614 2.684 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -18.713 -0.772 2.909 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -18.291 -1.311 4.538 1.00 0.00 H new ATOM 417 N THR A 23 -16.635 3.811 4.658 1.00 0.00 N ATOM 418 CA THR A 23 -16.182 4.289 5.953 1.00 0.00 C ATOM 419 C THR A 23 -17.225 5.219 6.574 1.00 0.00 C ATOM 420 O THR A 23 -17.289 5.360 7.794 1.00 0.00 O ATOM 421 CB THR A 23 -14.815 4.950 5.761 1.00 0.00 C ATOM 422 OG1 THR A 23 -13.908 3.854 5.674 1.00 0.00 O ATOM 423 CG2 THR A 23 -14.356 5.716 7.003 1.00 0.00 C ATOM 0 H THR A 23 -16.046 4.086 3.872 1.00 0.00 H new ATOM 0 HA THR A 23 -16.066 3.467 6.659 1.00 0.00 H new ATOM 0 HB THR A 23 -14.857 5.630 4.910 1.00 0.00 H new ATOM 0 HG1 THR A 23 -14.028 3.397 4.815 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.381 6.165 6.814 1.00 0.00 H new ATOM 0 HG22 THR A 23 -15.078 6.499 7.235 1.00 0.00 H new ATOM 0 HG23 THR A 23 -14.281 5.030 7.847 1.00 0.00 H new ATOM 431 N TYR A 24 -18.017 5.831 5.705 1.00 0.00 N ATOM 432 CA TYR A 24 -19.055 6.744 6.153 1.00 0.00 C ATOM 433 C TYR A 24 -19.976 6.069 7.172 1.00 0.00 C ATOM 434 O TYR A 24 -20.079 6.517 8.313 1.00 0.00 O ATOM 435 CB TYR A 24 -19.868 7.102 4.907 1.00 0.00 C ATOM 436 CG TYR A 24 -20.194 8.592 4.784 1.00 0.00 C ATOM 437 CD1 TYR A 24 -19.254 9.536 5.147 1.00 0.00 C ATOM 438 CD2 TYR A 24 -21.426 8.992 4.310 1.00 0.00 C ATOM 439 CE1 TYR A 24 -19.561 10.938 5.031 1.00 0.00 C ATOM 440 CE2 TYR A 24 -21.733 10.394 4.194 1.00 0.00 C ATOM 441 CZ TYR A 24 -20.785 11.298 4.560 1.00 0.00 C ATOM 442 OH TYR A 24 -21.075 12.622 4.451 1.00 0.00 O ATOM 0 H TYR A 24 -17.961 5.712 4.693 1.00 0.00 H new ATOM 0 HA TYR A 24 -18.616 7.619 6.632 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -19.315 6.787 4.022 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -20.800 6.536 4.919 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -18.289 9.223 5.518 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -22.161 8.253 4.026 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.835 11.687 5.312 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -22.694 10.720 3.825 1.00 0.00 H new ATOM 0 HH TYR A 24 -21.505 12.932 5.275 1.00 0.00 H new ATOM 452 N LYS A 25 -20.623 5.004 6.723 1.00 0.00 N ATOM 453 CA LYS A 25 -21.532 4.263 7.581 1.00 0.00 C ATOM 454 C LYS A 25 -20.747 3.658 8.746 1.00 0.00 C ATOM 455 O LYS A 25 -21.292 3.463 9.832 1.00 0.00 O ATOM 456 CB LYS A 25 -22.317 3.232 6.767 1.00 0.00 C ATOM 457 CG LYS A 25 -21.374 2.337 5.961 1.00 0.00 C ATOM 458 CD LYS A 25 -21.226 2.848 4.526 1.00 0.00 C ATOM 459 CE LYS A 25 -21.404 1.710 3.518 1.00 0.00 C ATOM 460 NZ LYS A 25 -21.548 2.250 2.148 1.00 0.00 N ATOM 0 H LYS A 25 -20.536 4.636 5.776 1.00 0.00 H new ATOM 0 HA LYS A 25 -22.279 4.930 8.011 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -22.922 2.620 7.436 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -23.004 3.743 6.093 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -20.397 2.306 6.442 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -21.757 1.316 5.950 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -21.965 3.626 4.335 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -20.244 3.302 4.397 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -20.546 1.039 3.563 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -22.283 1.121 3.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -21.217 1.544 1.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -22.548 2.470 1.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -20.980 3.116 2.055 1.00 0.00 H new ATOM 473 N SER A 26 -19.480 3.378 8.482 1.00 0.00 N ATOM 474 CA SER A 26 -18.614 2.799 9.496 1.00 0.00 C ATOM 475 C SER A 26 -18.305 3.838 10.576 1.00 0.00 C ATOM 476 O SER A 26 -18.240 3.508 11.759 1.00 0.00 O ATOM 477 CB SER A 26 -17.317 2.274 8.878 1.00 0.00 C ATOM 478 OG SER A 26 -17.133 0.882 9.125 1.00 0.00 O ATOM 0 H SER A 26 -19.031 3.541 7.581 1.00 0.00 H new ATOM 0 HA SER A 26 -19.135 1.956 9.950 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.329 2.453 7.803 1.00 0.00 H new ATOM 0 HB3 SER A 26 -16.471 2.829 9.284 1.00 0.00 H new ATOM 0 HG SER A 26 -16.295 0.585 8.713 1.00 0.00 H new ATOM 484 N ASN A 27 -18.124 5.072 10.130 1.00 0.00 N ATOM 485 CA ASN A 27 -17.824 6.161 11.043 1.00 0.00 C ATOM 486 C ASN A 27 -17.926 7.492 10.295 1.00 0.00 C ATOM 487 O ASN A 27 -16.922 8.020 9.820 1.00 0.00 O ATOM 488 CB ASN A 27 -16.403 6.039 11.598 1.00 0.00 C ATOM 489 CG ASN A 27 -16.373 6.332 13.099 1.00 0.00 C ATOM 490 OD1 ASN A 27 -16.633 5.478 13.930 1.00 0.00 O ATOM 491 ND2 ASN A 27 -16.043 7.585 13.399 1.00 0.00 N ATOM 0 H ASN A 27 -18.179 5.342 9.148 1.00 0.00 H new ATOM 0 HA ASN A 27 -18.538 6.117 11.865 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -16.021 5.035 11.412 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -15.744 6.732 11.075 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -15.996 7.880 14.374 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -15.837 8.250 12.654 1.00 0.00 H new ATOM 498 N PRO A 28 -19.181 8.009 10.211 1.00 0.00 N ATOM 499 CA PRO A 28 -19.428 9.268 9.529 1.00 0.00 C ATOM 500 C PRO A 28 -18.959 10.452 10.377 1.00 0.00 C ATOM 501 O PRO A 28 -19.073 11.603 9.959 1.00 0.00 O ATOM 502 CB PRO A 28 -20.924 9.284 9.262 1.00 0.00 C ATOM 503 CG PRO A 28 -21.527 8.260 10.209 1.00 0.00 C ATOM 504 CD PRO A 28 -20.394 7.412 10.762 1.00 0.00 C ATOM 0 HA PRO A 28 -18.870 9.358 8.597 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -21.342 10.275 9.440 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -21.138 9.030 8.224 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -22.062 8.757 11.018 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -22.251 7.635 9.685 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -20.383 7.428 11.852 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -20.495 6.370 10.459 1.00 0.00 H new ATOM 512 N LEU A 29 -18.441 10.129 11.553 1.00 0.00 N ATOM 513 CA LEU A 29 -17.954 11.151 12.463 1.00 0.00 C ATOM 514 C LEU A 29 -16.463 11.384 12.211 1.00 0.00 C ATOM 515 O LEU A 29 -15.930 12.440 12.549 1.00 0.00 O ATOM 516 CB LEU A 29 -18.282 10.781 13.911 1.00 0.00 C ATOM 517 CG LEU A 29 -19.664 11.202 14.414 1.00 0.00 C ATOM 518 CD1 LEU A 29 -19.743 11.112 15.939 1.00 0.00 C ATOM 519 CD2 LEU A 29 -20.033 12.596 13.902 1.00 0.00 C ATOM 0 H LEU A 29 -18.348 9.173 11.897 1.00 0.00 H new ATOM 0 HA LEU A 29 -18.461 12.098 12.278 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -18.192 9.700 14.018 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -17.529 11.229 14.559 1.00 0.00 H new ATOM 0 HG LEU A 29 -20.400 10.506 14.012 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -20.736 11.417 16.271 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -19.555 10.085 16.253 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -18.995 11.770 16.382 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -21.020 12.871 14.274 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -19.298 13.319 14.254 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -20.044 12.592 12.812 1.00 0.00 H new ATOM 531 N ASP A 30 -15.832 10.382 11.618 1.00 0.00 N ATOM 532 CA ASP A 30 -14.413 10.464 11.316 1.00 0.00 C ATOM 533 C ASP A 30 -14.184 11.534 10.248 1.00 0.00 C ATOM 534 O ASP A 30 -14.353 11.274 9.057 1.00 0.00 O ATOM 535 CB ASP A 30 -13.887 9.134 10.773 1.00 0.00 C ATOM 536 CG ASP A 30 -12.527 8.702 11.326 1.00 0.00 C ATOM 537 OD1 ASP A 30 -11.572 9.551 11.149 1.00 0.00 O ATOM 538 OD2 ASP A 30 -12.387 7.610 11.897 1.00 0.00 O ATOM 0 H ASP A 30 -16.277 9.508 11.338 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.886 10.710 12.238 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.616 8.355 10.994 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.815 9.205 9.688 1.00 0.00 H new ATOM 543 N ALA A 31 -13.803 12.716 10.711 1.00 0.00 N ATOM 544 CA ALA A 31 -13.550 13.827 9.809 1.00 0.00 C ATOM 545 C ALA A 31 -12.251 13.570 9.043 1.00 0.00 C ATOM 546 O ALA A 31 -12.036 14.134 7.972 1.00 0.00 O ATOM 547 CB ALA A 31 -13.508 15.132 10.606 1.00 0.00 C ATOM 0 H ALA A 31 -13.663 12.928 11.699 1.00 0.00 H new ATOM 0 HA ALA A 31 -14.352 13.918 9.077 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -13.318 15.965 9.930 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.464 15.283 11.108 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -12.712 15.079 11.349 1.00 0.00 H new ATOM 553 N ASP A 32 -11.418 12.717 9.622 1.00 0.00 N ATOM 554 CA ASP A 32 -10.146 12.378 9.007 1.00 0.00 C ATOM 555 C ASP A 32 -10.402 11.629 7.697 1.00 0.00 C ATOM 556 O ASP A 32 -9.876 12.005 6.650 1.00 0.00 O ATOM 557 CB ASP A 32 -9.319 11.468 9.918 1.00 0.00 C ATOM 558 CG ASP A 32 -7.910 11.155 9.411 1.00 0.00 C ATOM 559 OD1 ASP A 32 -7.007 12.003 9.468 1.00 0.00 O ATOM 560 OD2 ASP A 32 -7.754 9.966 8.935 1.00 0.00 O ATOM 0 H ASP A 32 -11.600 12.251 10.511 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.599 13.304 8.830 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.240 11.936 10.899 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.857 10.530 10.054 1.00 0.00 H new ATOM 565 N ASN A 33 -11.209 10.583 7.798 1.00 0.00 N ATOM 566 CA ASN A 33 -11.540 9.778 6.635 1.00 0.00 C ATOM 567 C ASN A 33 -12.428 10.594 5.692 1.00 0.00 C ATOM 568 O ASN A 33 -12.334 10.458 4.473 1.00 0.00 O ATOM 569 CB ASN A 33 -12.309 8.519 7.037 1.00 0.00 C ATOM 570 CG ASN A 33 -11.534 7.257 6.653 1.00 0.00 C ATOM 571 OD1 ASN A 33 -10.756 6.717 7.422 1.00 0.00 O ATOM 572 ND2 ASN A 33 -11.790 6.819 5.423 1.00 0.00 N ATOM 0 H ASN A 33 -11.643 10.274 8.668 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.608 9.491 6.147 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -12.489 8.526 8.112 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -13.284 8.513 6.550 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.323 5.983 5.072 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -12.453 7.319 4.831 1.00 0.00 H new ATOM 579 N LEU A 34 -13.269 11.422 6.293 1.00 0.00 N ATOM 580 CA LEU A 34 -14.173 12.259 5.522 1.00 0.00 C ATOM 581 C LEU A 34 -13.361 13.288 4.734 1.00 0.00 C ATOM 582 O LEU A 34 -13.718 13.636 3.609 1.00 0.00 O ATOM 583 CB LEU A 34 -15.235 12.880 6.432 1.00 0.00 C ATOM 584 CG LEU A 34 -16.685 12.736 5.966 1.00 0.00 C ATOM 585 CD1 LEU A 34 -17.657 13.252 7.030 1.00 0.00 C ATOM 586 CD2 LEU A 34 -16.898 13.422 4.615 1.00 0.00 C ATOM 0 H LEU A 34 -13.344 11.532 7.304 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.720 11.659 4.795 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.146 12.430 7.421 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -15.014 13.941 6.543 1.00 0.00 H new ATOM 0 HG LEU A 34 -16.894 11.676 5.825 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -18.681 13.138 6.673 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.527 12.681 7.949 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -17.456 14.305 7.226 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.937 13.304 4.307 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -16.664 14.483 4.705 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -16.245 12.968 3.870 1.00 0.00 H new ATOM 598 N THR A 35 -12.284 13.747 5.354 1.00 0.00 N ATOM 599 CA THR A 35 -11.418 14.729 4.724 1.00 0.00 C ATOM 600 C THR A 35 -10.605 14.081 3.602 1.00 0.00 C ATOM 601 O THR A 35 -10.396 14.686 2.552 1.00 0.00 O ATOM 602 CB THR A 35 -10.552 15.363 5.814 1.00 0.00 C ATOM 603 OG1 THR A 35 -11.417 16.307 6.440 1.00 0.00 O ATOM 604 CG2 THR A 35 -9.422 16.219 5.239 1.00 0.00 C ATOM 0 H THR A 35 -11.991 13.457 6.287 1.00 0.00 H new ATOM 0 HA THR A 35 -11.997 15.520 4.248 1.00 0.00 H new ATOM 0 HB THR A 35 -10.131 14.580 6.444 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.813 15.906 7.242 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.838 16.646 6.054 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.777 15.599 4.616 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.845 17.023 4.636 1.00 0.00 H new ATOM 612 N ARG A 36 -10.168 12.857 3.862 1.00 0.00 N ATOM 613 CA ARG A 36 -9.383 12.120 2.887 1.00 0.00 C ATOM 614 C ARG A 36 -10.259 11.705 1.704 1.00 0.00 C ATOM 615 O ARG A 36 -9.751 11.409 0.624 1.00 0.00 O ATOM 616 CB ARG A 36 -8.758 10.872 3.513 1.00 0.00 C ATOM 617 CG ARG A 36 -9.546 9.616 3.135 1.00 0.00 C ATOM 618 CD ARG A 36 -9.043 8.398 3.914 1.00 0.00 C ATOM 619 NE ARG A 36 -9.651 7.163 3.370 1.00 0.00 N ATOM 620 CZ ARG A 36 -9.100 5.936 3.482 1.00 0.00 C ATOM 621 NH1 ARG A 36 -7.923 5.769 4.122 1.00 0.00 N ATOM 622 NH2 ARG A 36 -9.730 4.901 2.957 1.00 0.00 N ATOM 0 H ARG A 36 -10.343 12.358 4.734 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.585 12.776 2.539 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -7.725 10.772 3.179 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -8.734 10.978 4.598 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -10.605 9.771 3.340 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.452 9.432 2.065 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -7.957 8.338 3.849 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -9.294 8.502 4.970 1.00 0.00 H new ATOM 0 HE ARG A 36 -10.542 7.244 2.880 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -7.443 6.574 4.525 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -7.514 4.838 4.202 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -10.619 5.036 2.476 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -9.327 3.967 3.033 1.00 0.00 H new ATOM 634 N TRP A 37 -11.561 11.696 1.948 1.00 0.00 N ATOM 635 CA TRP A 37 -12.514 11.321 0.916 1.00 0.00 C ATOM 636 C TRP A 37 -12.485 12.400 -0.168 1.00 0.00 C ATOM 637 O TRP A 37 -12.781 12.125 -1.330 1.00 0.00 O ATOM 638 CB TRP A 37 -13.908 11.106 1.508 1.00 0.00 C ATOM 639 CG TRP A 37 -14.888 10.415 0.558 1.00 0.00 C ATOM 640 CD1 TRP A 37 -14.679 10.034 -0.709 1.00 0.00 C ATOM 641 CD2 TRP A 37 -16.249 10.035 0.854 1.00 0.00 C ATOM 642 NE1 TRP A 37 -15.800 9.439 -1.251 1.00 0.00 N ATOM 643 CE2 TRP A 37 -16.785 9.440 -0.270 1.00 0.00 C ATOM 644 CE3 TRP A 37 -17.001 10.190 2.031 1.00 0.00 C ATOM 645 CZ2 TRP A 37 -18.096 8.952 -0.327 1.00 0.00 C ATOM 646 CZ3 TRP A 37 -18.309 9.697 1.958 1.00 0.00 C ATOM 647 CH2 TRP A 37 -18.864 9.095 0.835 1.00 0.00 C ATOM 0 H TRP A 37 -11.979 11.942 2.845 1.00 0.00 H new ATOM 0 HA TRP A 37 -12.239 10.367 0.466 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -13.818 10.511 2.417 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -14.321 12.072 1.800 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -13.749 10.175 -1.240 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -15.889 9.067 -2.197 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -16.601 10.653 2.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -18.493 8.490 -1.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -18.931 9.791 2.836 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -19.883 8.739 0.859 1.00 0.00 H new ATOM 658 N GLY A 38 -12.124 13.604 0.249 1.00 0.00 N ATOM 659 CA GLY A 38 -12.052 14.726 -0.672 1.00 0.00 C ATOM 660 C GLY A 38 -10.689 14.780 -1.364 1.00 0.00 C ATOM 661 O GLY A 38 -10.605 14.689 -2.587 1.00 0.00 O ATOM 0 H GLY A 38 -11.878 13.828 1.213 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -12.840 14.639 -1.420 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -12.227 15.656 -0.132 1.00 0.00 H new ATOM 665 N GLY A 39 -9.654 14.930 -0.550 1.00 0.00 N ATOM 666 CA GLY A 39 -8.298 14.998 -1.068 1.00 0.00 C ATOM 667 C GLY A 39 -8.099 14.005 -2.215 1.00 0.00 C ATOM 668 O GLY A 39 -7.469 14.330 -3.220 1.00 0.00 O ATOM 0 H GLY A 39 -9.727 15.006 0.464 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.088 16.009 -1.417 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.588 14.783 -0.269 1.00 0.00 H new ATOM 672 N VAL A 40 -8.649 12.814 -2.026 1.00 0.00 N ATOM 673 CA VAL A 40 -8.539 11.771 -3.033 1.00 0.00 C ATOM 674 C VAL A 40 -9.334 12.182 -4.274 1.00 0.00 C ATOM 675 O VAL A 40 -8.815 12.141 -5.389 1.00 0.00 O ATOM 676 CB VAL A 40 -8.992 10.431 -2.449 1.00 0.00 C ATOM 677 CG1 VAL A 40 -10.516 10.370 -2.333 1.00 0.00 C ATOM 678 CG2 VAL A 40 -8.458 9.263 -3.280 1.00 0.00 C ATOM 0 H VAL A 40 -9.172 12.548 -1.191 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.501 11.642 -3.339 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.577 10.346 -1.445 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.811 9.407 -1.915 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.864 11.171 -1.680 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.961 10.488 -3.321 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.794 8.322 -2.844 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -8.830 9.343 -4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.368 9.290 -3.288 1.00 0.00 H new ATOM 688 N LEU A 41 -10.580 12.567 -4.040 1.00 0.00 N ATOM 689 CA LEU A 41 -11.451 12.983 -5.125 1.00 0.00 C ATOM 690 C LEU A 41 -10.745 14.056 -5.957 1.00 0.00 C ATOM 691 O LEU A 41 -10.803 14.031 -7.186 1.00 0.00 O ATOM 692 CB LEU A 41 -12.811 13.424 -4.581 1.00 0.00 C ATOM 693 CG LEU A 41 -13.761 12.301 -4.160 1.00 0.00 C ATOM 694 CD1 LEU A 41 -15.032 12.868 -3.523 1.00 0.00 C ATOM 695 CD2 LEU A 41 -14.074 11.377 -5.339 1.00 0.00 C ATOM 0 H LEU A 41 -11.007 12.599 -3.114 1.00 0.00 H new ATOM 0 HA LEU A 41 -11.656 12.145 -5.791 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -12.643 14.073 -3.721 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -13.307 14.026 -5.342 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.262 11.698 -3.402 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -15.690 12.049 -3.233 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -14.768 13.451 -2.641 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -15.544 13.508 -4.241 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.751 10.588 -5.013 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -14.544 11.952 -6.137 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -13.150 10.933 -5.708 1.00 0.00 H new ATOM 707 N LEU A 42 -10.094 14.971 -5.255 1.00 0.00 N ATOM 708 CA LEU A 42 -9.377 16.050 -5.914 1.00 0.00 C ATOM 709 C LEU A 42 -8.210 15.467 -6.714 1.00 0.00 C ATOM 710 O LEU A 42 -7.875 15.970 -7.785 1.00 0.00 O ATOM 711 CB LEU A 42 -8.955 17.112 -4.897 1.00 0.00 C ATOM 712 CG LEU A 42 -10.039 17.574 -3.920 1.00 0.00 C ATOM 713 CD1 LEU A 42 -9.458 18.511 -2.859 1.00 0.00 C ATOM 714 CD2 LEU A 42 -11.213 18.211 -4.666 1.00 0.00 C ATOM 0 H LEU A 42 -10.048 14.988 -4.236 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.027 16.562 -6.624 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.117 16.721 -4.320 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.589 17.983 -5.441 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.425 16.698 -3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.249 18.824 -2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.682 17.989 -2.299 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.028 19.388 -3.344 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.969 18.531 -3.949 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.860 19.074 -5.230 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.647 17.483 -5.351 1.00 0.00 H new ATOM 726 N GLU A 43 -7.623 14.415 -6.163 1.00 0.00 N ATOM 727 CA GLU A 43 -6.501 13.759 -6.811 1.00 0.00 C ATOM 728 C GLU A 43 -6.950 13.114 -8.125 1.00 0.00 C ATOM 729 O GLU A 43 -6.412 13.423 -9.187 1.00 0.00 O ATOM 730 CB GLU A 43 -5.860 12.724 -5.884 1.00 0.00 C ATOM 731 CG GLU A 43 -5.060 13.405 -4.772 1.00 0.00 C ATOM 732 CD GLU A 43 -3.693 13.866 -5.283 1.00 0.00 C ATOM 733 OE1 GLU A 43 -3.508 14.028 -6.498 1.00 0.00 O ATOM 734 OE2 GLU A 43 -2.806 14.058 -4.367 1.00 0.00 O ATOM 0 H GLU A 43 -7.904 14.001 -5.274 1.00 0.00 H new ATOM 0 HA GLU A 43 -5.746 14.512 -7.037 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -6.634 12.094 -5.446 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -5.205 12.071 -6.460 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.617 14.261 -4.390 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -4.927 12.714 -3.939 1.00 0.00 H new ATOM 741 N LEU A 44 -7.931 12.232 -8.009 1.00 0.00 N ATOM 742 CA LEU A 44 -8.459 11.542 -9.174 1.00 0.00 C ATOM 743 C LEU A 44 -8.848 12.570 -10.238 1.00 0.00 C ATOM 744 O LEU A 44 -8.795 12.283 -11.432 1.00 0.00 O ATOM 745 CB LEU A 44 -9.604 10.610 -8.772 1.00 0.00 C ATOM 746 CG LEU A 44 -9.193 9.244 -8.218 1.00 0.00 C ATOM 747 CD1 LEU A 44 -10.375 8.552 -7.534 1.00 0.00 C ATOM 748 CD2 LEU A 44 -8.574 8.372 -9.312 1.00 0.00 C ATOM 0 H LEU A 44 -8.375 11.979 -7.126 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.696 10.900 -9.614 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -10.212 11.116 -8.022 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.239 10.451 -9.643 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.427 9.400 -7.459 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -10.056 7.583 -7.149 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -10.732 9.170 -6.710 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -11.180 8.409 -8.255 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.291 7.407 -8.891 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.300 8.221 -10.111 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.690 8.866 -9.714 1.00 0.00 H new ATOM 760 N SER A 45 -9.230 13.748 -9.765 1.00 0.00 N ATOM 761 CA SER A 45 -9.629 14.820 -10.661 1.00 0.00 C ATOM 762 C SER A 45 -8.504 15.117 -11.654 1.00 0.00 C ATOM 763 O SER A 45 -8.730 15.756 -12.681 1.00 0.00 O ATOM 764 CB SER A 45 -9.994 16.084 -9.879 1.00 0.00 C ATOM 765 OG SER A 45 -11.355 16.457 -10.074 1.00 0.00 O ATOM 0 H SER A 45 -9.271 13.983 -8.773 1.00 0.00 H new ATOM 0 HA SER A 45 -10.514 14.496 -11.210 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.812 15.919 -8.817 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.345 16.903 -10.190 1.00 0.00 H new ATOM 0 HG SER A 45 -11.549 17.267 -9.557 1.00 0.00 H new ATOM 771 N GLN A 46 -7.315 14.640 -11.313 1.00 0.00 N ATOM 772 CA GLN A 46 -6.154 14.847 -12.162 1.00 0.00 C ATOM 773 C GLN A 46 -6.302 14.057 -13.464 1.00 0.00 C ATOM 774 O GLN A 46 -5.488 14.198 -14.375 1.00 0.00 O ATOM 775 CB GLN A 46 -4.866 14.464 -11.432 1.00 0.00 C ATOM 776 CG GLN A 46 -4.611 12.958 -11.522 1.00 0.00 C ATOM 777 CD GLN A 46 -3.343 12.570 -10.758 1.00 0.00 C ATOM 778 OE1 GLN A 46 -2.334 12.193 -11.330 1.00 0.00 O ATOM 779 NE2 GLN A 46 -3.452 12.682 -9.438 1.00 0.00 N ATOM 0 H GLN A 46 -7.131 14.111 -10.460 1.00 0.00 H new ATOM 0 HA GLN A 46 -6.092 15.907 -12.408 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -4.024 15.005 -11.864 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -4.934 14.763 -10.386 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -5.465 12.416 -11.116 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -4.515 12.664 -12.567 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -4.327 13.004 -9.024 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -2.661 12.446 -8.839 1.00 0.00 H new ATOM 788 N PHE A 47 -7.347 13.244 -13.511 1.00 0.00 N ATOM 789 CA PHE A 47 -7.611 12.432 -14.686 1.00 0.00 C ATOM 790 C PHE A 47 -9.084 12.020 -14.748 1.00 0.00 C ATOM 791 O PHE A 47 -9.432 11.047 -15.415 1.00 0.00 O ATOM 792 CB PHE A 47 -6.747 11.175 -14.565 1.00 0.00 C ATOM 793 CG PHE A 47 -7.539 9.903 -14.255 1.00 0.00 C ATOM 794 CD1 PHE A 47 -7.976 9.666 -12.989 1.00 0.00 C ATOM 795 CD2 PHE A 47 -7.807 9.010 -15.245 1.00 0.00 C ATOM 796 CE1 PHE A 47 -8.711 8.485 -12.700 1.00 0.00 C ATOM 797 CE2 PHE A 47 -8.542 7.830 -14.957 1.00 0.00 C ATOM 798 CZ PHE A 47 -8.978 7.592 -13.690 1.00 0.00 C ATOM 0 H PHE A 47 -8.021 13.130 -12.754 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.381 12.998 -15.589 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -6.199 11.032 -15.497 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -6.006 11.330 -13.780 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -7.764 10.376 -12.203 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -7.461 9.198 -16.250 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.057 8.297 -11.695 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -8.755 7.121 -15.743 1.00 0.00 H new ATOM 0 HZ PHE A 47 -9.536 6.694 -13.471 1.00 0.00 H new ATOM 808 N HIS A 48 -9.908 12.781 -14.044 1.00 0.00 N ATOM 809 CA HIS A 48 -11.335 12.508 -14.011 1.00 0.00 C ATOM 810 C HIS A 48 -12.081 13.582 -14.804 1.00 0.00 C ATOM 811 O HIS A 48 -13.089 14.114 -14.340 1.00 0.00 O ATOM 812 CB HIS A 48 -11.831 12.384 -12.569 1.00 0.00 C ATOM 813 CG HIS A 48 -12.155 10.970 -12.150 1.00 0.00 C ATOM 814 ND1 HIS A 48 -13.443 10.463 -12.154 1.00 0.00 N ATOM 815 CD2 HIS A 48 -11.345 9.961 -11.716 1.00 0.00 C ATOM 816 CE1 HIS A 48 -13.399 9.206 -11.738 1.00 0.00 C ATOM 817 NE2 HIS A 48 -12.098 8.897 -11.467 1.00 0.00 N ATOM 0 H HIS A 48 -9.615 13.587 -13.492 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.537 11.548 -14.487 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -11.071 12.786 -11.899 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -12.721 13.001 -12.448 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -10.273 10.019 -11.596 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -14.244 8.542 -11.632 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -11.760 7.996 -11.129 1.00 0.00 H new ATOM 825 N SER A 49 -11.558 13.870 -15.987 1.00 0.00 N ATOM 826 CA SER A 49 -12.163 14.871 -16.849 1.00 0.00 C ATOM 827 C SER A 49 -12.614 16.073 -16.018 1.00 0.00 C ATOM 828 O SER A 49 -12.345 16.141 -14.820 1.00 0.00 O ATOM 829 CB SER A 49 -13.345 14.288 -17.625 1.00 0.00 C ATOM 830 OG SER A 49 -12.931 13.309 -18.575 1.00 0.00 O ATOM 0 H SER A 49 -10.722 13.428 -16.369 1.00 0.00 H new ATOM 0 HA SER A 49 -11.415 15.197 -17.572 1.00 0.00 H new ATOM 0 HB2 SER A 49 -14.051 13.839 -16.926 1.00 0.00 H new ATOM 0 HB3 SER A 49 -13.873 15.091 -18.139 1.00 0.00 H new ATOM 0 HG SER A 49 -13.715 12.960 -19.048 1.00 0.00 H new ATOM 836 N ILE A 50 -13.294 16.993 -16.688 1.00 0.00 N ATOM 837 CA ILE A 50 -13.785 18.190 -16.026 1.00 0.00 C ATOM 838 C ILE A 50 -15.111 17.875 -15.331 1.00 0.00 C ATOM 839 O ILE A 50 -15.268 18.134 -14.139 1.00 0.00 O ATOM 840 CB ILE A 50 -13.871 19.353 -17.016 1.00 0.00 C ATOM 841 CG1 ILE A 50 -12.803 20.407 -16.718 1.00 0.00 C ATOM 842 CG2 ILE A 50 -15.279 19.952 -17.037 1.00 0.00 C ATOM 843 CD1 ILE A 50 -11.623 20.281 -17.684 1.00 0.00 C ATOM 0 H ILE A 50 -13.516 16.933 -17.682 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.087 18.511 -15.253 1.00 0.00 H new ATOM 0 HB ILE A 50 -13.671 18.967 -18.015 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.238 21.403 -16.798 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.452 20.294 -15.692 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -15.313 20.777 -17.749 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -15.996 19.186 -17.334 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -15.533 20.320 -16.043 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -10.878 21.042 -17.450 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -11.175 19.292 -17.584 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -11.974 20.419 -18.707 1.00 0.00 H new ATOM 855 N SER A 51 -16.031 17.319 -16.105 1.00 0.00 N ATOM 856 CA SER A 51 -17.339 16.967 -15.579 1.00 0.00 C ATOM 857 C SER A 51 -17.183 16.132 -14.306 1.00 0.00 C ATOM 858 O SER A 51 -17.693 16.502 -13.250 1.00 0.00 O ATOM 859 CB SER A 51 -18.163 16.202 -16.617 1.00 0.00 C ATOM 860 OG SER A 51 -17.559 14.960 -16.968 1.00 0.00 O ATOM 0 H SER A 51 -15.897 17.103 -17.093 1.00 0.00 H new ATOM 0 HA SER A 51 -17.871 17.888 -15.340 1.00 0.00 H new ATOM 0 HB2 SER A 51 -19.163 16.020 -16.224 1.00 0.00 H new ATOM 0 HB3 SER A 51 -18.279 16.815 -17.511 1.00 0.00 H new ATOM 0 HG SER A 51 -18.116 14.501 -17.631 1.00 0.00 H new ATOM 866 N ASP A 52 -16.475 15.021 -14.448 1.00 0.00 N ATOM 867 CA ASP A 52 -16.245 14.131 -13.323 1.00 0.00 C ATOM 868 C ASP A 52 -15.456 14.874 -12.243 1.00 0.00 C ATOM 869 O ASP A 52 -15.629 14.613 -11.053 1.00 0.00 O ATOM 870 CB ASP A 52 -15.429 12.907 -13.746 1.00 0.00 C ATOM 871 CG ASP A 52 -16.218 11.598 -13.818 1.00 0.00 C ATOM 872 OD1 ASP A 52 -16.831 11.391 -14.934 1.00 0.00 O ATOM 873 OD2 ASP A 52 -16.245 10.816 -12.856 1.00 0.00 O ATOM 0 H ASP A 52 -16.053 14.717 -15.325 1.00 0.00 H new ATOM 0 HA ASP A 52 -17.215 13.806 -12.947 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -14.989 13.103 -14.724 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -14.604 12.779 -13.045 1.00 0.00 H new ATOM 878 N ALA A 53 -14.608 15.785 -12.696 1.00 0.00 N ATOM 879 CA ALA A 53 -13.793 16.568 -11.783 1.00 0.00 C ATOM 880 C ALA A 53 -14.697 17.483 -10.956 1.00 0.00 C ATOM 881 O ALA A 53 -14.546 17.575 -9.738 1.00 0.00 O ATOM 882 CB ALA A 53 -12.743 17.349 -12.577 1.00 0.00 C ATOM 0 H ALA A 53 -14.467 15.999 -13.683 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.260 15.917 -11.090 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.132 17.936 -11.892 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.108 16.652 -13.124 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.241 18.015 -13.281 1.00 0.00 H new ATOM 888 N LYS A 54 -15.617 18.137 -11.649 1.00 0.00 N ATOM 889 CA LYS A 54 -16.546 19.042 -10.993 1.00 0.00 C ATOM 890 C LYS A 54 -17.405 18.255 -10.002 1.00 0.00 C ATOM 891 O LYS A 54 -17.402 18.545 -8.807 1.00 0.00 O ATOM 892 CB LYS A 54 -17.360 19.819 -12.031 1.00 0.00 C ATOM 893 CG LYS A 54 -16.447 20.656 -12.929 1.00 0.00 C ATOM 894 CD LYS A 54 -17.087 20.885 -14.300 1.00 0.00 C ATOM 895 CE LYS A 54 -18.510 21.428 -14.156 1.00 0.00 C ATOM 896 NZ LYS A 54 -19.074 21.761 -15.483 1.00 0.00 N ATOM 0 H LYS A 54 -15.739 18.058 -12.659 1.00 0.00 H new ATOM 0 HA LYS A 54 -16.004 19.793 -10.419 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -17.937 19.124 -12.640 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -18.074 20.469 -11.526 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -16.244 21.616 -12.454 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -15.489 20.151 -13.051 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -16.483 21.586 -14.875 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -17.106 19.949 -14.858 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -19.140 20.688 -13.662 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -18.505 22.316 -13.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -20.040 22.128 -15.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -18.482 22.483 -15.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -19.097 20.906 -16.075 1.00 0.00 H new ATOM 909 N GLN A 55 -18.118 17.274 -10.535 1.00 0.00 N ATOM 910 CA GLN A 55 -18.980 16.443 -9.712 1.00 0.00 C ATOM 911 C GLN A 55 -18.188 15.851 -8.544 1.00 0.00 C ATOM 912 O GLN A 55 -18.715 15.709 -7.441 1.00 0.00 O ATOM 913 CB GLN A 55 -19.635 15.339 -10.545 1.00 0.00 C ATOM 914 CG GLN A 55 -18.753 14.090 -10.591 1.00 0.00 C ATOM 915 CD GLN A 55 -19.075 13.148 -9.430 1.00 0.00 C ATOM 916 OE1 GLN A 55 -19.332 13.563 -8.312 1.00 0.00 O ATOM 917 NE2 GLN A 55 -19.047 11.858 -9.756 1.00 0.00 N ATOM 0 H GLN A 55 -18.116 17.036 -11.527 1.00 0.00 H new ATOM 0 HA GLN A 55 -19.776 17.068 -9.307 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -20.607 15.087 -10.121 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -19.813 15.700 -11.558 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -18.902 13.570 -11.538 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -17.703 14.380 -10.548 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -18.824 11.578 -10.711 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -19.248 11.149 -9.051 1.00 0.00 H new ATOM 926 N MET A 56 -16.936 15.523 -8.825 1.00 0.00 N ATOM 927 CA MET A 56 -16.067 14.950 -7.812 1.00 0.00 C ATOM 928 C MET A 56 -15.679 15.998 -6.766 1.00 0.00 C ATOM 929 O MET A 56 -15.572 15.688 -5.581 1.00 0.00 O ATOM 930 CB MET A 56 -14.803 14.399 -8.475 1.00 0.00 C ATOM 931 CG MET A 56 -15.049 13.002 -9.048 1.00 0.00 C ATOM 932 SD MET A 56 -13.676 12.514 -10.079 1.00 0.00 S ATOM 933 CE MET A 56 -12.524 11.976 -8.826 1.00 0.00 C ATOM 0 H MET A 56 -16.502 15.643 -9.740 1.00 0.00 H new ATOM 0 HA MET A 56 -16.606 14.145 -7.311 1.00 0.00 H new ATOM 0 HB2 MET A 56 -14.483 15.071 -9.271 1.00 0.00 H new ATOM 0 HB3 MET A 56 -13.993 14.360 -7.746 1.00 0.00 H new ATOM 0 HG2 MET A 56 -15.178 12.285 -8.237 1.00 0.00 H new ATOM 0 HG3 MET A 56 -15.971 12.996 -9.629 1.00 0.00 H new ATOM 0 HE1 MET A 56 -11.551 12.434 -9.006 1.00 0.00 H new ATOM 0 HE2 MET A 56 -12.890 12.274 -7.843 1.00 0.00 H new ATOM 0 HE3 MET A 56 -12.427 10.891 -8.863 1.00 0.00 H new ATOM 943 N ILE A 57 -15.479 17.218 -7.243 1.00 0.00 N ATOM 944 CA ILE A 57 -15.105 18.313 -6.365 1.00 0.00 C ATOM 945 C ILE A 57 -16.307 18.702 -5.502 1.00 0.00 C ATOM 946 O ILE A 57 -16.199 18.776 -4.279 1.00 0.00 O ATOM 947 CB ILE A 57 -14.528 19.476 -7.174 1.00 0.00 C ATOM 948 CG1 ILE A 57 -13.137 19.134 -7.711 1.00 0.00 C ATOM 949 CG2 ILE A 57 -14.524 20.767 -6.353 1.00 0.00 C ATOM 950 CD1 ILE A 57 -12.921 19.737 -9.100 1.00 0.00 C ATOM 0 H ILE A 57 -15.569 17.472 -8.227 1.00 0.00 H new ATOM 0 HA ILE A 57 -14.311 18.002 -5.686 1.00 0.00 H new ATOM 0 HB ILE A 57 -15.173 19.645 -8.036 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -12.377 19.509 -7.026 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -13.018 18.052 -7.758 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -14.109 21.578 -6.952 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -15.544 21.016 -6.062 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -13.916 20.628 -5.459 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -11.924 19.479 -9.458 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -13.668 19.341 -9.789 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -13.017 20.821 -9.045 1.00 0.00 H new ATOM 962 N GLN A 58 -17.425 18.938 -6.172 1.00 0.00 N ATOM 963 CA GLN A 58 -18.646 19.317 -5.481 1.00 0.00 C ATOM 964 C GLN A 58 -18.864 18.422 -4.259 1.00 0.00 C ATOM 965 O GLN A 58 -19.026 18.916 -3.145 1.00 0.00 O ATOM 966 CB GLN A 58 -19.850 19.260 -6.424 1.00 0.00 C ATOM 967 CG GLN A 58 -19.553 19.989 -7.736 1.00 0.00 C ATOM 968 CD GLN A 58 -20.657 20.997 -8.066 1.00 0.00 C ATOM 969 OE1 GLN A 58 -20.794 22.033 -7.436 1.00 0.00 O ATOM 970 NE2 GLN A 58 -21.432 20.636 -9.084 1.00 0.00 N ATOM 0 H GLN A 58 -17.511 18.874 -7.186 1.00 0.00 H new ATOM 0 HA GLN A 58 -18.542 20.347 -5.139 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -20.106 18.221 -6.631 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -20.717 19.711 -5.941 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -18.596 20.505 -7.661 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -19.463 19.265 -8.546 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -21.261 19.754 -9.567 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -22.198 21.241 -9.382 1.00 0.00 H new ATOM 979 N GLU A 59 -18.861 17.121 -4.510 1.00 0.00 N ATOM 980 CA GLU A 59 -19.056 16.153 -3.445 1.00 0.00 C ATOM 981 C GLU A 59 -17.876 16.189 -2.472 1.00 0.00 C ATOM 982 O GLU A 59 -18.056 16.026 -1.266 1.00 0.00 O ATOM 983 CB GLU A 59 -19.257 14.746 -4.012 1.00 0.00 C ATOM 984 CG GLU A 59 -17.927 13.996 -4.101 1.00 0.00 C ATOM 985 CD GLU A 59 -18.037 12.793 -5.040 1.00 0.00 C ATOM 986 OE1 GLU A 59 -19.044 12.652 -5.750 1.00 0.00 O ATOM 987 OE2 GLU A 59 -17.030 11.988 -5.015 1.00 0.00 O ATOM 0 H GLU A 59 -18.727 16.715 -5.436 1.00 0.00 H new ATOM 0 HA GLU A 59 -19.960 16.421 -2.899 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -19.950 14.191 -3.380 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -19.709 14.810 -5.002 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -17.148 14.670 -4.458 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -17.628 13.661 -3.108 1.00 0.00 H new ATOM 994 N ALA A 60 -16.695 16.403 -3.033 1.00 0.00 N ATOM 995 CA ALA A 60 -15.485 16.463 -2.230 1.00 0.00 C ATOM 996 C ALA A 60 -15.623 17.577 -1.190 1.00 0.00 C ATOM 997 O ALA A 60 -15.021 17.509 -0.119 1.00 0.00 O ATOM 998 CB ALA A 60 -14.275 16.666 -3.144 1.00 0.00 C ATOM 0 H ALA A 60 -16.550 16.537 -4.034 1.00 0.00 H new ATOM 0 HA ALA A 60 -15.334 15.527 -1.693 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.368 16.711 -2.542 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -14.205 15.834 -3.845 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -14.390 17.598 -3.698 1.00 0.00 H new ATOM 1004 N ILE A 61 -16.419 18.576 -1.541 1.00 0.00 N ATOM 1005 CA ILE A 61 -16.644 19.702 -0.651 1.00 0.00 C ATOM 1006 C ILE A 61 -17.679 19.312 0.406 1.00 0.00 C ATOM 1007 O ILE A 61 -17.440 19.470 1.602 1.00 0.00 O ATOM 1008 CB ILE A 61 -17.022 20.950 -1.451 1.00 0.00 C ATOM 1009 CG1 ILE A 61 -15.778 21.754 -1.834 1.00 0.00 C ATOM 1010 CG2 ILE A 61 -18.043 21.800 -0.691 1.00 0.00 C ATOM 1011 CD1 ILE A 61 -15.871 22.253 -3.277 1.00 0.00 C ATOM 0 H ILE A 61 -16.916 18.629 -2.430 1.00 0.00 H new ATOM 0 HA ILE A 61 -15.727 19.958 -0.120 1.00 0.00 H new ATOM 0 HB ILE A 61 -17.496 20.630 -2.379 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -15.667 22.602 -1.159 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -14.889 21.134 -1.716 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -18.295 22.681 -1.282 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -18.944 21.213 -0.513 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -17.618 22.112 0.263 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.974 22.821 -3.524 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.958 21.401 -3.952 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -16.747 22.892 -3.385 1.00 0.00 H new ATOM 1023 N THR A 62 -18.808 18.810 -0.073 1.00 0.00 N ATOM 1024 CA THR A 62 -19.880 18.396 0.815 1.00 0.00 C ATOM 1025 C THR A 62 -19.338 17.481 1.915 1.00 0.00 C ATOM 1026 O THR A 62 -19.851 17.478 3.033 1.00 0.00 O ATOM 1027 CB THR A 62 -20.973 17.744 -0.034 1.00 0.00 C ATOM 1028 OG1 THR A 62 -20.314 16.651 -0.668 1.00 0.00 O ATOM 1029 CG2 THR A 62 -21.421 18.634 -1.195 1.00 0.00 C ATOM 0 H THR A 62 -19.003 18.681 -1.066 1.00 0.00 H new ATOM 0 HA THR A 62 -20.317 19.250 1.332 1.00 0.00 H new ATOM 0 HB THR A 62 -21.831 17.510 0.596 1.00 0.00 H new ATOM 0 HG1 THR A 62 -19.344 16.772 -0.603 1.00 0.00 H new ATOM 0 HG21 THR A 62 -22.197 18.124 -1.766 1.00 0.00 H new ATOM 0 HG22 THR A 62 -21.815 19.572 -0.803 1.00 0.00 H new ATOM 0 HG23 THR A 62 -20.570 18.841 -1.844 1.00 0.00 H new ATOM 1037 N LYS A 63 -18.308 16.727 1.560 1.00 0.00 N ATOM 1038 CA LYS A 63 -17.691 15.810 2.503 1.00 0.00 C ATOM 1039 C LYS A 63 -16.898 16.608 3.540 1.00 0.00 C ATOM 1040 O LYS A 63 -16.988 16.339 4.736 1.00 0.00 O ATOM 1041 CB LYS A 63 -16.857 14.763 1.763 1.00 0.00 C ATOM 1042 CG LYS A 63 -17.587 13.420 1.706 1.00 0.00 C ATOM 1043 CD LYS A 63 -18.539 13.364 0.510 1.00 0.00 C ATOM 1044 CE LYS A 63 -18.177 12.208 -0.425 1.00 0.00 C ATOM 1045 NZ LYS A 63 -16.786 12.350 -0.910 1.00 0.00 N ATOM 0 H LYS A 63 -17.885 16.732 0.632 1.00 0.00 H new ATOM 0 HA LYS A 63 -18.453 15.251 3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -16.646 15.110 0.751 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -15.897 14.638 2.263 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -16.861 12.610 1.636 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.147 13.267 2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -19.564 13.245 0.862 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -18.497 14.306 -0.037 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -18.291 11.259 0.099 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -18.863 12.189 -1.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -16.780 12.353 -1.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -16.385 13.243 -0.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -16.214 11.554 -0.562 1.00 0.00 H new ATOM 1058 N PHE A 64 -16.140 17.575 3.042 1.00 0.00 N ATOM 1059 CA PHE A 64 -15.332 18.414 3.911 1.00 0.00 C ATOM 1060 C PHE A 64 -16.196 19.096 4.973 1.00 0.00 C ATOM 1061 O PHE A 64 -15.814 19.163 6.140 1.00 0.00 O ATOM 1062 CB PHE A 64 -14.691 19.485 3.027 1.00 0.00 C ATOM 1063 CG PHE A 64 -13.648 18.942 2.048 1.00 0.00 C ATOM 1064 CD1 PHE A 64 -12.945 17.819 2.357 1.00 0.00 C ATOM 1065 CD2 PHE A 64 -13.423 19.583 0.870 1.00 0.00 C ATOM 1066 CE1 PHE A 64 -11.977 17.316 1.449 1.00 0.00 C ATOM 1067 CE2 PHE A 64 -12.454 19.079 -0.038 1.00 0.00 C ATOM 1068 CZ PHE A 64 -11.752 17.956 0.270 1.00 0.00 C ATOM 0 H PHE A 64 -16.069 17.796 2.049 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.585 17.808 4.424 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -15.474 19.992 2.463 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.221 20.234 3.664 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -13.123 17.310 3.293 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -13.981 20.475 0.625 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -11.419 16.425 1.694 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -12.275 19.588 -0.974 1.00 0.00 H new ATOM 0 HZ PHE A 64 -11.016 17.572 -0.421 1.00 0.00 H new ATOM 1078 N GLU A 65 -17.345 19.585 4.531 1.00 0.00 N ATOM 1079 CA GLU A 65 -18.267 20.260 5.429 1.00 0.00 C ATOM 1080 C GLU A 65 -18.570 19.376 6.641 1.00 0.00 C ATOM 1081 O GLU A 65 -18.396 19.800 7.782 1.00 0.00 O ATOM 1082 CB GLU A 65 -19.554 20.653 4.701 1.00 0.00 C ATOM 1083 CG GLU A 65 -19.585 22.155 4.415 1.00 0.00 C ATOM 1084 CD GLU A 65 -20.118 22.932 5.620 1.00 0.00 C ATOM 1085 OE1 GLU A 65 -20.828 22.361 6.462 1.00 0.00 O ATOM 1086 OE2 GLU A 65 -19.769 24.173 5.667 1.00 0.00 O ATOM 0 H GLU A 65 -17.659 19.527 3.562 1.00 0.00 H new ATOM 0 HA GLU A 65 -17.794 21.177 5.781 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -19.630 20.099 3.765 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -20.417 20.377 5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -18.582 22.503 4.169 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -20.213 22.350 3.545 1.00 0.00 H new ATOM 1093 N GLU A 66 -19.019 18.164 6.351 1.00 0.00 N ATOM 1094 CA GLU A 66 -19.348 17.217 7.403 1.00 0.00 C ATOM 1095 C GLU A 66 -18.140 16.995 8.315 1.00 0.00 C ATOM 1096 O GLU A 66 -18.291 16.843 9.526 1.00 0.00 O ATOM 1097 CB GLU A 66 -19.841 15.893 6.814 1.00 0.00 C ATOM 1098 CG GLU A 66 -20.649 15.102 7.845 1.00 0.00 C ATOM 1099 CD GLU A 66 -22.093 14.907 7.377 1.00 0.00 C ATOM 1100 OE1 GLU A 66 -22.744 15.997 7.151 1.00 0.00 O ATOM 1101 OE2 GLU A 66 -22.552 13.763 7.243 1.00 0.00 O ATOM 0 H GLU A 66 -19.163 17.816 5.403 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.158 17.635 8.001 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -20.457 16.088 5.936 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -18.990 15.300 6.481 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -20.182 14.131 8.011 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -20.640 15.627 8.800 1.00 0.00 H new ATOM 1108 N ALA A 67 -16.967 16.983 7.698 1.00 0.00 N ATOM 1109 CA ALA A 67 -15.734 16.782 8.438 1.00 0.00 C ATOM 1110 C ALA A 67 -15.520 17.958 9.394 1.00 0.00 C ATOM 1111 O ALA A 67 -15.170 17.762 10.556 1.00 0.00 O ATOM 1112 CB ALA A 67 -14.572 16.608 7.458 1.00 0.00 C ATOM 0 H ALA A 67 -16.845 17.109 6.693 1.00 0.00 H new ATOM 0 HA ALA A 67 -15.791 15.875 9.039 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -13.647 16.457 8.014 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -14.759 15.742 6.822 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -14.482 17.500 6.839 1.00 0.00 H new ATOM 1118 N LEU A 68 -15.739 19.154 8.867 1.00 0.00 N ATOM 1119 CA LEU A 68 -15.574 20.361 9.658 1.00 0.00 C ATOM 1120 C LEU A 68 -16.515 20.308 10.863 1.00 0.00 C ATOM 1121 O LEU A 68 -16.189 20.820 11.933 1.00 0.00 O ATOM 1122 CB LEU A 68 -15.762 21.604 8.785 1.00 0.00 C ATOM 1123 CG LEU A 68 -14.526 22.080 8.021 1.00 0.00 C ATOM 1124 CD1 LEU A 68 -14.909 23.072 6.921 1.00 0.00 C ATOM 1125 CD2 LEU A 68 -13.480 22.659 8.976 1.00 0.00 C ATOM 0 H LEU A 68 -16.029 19.313 7.902 1.00 0.00 H new ATOM 0 HA LEU A 68 -14.558 20.425 10.048 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -16.554 21.401 8.064 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -16.109 22.420 9.419 1.00 0.00 H new ATOM 0 HG LEU A 68 -14.074 21.217 7.533 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -14.011 23.395 6.393 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -15.590 22.591 6.219 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -15.399 23.938 7.366 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.611 22.990 8.407 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -13.907 23.506 9.513 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -13.176 21.894 9.690 1.00 0.00 H new ATOM 1137 N LEU A 69 -17.665 19.685 10.649 1.00 0.00 N ATOM 1138 CA LEU A 69 -18.655 19.558 11.705 1.00 0.00 C ATOM 1139 C LEU A 69 -18.076 18.716 12.844 1.00 0.00 C ATOM 1140 O LEU A 69 -18.290 19.020 14.016 1.00 0.00 O ATOM 1141 CB LEU A 69 -19.969 19.011 11.144 1.00 0.00 C ATOM 1142 CG LEU A 69 -20.878 20.029 10.452 1.00 0.00 C ATOM 1143 CD1 LEU A 69 -21.324 19.522 9.079 1.00 0.00 C ATOM 1144 CD2 LEU A 69 -22.068 20.395 11.341 1.00 0.00 C ATOM 0 H LEU A 69 -17.933 19.263 9.760 1.00 0.00 H new ATOM 0 HA LEU A 69 -18.895 20.536 12.121 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -19.736 18.219 10.432 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -20.526 18.552 11.960 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.305 20.942 10.288 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.969 20.264 8.609 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.449 19.352 8.452 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -21.873 18.587 9.197 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -22.698 21.120 10.825 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -22.649 19.499 11.558 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -21.706 20.827 12.274 1.00 0.00 H new ATOM 1156 N ILE A 70 -17.353 17.675 12.459 1.00 0.00 N ATOM 1157 CA ILE A 70 -16.740 16.788 13.433 1.00 0.00 C ATOM 1158 C ILE A 70 -15.656 17.548 14.198 1.00 0.00 C ATOM 1159 O ILE A 70 -15.565 17.445 15.420 1.00 0.00 O ATOM 1160 CB ILE A 70 -16.235 15.513 12.753 1.00 0.00 C ATOM 1161 CG1 ILE A 70 -17.398 14.695 12.188 1.00 0.00 C ATOM 1162 CG2 ILE A 70 -15.366 14.691 13.708 1.00 0.00 C ATOM 1163 CD1 ILE A 70 -17.071 14.175 10.786 1.00 0.00 C ATOM 0 H ILE A 70 -17.178 17.426 11.486 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.477 16.460 14.166 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.606 15.801 11.911 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -17.613 13.856 12.850 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -18.297 15.311 12.151 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -15.020 13.790 13.201 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -14.507 15.285 14.020 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -15.952 14.412 14.584 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -17.914 13.597 10.407 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -16.880 15.017 10.121 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.186 13.540 10.831 1.00 0.00 H new ATOM 1175 N ASP A 71 -14.860 18.295 13.447 1.00 0.00 N ATOM 1176 CA ASP A 71 -13.785 19.073 14.039 1.00 0.00 C ATOM 1177 C ASP A 71 -13.492 20.286 13.155 1.00 0.00 C ATOM 1178 O ASP A 71 -13.032 20.138 12.024 1.00 0.00 O ATOM 1179 CB ASP A 71 -12.502 18.246 14.148 1.00 0.00 C ATOM 1180 CG ASP A 71 -11.686 18.483 15.420 1.00 0.00 C ATOM 1181 OD1 ASP A 71 -11.864 19.494 16.115 1.00 0.00 O ATOM 1182 OD2 ASP A 71 -10.823 17.563 15.693 1.00 0.00 O ATOM 0 H ASP A 71 -14.938 18.378 12.433 1.00 0.00 H new ATOM 0 HA ASP A 71 -14.101 19.381 15.036 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -12.763 17.189 14.094 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -11.873 18.464 13.285 1.00 0.00 H new ATOM 1187 N PRO A 72 -13.777 21.491 13.718 1.00 0.00 N ATOM 1188 CA PRO A 72 -13.549 22.729 12.993 1.00 0.00 C ATOM 1189 C PRO A 72 -12.058 23.068 12.942 1.00 0.00 C ATOM 1190 O PRO A 72 -11.660 24.038 12.298 1.00 0.00 O ATOM 1191 CB PRO A 72 -14.371 23.774 13.731 1.00 0.00 C ATOM 1192 CG PRO A 72 -14.654 23.187 15.104 1.00 0.00 C ATOM 1193 CD PRO A 72 -14.322 21.705 15.056 1.00 0.00 C ATOM 0 HA PRO A 72 -13.853 22.667 11.948 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.825 24.714 13.813 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -15.298 23.989 13.199 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -14.054 23.688 15.864 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.700 23.335 15.374 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.599 21.436 15.826 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -15.209 21.095 15.225 1.00 0.00 H new ATOM 1201 N LYS A 73 -11.274 22.250 13.628 1.00 0.00 N ATOM 1202 CA LYS A 73 -9.835 22.450 13.668 1.00 0.00 C ATOM 1203 C LYS A 73 -9.204 21.833 12.419 1.00 0.00 C ATOM 1204 O LYS A 73 -8.006 21.986 12.185 1.00 0.00 O ATOM 1205 CB LYS A 73 -9.256 21.914 14.979 1.00 0.00 C ATOM 1206 CG LYS A 73 -10.154 22.276 16.164 1.00 0.00 C ATOM 1207 CD LYS A 73 -10.167 23.788 16.400 1.00 0.00 C ATOM 1208 CE LYS A 73 -11.456 24.222 17.101 1.00 0.00 C ATOM 1209 NZ LYS A 73 -11.239 25.477 17.855 1.00 0.00 N ATOM 0 H LYS A 73 -11.608 21.447 14.161 1.00 0.00 H new ATOM 0 HA LYS A 73 -9.597 23.514 13.653 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -9.148 20.831 14.917 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -8.259 22.325 15.135 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -11.169 21.925 15.977 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -9.801 21.767 17.061 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -9.306 24.073 17.005 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -10.074 24.309 15.447 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -12.247 24.365 16.365 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -11.790 23.437 17.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -12.124 25.757 18.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -10.499 25.329 18.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -10.942 26.228 17.200 1.00 0.00 H new ATOM 1222 N LYS A 74 -10.037 21.149 11.650 1.00 0.00 N ATOM 1223 CA LYS A 74 -9.575 20.508 10.430 1.00 0.00 C ATOM 1224 C LYS A 74 -9.147 21.580 9.427 1.00 0.00 C ATOM 1225 O LYS A 74 -9.861 21.854 8.463 1.00 0.00 O ATOM 1226 CB LYS A 74 -10.641 19.551 9.891 1.00 0.00 C ATOM 1227 CG LYS A 74 -10.002 18.280 9.328 1.00 0.00 C ATOM 1228 CD LYS A 74 -9.226 17.529 10.413 1.00 0.00 C ATOM 1229 CE LYS A 74 -9.160 16.033 10.103 1.00 0.00 C ATOM 1230 NZ LYS A 74 -7.758 15.559 10.130 1.00 0.00 N ATOM 0 H LYS A 74 -11.030 21.024 11.848 1.00 0.00 H new ATOM 0 HA LYS A 74 -8.699 19.892 10.631 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.337 19.290 10.688 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.220 20.047 9.112 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.775 17.632 8.915 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.331 18.538 8.509 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -8.217 17.933 10.489 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.705 17.683 11.380 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -9.752 15.478 10.831 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.597 15.839 9.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -7.731 14.541 9.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -7.203 16.076 9.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -7.353 15.726 11.073 1.00 0.00 H new ATOM 1243 N ASP A 75 -7.983 22.157 9.686 1.00 0.00 N ATOM 1244 CA ASP A 75 -7.450 23.192 8.817 1.00 0.00 C ATOM 1245 C ASP A 75 -7.361 22.656 7.387 1.00 0.00 C ATOM 1246 O ASP A 75 -7.459 23.419 6.427 1.00 0.00 O ATOM 1247 CB ASP A 75 -6.045 23.610 9.255 1.00 0.00 C ATOM 1248 CG ASP A 75 -5.211 22.499 9.896 1.00 0.00 C ATOM 1249 OD1 ASP A 75 -4.987 21.479 9.139 1.00 0.00 O ATOM 1250 OD2 ASP A 75 -4.796 22.603 11.060 1.00 0.00 O ATOM 0 H ASP A 75 -7.394 21.927 10.486 1.00 0.00 H new ATOM 0 HA ASP A 75 -8.115 24.054 8.872 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.508 23.992 8.386 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.131 24.434 9.964 1.00 0.00 H new ATOM 1255 N GLU A 76 -7.175 21.348 7.291 1.00 0.00 N ATOM 1256 CA GLU A 76 -7.071 20.700 5.994 1.00 0.00 C ATOM 1257 C GLU A 76 -8.415 20.752 5.265 1.00 0.00 C ATOM 1258 O GLU A 76 -8.485 21.175 4.112 1.00 0.00 O ATOM 1259 CB GLU A 76 -6.581 19.258 6.139 1.00 0.00 C ATOM 1260 CG GLU A 76 -6.478 18.574 4.774 1.00 0.00 C ATOM 1261 CD GLU A 76 -5.765 17.226 4.889 1.00 0.00 C ATOM 1262 OE1 GLU A 76 -4.639 17.162 5.404 1.00 0.00 O ATOM 1263 OE2 GLU A 76 -6.422 16.220 4.420 1.00 0.00 O ATOM 0 H GLU A 76 -7.094 20.719 8.090 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.336 21.240 5.398 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -5.607 19.249 6.629 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -7.265 18.700 6.779 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -7.476 18.428 4.360 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.937 19.218 4.081 1.00 0.00 H new ATOM 1270 N ALA A 77 -9.450 20.316 5.968 1.00 0.00 N ATOM 1271 CA ALA A 77 -10.789 20.308 5.403 1.00 0.00 C ATOM 1272 C ALA A 77 -11.113 21.697 4.850 1.00 0.00 C ATOM 1273 O ALA A 77 -11.841 21.823 3.866 1.00 0.00 O ATOM 1274 CB ALA A 77 -11.790 19.856 6.468 1.00 0.00 C ATOM 0 H ALA A 77 -9.388 19.966 6.924 1.00 0.00 H new ATOM 0 HA ALA A 77 -10.852 19.601 4.576 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -12.794 19.850 6.044 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.533 18.852 6.806 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -11.757 20.543 7.313 1.00 0.00 H new ATOM 1280 N VAL A 78 -10.557 22.705 5.506 1.00 0.00 N ATOM 1281 CA VAL A 78 -10.778 24.080 5.092 1.00 0.00 C ATOM 1282 C VAL A 78 -9.965 24.364 3.828 1.00 0.00 C ATOM 1283 O VAL A 78 -10.508 24.832 2.828 1.00 0.00 O ATOM 1284 CB VAL A 78 -10.447 25.032 6.243 1.00 0.00 C ATOM 1285 CG1 VAL A 78 -10.322 26.473 5.743 1.00 0.00 C ATOM 1286 CG2 VAL A 78 -11.489 24.927 7.358 1.00 0.00 C ATOM 0 H VAL A 78 -9.954 22.597 6.321 1.00 0.00 H new ATOM 0 HA VAL A 78 -11.828 24.241 4.846 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.483 24.736 6.657 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.086 27.130 6.581 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.527 26.533 5.000 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.264 26.785 5.292 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.230 25.614 8.164 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.472 25.185 6.963 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -11.509 23.907 7.743 1.00 0.00 H new ATOM 1296 N TRP A 79 -8.676 24.070 3.913 1.00 0.00 N ATOM 1297 CA TRP A 79 -7.782 24.288 2.788 1.00 0.00 C ATOM 1298 C TRP A 79 -8.299 23.465 1.607 1.00 0.00 C ATOM 1299 O TRP A 79 -8.451 23.985 0.502 1.00 0.00 O ATOM 1300 CB TRP A 79 -6.337 23.954 3.163 1.00 0.00 C ATOM 1301 CG TRP A 79 -5.507 23.397 2.005 1.00 0.00 C ATOM 1302 CD1 TRP A 79 -4.757 24.077 1.126 1.00 0.00 C ATOM 1303 CD2 TRP A 79 -5.372 22.009 1.633 1.00 0.00 C ATOM 1304 NE1 TRP A 79 -4.151 23.232 0.219 1.00 0.00 N ATOM 1305 CE2 TRP A 79 -4.536 21.935 0.537 1.00 0.00 C ATOM 1306 CE3 TRP A 79 -5.937 20.855 2.204 1.00 0.00 C ATOM 1307 CZ2 TRP A 79 -4.191 20.728 -0.083 1.00 0.00 C ATOM 1308 CZ3 TRP A 79 -5.582 19.657 1.573 1.00 0.00 C ATOM 1309 CH2 TRP A 79 -4.742 19.565 0.469 1.00 0.00 C ATOM 0 H TRP A 79 -8.229 23.682 4.744 1.00 0.00 H new ATOM 0 HA TRP A 79 -7.772 25.340 2.501 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -5.854 24.854 3.543 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -6.342 23.227 3.976 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -4.642 25.151 1.128 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -3.534 23.508 -0.545 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -6.593 20.890 3.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -3.535 20.696 -0.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -5.989 18.740 1.972 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -4.515 18.601 0.039 1.00 0.00 H new ATOM 1320 N CYS A 80 -8.555 22.194 1.879 1.00 0.00 N ATOM 1321 CA CYS A 80 -9.052 21.294 0.852 1.00 0.00 C ATOM 1322 C CYS A 80 -10.253 21.955 0.174 1.00 0.00 C ATOM 1323 O CYS A 80 -10.306 22.048 -1.051 1.00 0.00 O ATOM 1324 CB CYS A 80 -9.405 19.921 1.427 1.00 0.00 C ATOM 1325 SG CYS A 80 -8.274 18.650 0.751 1.00 0.00 S ATOM 0 H CYS A 80 -8.428 21.766 2.796 1.00 0.00 H new ATOM 0 HA CYS A 80 -8.272 21.116 0.112 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -9.332 19.943 2.514 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -10.437 19.669 1.182 1.00 0.00 H new ATOM 0 HG CYS A 80 -7.046 19.066 0.849 1.00 0.00 H new ATOM 1331 N ILE A 81 -11.189 22.398 1.001 1.00 0.00 N ATOM 1332 CA ILE A 81 -12.387 23.048 0.497 1.00 0.00 C ATOM 1333 C ILE A 81 -11.987 24.173 -0.460 1.00 0.00 C ATOM 1334 O ILE A 81 -12.690 24.446 -1.432 1.00 0.00 O ATOM 1335 CB ILE A 81 -13.273 23.511 1.655 1.00 0.00 C ATOM 1336 CG1 ILE A 81 -14.035 22.334 2.266 1.00 0.00 C ATOM 1337 CG2 ILE A 81 -14.213 24.634 1.211 1.00 0.00 C ATOM 1338 CD1 ILE A 81 -14.578 22.692 3.651 1.00 0.00 C ATOM 0 H ILE A 81 -11.142 22.319 2.017 1.00 0.00 H new ATOM 0 HA ILE A 81 -12.992 22.343 -0.074 1.00 0.00 H new ATOM 0 HB ILE A 81 -12.630 23.919 2.435 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -14.859 22.050 1.611 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -13.376 21.469 2.342 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -14.832 24.945 2.053 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -13.626 25.482 0.860 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -14.852 24.276 0.404 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -15.115 21.838 4.063 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.750 22.952 4.310 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -15.256 23.541 3.568 1.00 0.00 H new ATOM 1350 N GLY A 82 -10.860 24.797 -0.151 1.00 0.00 N ATOM 1351 CA GLY A 82 -10.358 25.886 -0.971 1.00 0.00 C ATOM 1352 C GLY A 82 -9.728 25.356 -2.261 1.00 0.00 C ATOM 1353 O GLY A 82 -9.998 25.871 -3.345 1.00 0.00 O ATOM 0 H GLY A 82 -10.280 24.569 0.656 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.172 26.569 -1.214 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.619 26.458 -0.410 1.00 0.00 H new ATOM 1357 N ASN A 83 -8.901 24.334 -2.101 1.00 0.00 N ATOM 1358 CA ASN A 83 -8.231 23.728 -3.240 1.00 0.00 C ATOM 1359 C ASN A 83 -9.277 23.136 -4.186 1.00 0.00 C ATOM 1360 O ASN A 83 -9.057 23.064 -5.394 1.00 0.00 O ATOM 1361 CB ASN A 83 -7.302 22.597 -2.795 1.00 0.00 C ATOM 1362 CG ASN A 83 -6.672 21.899 -4.001 1.00 0.00 C ATOM 1363 OD1 ASN A 83 -7.332 21.228 -4.778 1.00 0.00 O ATOM 1364 ND2 ASN A 83 -5.361 22.092 -4.115 1.00 0.00 N ATOM 0 H ASN A 83 -8.679 23.910 -1.200 1.00 0.00 H new ATOM 0 HA ASN A 83 -7.645 24.501 -3.737 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.518 22.997 -2.152 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -7.862 21.873 -2.203 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.848 21.667 -4.887 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.868 22.665 -3.430 1.00 0.00 H new ATOM 1371 N ALA A 84 -10.394 22.728 -3.601 1.00 0.00 N ATOM 1372 CA ALA A 84 -11.475 22.144 -4.377 1.00 0.00 C ATOM 1373 C ALA A 84 -12.126 23.231 -5.235 1.00 0.00 C ATOM 1374 O ALA A 84 -12.217 23.094 -6.454 1.00 0.00 O ATOM 1375 CB ALA A 84 -12.473 21.469 -3.435 1.00 0.00 C ATOM 0 H ALA A 84 -10.574 22.790 -2.599 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.093 21.377 -5.051 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -13.284 21.031 -4.017 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.968 20.686 -2.870 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -12.880 22.209 -2.745 1.00 0.00 H new ATOM 1381 N TYR A 85 -12.562 24.287 -4.564 1.00 0.00 N ATOM 1382 CA TYR A 85 -13.202 25.397 -5.249 1.00 0.00 C ATOM 1383 C TYR A 85 -12.277 25.992 -6.313 1.00 0.00 C ATOM 1384 O TYR A 85 -12.709 26.274 -7.429 1.00 0.00 O ATOM 1385 CB TYR A 85 -13.474 26.454 -4.177 1.00 0.00 C ATOM 1386 CG TYR A 85 -14.614 26.094 -3.223 1.00 0.00 C ATOM 1387 CD1 TYR A 85 -15.713 25.403 -3.690 1.00 0.00 C ATOM 1388 CD2 TYR A 85 -14.543 26.460 -1.894 1.00 0.00 C ATOM 1389 CE1 TYR A 85 -16.786 25.064 -2.792 1.00 0.00 C ATOM 1390 CE2 TYR A 85 -15.616 26.121 -0.996 1.00 0.00 C ATOM 1391 CZ TYR A 85 -16.685 25.439 -1.489 1.00 0.00 C ATOM 1392 OH TYR A 85 -17.698 25.119 -0.640 1.00 0.00 O ATOM 0 H TYR A 85 -12.485 24.397 -3.553 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.112 25.066 -5.749 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.565 26.611 -3.597 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -13.708 27.400 -4.665 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.768 25.116 -4.730 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.683 27.001 -1.528 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -17.652 24.524 -3.145 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -15.573 26.402 0.046 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.489 25.449 0.258 1.00 0.00 H new ATOM 1402 N THR A 86 -11.021 26.165 -5.928 1.00 0.00 N ATOM 1403 CA THR A 86 -10.031 26.721 -6.834 1.00 0.00 C ATOM 1404 C THR A 86 -9.978 25.910 -8.130 1.00 0.00 C ATOM 1405 O THR A 86 -10.010 26.475 -9.223 1.00 0.00 O ATOM 1406 CB THR A 86 -8.691 26.775 -6.097 1.00 0.00 C ATOM 1407 OG1 THR A 86 -8.965 27.557 -4.937 1.00 0.00 O ATOM 1408 CG2 THR A 86 -7.638 27.586 -6.853 1.00 0.00 C ATOM 0 H THR A 86 -10.667 25.930 -5.001 1.00 0.00 H new ATOM 0 HA THR A 86 -10.295 27.735 -7.132 1.00 0.00 H new ATOM 0 HB THR A 86 -8.323 25.761 -5.939 1.00 0.00 H new ATOM 0 HG1 THR A 86 -8.988 26.976 -4.148 1.00 0.00 H new ATOM 0 HG21 THR A 86 -6.707 27.592 -6.286 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.465 27.136 -7.830 1.00 0.00 H new ATOM 0 HG23 THR A 86 -7.991 28.609 -6.982 1.00 0.00 H new ATOM 1416 N SER A 87 -9.898 24.598 -7.966 1.00 0.00 N ATOM 1417 CA SER A 87 -9.841 23.703 -9.110 1.00 0.00 C ATOM 1418 C SER A 87 -11.160 23.758 -9.884 1.00 0.00 C ATOM 1419 O SER A 87 -11.163 23.960 -11.097 1.00 0.00 O ATOM 1420 CB SER A 87 -9.544 22.267 -8.671 1.00 0.00 C ATOM 1421 OG SER A 87 -8.153 22.056 -8.446 1.00 0.00 O ATOM 0 H SER A 87 -9.871 24.133 -7.059 1.00 0.00 H new ATOM 0 HA SER A 87 -9.031 24.031 -9.761 1.00 0.00 H new ATOM 0 HB2 SER A 87 -10.097 22.045 -7.758 1.00 0.00 H new ATOM 0 HB3 SER A 87 -9.897 21.574 -9.434 1.00 0.00 H new ATOM 0 HG SER A 87 -8.004 21.129 -8.166 1.00 0.00 H new ATOM 1427 N PHE A 88 -12.248 23.577 -9.150 1.00 0.00 N ATOM 1428 CA PHE A 88 -13.570 23.604 -9.753 1.00 0.00 C ATOM 1429 C PHE A 88 -13.794 24.905 -10.525 1.00 0.00 C ATOM 1430 O PHE A 88 -14.403 24.900 -11.594 1.00 0.00 O ATOM 1431 CB PHE A 88 -14.584 23.522 -8.610 1.00 0.00 C ATOM 1432 CG PHE A 88 -16.035 23.381 -9.075 1.00 0.00 C ATOM 1433 CD1 PHE A 88 -16.746 24.485 -9.430 1.00 0.00 C ATOM 1434 CD2 PHE A 88 -16.614 22.152 -9.134 1.00 0.00 C ATOM 1435 CE1 PHE A 88 -18.092 24.354 -9.861 1.00 0.00 C ATOM 1436 CE2 PHE A 88 -17.961 22.021 -9.565 1.00 0.00 C ATOM 1437 CZ PHE A 88 -18.671 23.125 -9.920 1.00 0.00 C ATOM 0 H PHE A 88 -12.241 23.411 -8.144 1.00 0.00 H new ATOM 0 HA PHE A 88 -13.677 22.775 -10.453 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -14.332 22.673 -7.975 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -14.496 24.417 -7.995 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -16.286 25.461 -9.384 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -16.049 21.275 -8.853 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -18.657 25.231 -10.142 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -18.421 21.045 -9.611 1.00 0.00 H new ATOM 0 HZ PHE A 88 -19.695 23.026 -10.249 1.00 0.00 H new ATOM 1447 N ALA A 89 -13.289 25.989 -9.954 1.00 0.00 N ATOM 1448 CA ALA A 89 -13.426 27.295 -10.576 1.00 0.00 C ATOM 1449 C ALA A 89 -12.846 27.245 -11.991 1.00 0.00 C ATOM 1450 O ALA A 89 -13.513 27.624 -12.953 1.00 0.00 O ATOM 1451 CB ALA A 89 -12.744 28.350 -9.703 1.00 0.00 C ATOM 0 H ALA A 89 -12.784 25.989 -9.068 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.477 27.572 -10.661 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -12.847 29.330 -10.169 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -13.212 28.366 -8.719 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.687 28.107 -9.598 1.00 0.00 H new ATOM 1457 N PHE A 90 -11.610 26.776 -12.073 1.00 0.00 N ATOM 1458 CA PHE A 90 -10.932 26.672 -13.354 1.00 0.00 C ATOM 1459 C PHE A 90 -11.770 25.873 -14.354 1.00 0.00 C ATOM 1460 O PHE A 90 -11.613 26.028 -15.564 1.00 0.00 O ATOM 1461 CB PHE A 90 -9.615 25.933 -13.105 1.00 0.00 C ATOM 1462 CG PHE A 90 -8.516 26.808 -12.499 1.00 0.00 C ATOM 1463 CD1 PHE A 90 -7.975 27.821 -13.228 1.00 0.00 C ATOM 1464 CD2 PHE A 90 -8.080 26.573 -11.232 1.00 0.00 C ATOM 1465 CE1 PHE A 90 -6.954 28.633 -12.666 1.00 0.00 C ATOM 1466 CE2 PHE A 90 -7.060 27.385 -10.670 1.00 0.00 C ATOM 1467 CZ PHE A 90 -6.519 28.398 -11.399 1.00 0.00 C ATOM 0 H PHE A 90 -11.060 26.464 -11.273 1.00 0.00 H new ATOM 0 HA PHE A 90 -10.768 27.666 -13.770 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -9.803 25.091 -12.439 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -9.258 25.520 -14.048 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -8.322 28.008 -14.234 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -8.510 25.769 -10.654 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -6.523 29.437 -13.245 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.714 27.198 -9.664 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.743 29.016 -10.971 1.00 0.00 H new ATOM 1477 N LEU A 91 -12.641 25.035 -13.811 1.00 0.00 N ATOM 1478 CA LEU A 91 -13.504 24.211 -14.641 1.00 0.00 C ATOM 1479 C LEU A 91 -14.788 24.981 -14.956 1.00 0.00 C ATOM 1480 O LEU A 91 -15.489 24.662 -15.915 1.00 0.00 O ATOM 1481 CB LEU A 91 -13.747 22.854 -13.979 1.00 0.00 C ATOM 1482 CG LEU A 91 -12.504 22.127 -13.462 1.00 0.00 C ATOM 1483 CD1 LEU A 91 -12.857 20.724 -12.963 1.00 0.00 C ATOM 1484 CD2 LEU A 91 -11.404 22.098 -14.525 1.00 0.00 C ATOM 0 H LEU A 91 -12.768 24.909 -12.807 1.00 0.00 H new ATOM 0 HA LEU A 91 -13.021 23.993 -15.594 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -14.433 22.997 -13.144 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -14.250 22.206 -14.697 1.00 0.00 H new ATOM 0 HG LEU A 91 -12.113 22.683 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.956 20.229 -12.601 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -13.581 20.798 -12.152 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -13.286 20.144 -13.780 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -10.532 21.576 -14.132 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -11.768 21.579 -15.412 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -11.127 23.118 -14.790 1.00 0.00 H new ATOM 1496 N THR A 92 -15.058 25.981 -14.129 1.00 0.00 N ATOM 1497 CA THR A 92 -16.246 26.799 -14.307 1.00 0.00 C ATOM 1498 C THR A 92 -15.900 28.084 -15.062 1.00 0.00 C ATOM 1499 O THR A 92 -15.099 28.889 -14.590 1.00 0.00 O ATOM 1500 CB THR A 92 -16.858 27.051 -12.927 1.00 0.00 C ATOM 1501 OG1 THR A 92 -17.872 26.056 -12.811 1.00 0.00 O ATOM 1502 CG2 THR A 92 -17.623 28.374 -12.858 1.00 0.00 C ATOM 0 H THR A 92 -14.475 26.243 -13.334 1.00 0.00 H new ATOM 0 HA THR A 92 -16.989 26.289 -14.920 1.00 0.00 H new ATOM 0 HB THR A 92 -16.070 27.049 -12.174 1.00 0.00 H new ATOM 0 HG1 THR A 92 -17.816 25.633 -11.929 1.00 0.00 H new ATOM 0 HG21 THR A 92 -18.037 28.503 -11.858 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.945 29.198 -13.080 1.00 0.00 H new ATOM 0 HG23 THR A 92 -18.433 28.364 -13.587 1.00 0.00 H new ATOM 1510 N PRO A 93 -16.539 28.241 -16.252 1.00 0.00 N ATOM 1511 CA PRO A 93 -16.307 29.414 -17.077 1.00 0.00 C ATOM 1512 C PRO A 93 -17.015 30.640 -16.497 1.00 0.00 C ATOM 1513 O PRO A 93 -16.592 31.772 -16.728 1.00 0.00 O ATOM 1514 CB PRO A 93 -16.816 29.032 -18.457 1.00 0.00 C ATOM 1515 CG PRO A 93 -17.733 27.838 -18.247 1.00 0.00 C ATOM 1516 CD PRO A 93 -17.494 27.308 -16.843 1.00 0.00 C ATOM 0 HA PRO A 93 -15.255 29.697 -17.120 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -17.353 29.861 -18.918 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -15.990 28.778 -19.121 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -18.775 28.131 -18.372 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -17.528 27.064 -18.987 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -18.420 27.274 -16.270 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -17.095 26.294 -16.865 1.00 0.00 H new ATOM 1524 N ASP A 94 -18.080 30.374 -15.756 1.00 0.00 N ATOM 1525 CA ASP A 94 -18.850 31.441 -15.141 1.00 0.00 C ATOM 1526 C ASP A 94 -17.940 32.255 -14.219 1.00 0.00 C ATOM 1527 O ASP A 94 -17.850 31.974 -13.024 1.00 0.00 O ATOM 1528 CB ASP A 94 -19.996 30.878 -14.298 1.00 0.00 C ATOM 1529 CG ASP A 94 -21.362 30.869 -14.987 1.00 0.00 C ATOM 1530 OD1 ASP A 94 -21.623 31.669 -15.898 1.00 0.00 O ATOM 1531 OD2 ASP A 94 -22.188 29.982 -14.548 1.00 0.00 O ATOM 0 H ASP A 94 -18.428 29.434 -15.567 1.00 0.00 H new ATOM 0 HA ASP A 94 -19.260 32.063 -15.937 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -19.746 29.858 -14.007 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -20.073 31.461 -13.380 1.00 0.00 H new ATOM 1536 N GLU A 95 -17.288 33.247 -14.808 1.00 0.00 N ATOM 1537 CA GLU A 95 -16.388 34.103 -14.054 1.00 0.00 C ATOM 1538 C GLU A 95 -16.988 34.428 -12.684 1.00 0.00 C ATOM 1539 O GLU A 95 -16.305 34.332 -11.666 1.00 0.00 O ATOM 1540 CB GLU A 95 -16.070 35.382 -14.831 1.00 0.00 C ATOM 1541 CG GLU A 95 -15.294 35.067 -16.111 1.00 0.00 C ATOM 1542 CD GLU A 95 -15.100 36.326 -16.958 1.00 0.00 C ATOM 1543 OE1 GLU A 95 -15.912 37.260 -16.877 1.00 0.00 O ATOM 1544 OE2 GLU A 95 -14.060 36.315 -17.722 1.00 0.00 O ATOM 0 H GLU A 95 -17.365 33.477 -15.799 1.00 0.00 H new ATOM 0 HA GLU A 95 -15.451 33.568 -13.900 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.996 35.900 -15.081 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -15.487 36.057 -14.205 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -14.323 34.642 -15.857 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -15.830 34.314 -16.689 1.00 0.00 H new ATOM 1551 N THR A 96 -18.258 34.805 -12.704 1.00 0.00 N ATOM 1552 CA THR A 96 -18.957 35.145 -11.476 1.00 0.00 C ATOM 1553 C THR A 96 -18.816 34.017 -10.453 1.00 0.00 C ATOM 1554 O THR A 96 -18.401 34.250 -9.319 1.00 0.00 O ATOM 1555 CB THR A 96 -20.410 35.465 -11.833 1.00 0.00 C ATOM 1556 OG1 THR A 96 -20.973 35.929 -10.609 1.00 0.00 O ATOM 1557 CG2 THR A 96 -21.221 34.210 -12.164 1.00 0.00 C ATOM 0 H THR A 96 -18.821 34.883 -13.551 1.00 0.00 H new ATOM 0 HA THR A 96 -18.522 36.026 -11.003 1.00 0.00 H new ATOM 0 HB THR A 96 -20.434 36.147 -12.683 1.00 0.00 H new ATOM 0 HG1 THR A 96 -21.915 36.161 -10.749 1.00 0.00 H new ATOM 0 HG21 THR A 96 -22.245 34.493 -12.410 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.771 33.700 -13.015 1.00 0.00 H new ATOM 0 HG23 THR A 96 -21.226 33.542 -11.302 1.00 0.00 H new ATOM 1565 N GLU A 97 -19.170 32.817 -10.890 1.00 0.00 N ATOM 1566 CA GLU A 97 -19.088 31.651 -10.026 1.00 0.00 C ATOM 1567 C GLU A 97 -17.626 31.277 -9.777 1.00 0.00 C ATOM 1568 O GLU A 97 -17.216 31.086 -8.633 1.00 0.00 O ATOM 1569 CB GLU A 97 -19.862 30.473 -10.621 1.00 0.00 C ATOM 1570 CG GLU A 97 -21.370 30.723 -10.564 1.00 0.00 C ATOM 1571 CD GLU A 97 -22.013 29.942 -9.416 1.00 0.00 C ATOM 1572 OE1 GLU A 97 -21.553 28.840 -9.082 1.00 0.00 O ATOM 1573 OE2 GLU A 97 -23.025 30.519 -8.863 1.00 0.00 O ATOM 0 H GLU A 97 -19.514 32.627 -11.831 1.00 0.00 H new ATOM 0 HA GLU A 97 -19.547 31.899 -9.069 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -19.555 30.316 -11.655 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -19.620 29.561 -10.075 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.561 31.788 -10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -21.827 30.429 -11.509 1.00 0.00 H new ATOM 1580 N ALA A 98 -16.878 31.184 -10.867 1.00 0.00 N ATOM 1581 CA ALA A 98 -15.470 30.837 -10.781 1.00 0.00 C ATOM 1582 C ALA A 98 -14.776 31.779 -9.795 1.00 0.00 C ATOM 1583 O ALA A 98 -14.132 31.328 -8.848 1.00 0.00 O ATOM 1584 CB ALA A 98 -14.844 30.889 -12.176 1.00 0.00 C ATOM 0 H ALA A 98 -17.221 31.343 -11.814 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.348 29.820 -10.407 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -13.788 30.629 -12.111 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -15.353 30.180 -12.830 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -14.945 31.895 -12.583 1.00 0.00 H new ATOM 1590 N LYS A 99 -14.930 33.069 -10.050 1.00 0.00 N ATOM 1591 CA LYS A 99 -14.327 34.079 -9.197 1.00 0.00 C ATOM 1592 C LYS A 99 -14.875 33.934 -7.776 1.00 0.00 C ATOM 1593 O LYS A 99 -14.110 33.852 -6.817 1.00 0.00 O ATOM 1594 CB LYS A 99 -14.525 35.474 -9.794 1.00 0.00 C ATOM 1595 CG LYS A 99 -13.641 36.503 -9.087 1.00 0.00 C ATOM 1596 CD LYS A 99 -14.419 37.232 -7.989 1.00 0.00 C ATOM 1597 CE LYS A 99 -14.588 38.714 -8.328 1.00 0.00 C ATOM 1598 NZ LYS A 99 -15.769 39.273 -7.634 1.00 0.00 N ATOM 0 H LYS A 99 -15.464 33.439 -10.836 1.00 0.00 H new ATOM 0 HA LYS A 99 -13.248 33.933 -9.139 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -14.288 35.455 -10.858 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -15.571 35.766 -9.706 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.773 36.006 -8.654 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -13.266 37.225 -9.812 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -15.398 36.770 -7.864 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.895 37.130 -7.039 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -13.693 39.264 -8.036 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -14.700 38.836 -9.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -15.869 40.280 -7.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -16.622 38.759 -7.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -15.647 39.174 -6.606 1.00 0.00 H new ATOM 1611 N HIS A 100 -16.197 33.907 -7.686 1.00 0.00 N ATOM 1612 CA HIS A 100 -16.857 33.773 -6.399 1.00 0.00 C ATOM 1613 C HIS A 100 -16.237 32.610 -5.622 1.00 0.00 C ATOM 1614 O HIS A 100 -15.884 32.757 -4.453 1.00 0.00 O ATOM 1615 CB HIS A 100 -18.370 33.628 -6.576 1.00 0.00 C ATOM 1616 CG HIS A 100 -19.082 33.095 -5.356 1.00 0.00 C ATOM 1617 ND1 HIS A 100 -18.956 31.906 -4.699 1.00 0.00 N flip ATOM 1618 CD2 HIS A 100 -20.053 33.814 -4.681 1.00 0.00 C flip ATOM 1619 CE1 HIS A 100 -19.803 31.900 -3.677 1.00 0.00 C flip ATOM 1620 NE2 HIS A 100 -20.485 33.082 -3.665 1.00 0.00 N flip ATOM 0 H HIS A 100 -16.829 33.976 -8.484 1.00 0.00 H new ATOM 0 HA HIS A 100 -16.704 34.679 -5.812 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -18.790 34.600 -6.834 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -18.565 32.963 -7.417 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -20.400 34.804 -4.939 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -19.931 31.093 -2.971 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -21.202 33.354 -2.992 1.00 0.00 H new ATOM 1628 N ASN A 101 -16.123 31.480 -6.304 1.00 0.00 N ATOM 1629 CA ASN A 101 -15.551 30.292 -5.692 1.00 0.00 C ATOM 1630 C ASN A 101 -14.067 30.533 -5.410 1.00 0.00 C ATOM 1631 O ASN A 101 -13.584 30.239 -4.317 1.00 0.00 O ATOM 1632 CB ASN A 101 -15.665 29.084 -6.624 1.00 0.00 C ATOM 1633 CG ASN A 101 -16.667 28.064 -6.080 1.00 0.00 C ATOM 1634 OD1 ASN A 101 -16.356 26.905 -5.861 1.00 0.00 O ATOM 1635 ND2 ASN A 101 -17.885 28.558 -5.875 1.00 0.00 N ATOM 0 H ASN A 101 -16.417 31.362 -7.274 1.00 0.00 H new ATOM 0 HA ASN A 101 -16.098 30.090 -4.771 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -15.978 29.413 -7.615 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -14.688 28.614 -6.737 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -18.625 27.956 -5.513 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -18.079 29.538 -6.079 1.00 0.00 H new ATOM 1642 N PHE A 102 -13.385 31.065 -6.413 1.00 0.00 N ATOM 1643 CA PHE A 102 -11.966 31.349 -6.286 1.00 0.00 C ATOM 1644 C PHE A 102 -11.692 32.245 -5.076 1.00 0.00 C ATOM 1645 O PHE A 102 -10.740 32.015 -4.332 1.00 0.00 O ATOM 1646 CB PHE A 102 -11.541 32.086 -7.558 1.00 0.00 C ATOM 1647 CG PHE A 102 -10.745 31.225 -8.540 1.00 0.00 C ATOM 1648 CD1 PHE A 102 -9.494 30.802 -8.214 1.00 0.00 C ATOM 1649 CD2 PHE A 102 -11.287 30.882 -9.739 1.00 0.00 C ATOM 1650 CE1 PHE A 102 -8.755 30.003 -9.125 1.00 0.00 C ATOM 1651 CE2 PHE A 102 -10.548 30.083 -10.650 1.00 0.00 C ATOM 1652 CZ PHE A 102 -9.297 29.660 -10.324 1.00 0.00 C ATOM 0 H PHE A 102 -13.789 31.307 -7.318 1.00 0.00 H new ATOM 0 HA PHE A 102 -11.412 30.420 -6.150 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -12.431 32.464 -8.061 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -10.940 32.952 -7.280 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -9.063 31.074 -7.262 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -12.280 31.218 -9.998 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.762 29.667 -8.866 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -10.979 29.811 -11.602 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.734 29.052 -11.017 1.00 0.00 H new ATOM 1662 N ASP A 103 -12.544 33.247 -4.917 1.00 0.00 N ATOM 1663 CA ASP A 103 -12.406 34.178 -3.810 1.00 0.00 C ATOM 1664 C ASP A 103 -12.846 33.492 -2.515 1.00 0.00 C ATOM 1665 O ASP A 103 -12.455 33.908 -1.425 1.00 0.00 O ATOM 1666 CB ASP A 103 -13.287 35.411 -4.015 1.00 0.00 C ATOM 1667 CG ASP A 103 -12.534 36.742 -4.068 1.00 0.00 C ATOM 1668 OD1 ASP A 103 -12.346 37.308 -2.924 1.00 0.00 O ATOM 1669 OD2 ASP A 103 -12.147 37.215 -5.147 1.00 0.00 O ATOM 0 H ASP A 103 -13.332 33.435 -5.536 1.00 0.00 H new ATOM 0 HA ASP A 103 -11.362 34.486 -3.756 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -13.846 35.290 -4.943 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -14.017 35.456 -3.207 1.00 0.00 H new ATOM 1674 N LEU A 104 -13.652 32.454 -2.677 1.00 0.00 N ATOM 1675 CA LEU A 104 -14.149 31.707 -1.534 1.00 0.00 C ATOM 1676 C LEU A 104 -13.008 30.883 -0.933 1.00 0.00 C ATOM 1677 O LEU A 104 -12.832 30.854 0.284 1.00 0.00 O ATOM 1678 CB LEU A 104 -15.369 30.872 -1.929 1.00 0.00 C ATOM 1679 CG LEU A 104 -16.417 30.658 -0.835 1.00 0.00 C ATOM 1680 CD1 LEU A 104 -17.287 29.436 -1.141 1.00 0.00 C ATOM 1681 CD2 LEU A 104 -15.761 30.563 0.543 1.00 0.00 C ATOM 0 H LEU A 104 -13.974 32.112 -3.583 1.00 0.00 H new ATOM 0 HA LEU A 104 -14.495 32.387 -0.756 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -15.853 31.352 -2.780 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -15.022 29.896 -2.268 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.075 31.527 -0.818 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.024 29.306 -0.348 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -17.799 29.583 -2.092 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -16.658 28.548 -1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.529 30.411 1.302 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -15.065 29.724 0.558 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.221 31.486 0.753 1.00 0.00 H new ATOM 1693 N ALA A 105 -12.262 30.233 -1.815 1.00 0.00 N ATOM 1694 CA ALA A 105 -11.143 29.411 -1.387 1.00 0.00 C ATOM 1695 C ALA A 105 -10.218 30.241 -0.494 1.00 0.00 C ATOM 1696 O ALA A 105 -9.616 29.715 0.440 1.00 0.00 O ATOM 1697 CB ALA A 105 -10.422 28.851 -2.614 1.00 0.00 C ATOM 0 H ALA A 105 -12.411 30.259 -2.824 1.00 0.00 H new ATOM 0 HA ALA A 105 -11.493 28.562 -0.800 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -9.583 28.234 -2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -11.115 28.245 -3.198 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -10.054 29.674 -3.227 1.00 0.00 H new ATOM 1703 N THR A 106 -10.134 31.524 -0.815 1.00 0.00 N ATOM 1704 CA THR A 106 -9.292 32.431 -0.054 1.00 0.00 C ATOM 1705 C THR A 106 -9.759 32.498 1.402 1.00 0.00 C ATOM 1706 O THR A 106 -8.979 32.250 2.320 1.00 0.00 O ATOM 1707 CB THR A 106 -9.304 33.789 -0.758 1.00 0.00 C ATOM 1708 OG1 THR A 106 -8.565 33.566 -1.956 1.00 0.00 O ATOM 1709 CG2 THR A 106 -8.489 34.845 -0.008 1.00 0.00 C ATOM 0 H THR A 106 -10.635 31.956 -1.591 1.00 0.00 H new ATOM 0 HA THR A 106 -8.262 32.076 -0.016 1.00 0.00 H new ATOM 0 HB THR A 106 -10.333 34.133 -0.865 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.332 34.427 -2.362 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.531 35.790 -0.550 1.00 0.00 H new ATOM 0 HG22 THR A 106 -8.902 34.982 0.991 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.452 34.517 0.070 1.00 0.00 H new ATOM 1717 N GLN A 107 -11.030 32.834 1.568 1.00 0.00 N ATOM 1718 CA GLN A 107 -11.610 32.937 2.896 1.00 0.00 C ATOM 1719 C GLN A 107 -11.314 31.671 3.703 1.00 0.00 C ATOM 1720 O GLN A 107 -11.249 31.715 4.931 1.00 0.00 O ATOM 1721 CB GLN A 107 -13.115 33.198 2.818 1.00 0.00 C ATOM 1722 CG GLN A 107 -13.452 34.121 1.646 1.00 0.00 C ATOM 1723 CD GLN A 107 -14.804 34.806 1.858 1.00 0.00 C ATOM 1724 OE1 GLN A 107 -14.950 35.714 2.659 1.00 0.00 O ATOM 1725 NE2 GLN A 107 -15.781 34.321 1.096 1.00 0.00 N ATOM 0 H GLN A 107 -11.674 33.038 0.804 1.00 0.00 H new ATOM 0 HA GLN A 107 -11.154 33.785 3.406 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -13.646 32.253 2.705 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -13.458 33.647 3.750 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -12.672 34.874 1.536 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -13.473 33.546 0.720 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -15.590 33.559 0.445 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -16.721 34.711 1.162 1.00 0.00 H new ATOM 1734 N PHE A 108 -11.142 30.574 2.981 1.00 0.00 N ATOM 1735 CA PHE A 108 -10.855 29.298 3.615 1.00 0.00 C ATOM 1736 C PHE A 108 -9.362 29.163 3.922 1.00 0.00 C ATOM 1737 O PHE A 108 -8.983 28.797 5.034 1.00 0.00 O ATOM 1738 CB PHE A 108 -11.261 28.205 2.625 1.00 0.00 C ATOM 1739 CG PHE A 108 -12.732 27.795 2.720 1.00 0.00 C ATOM 1740 CD1 PHE A 108 -13.162 27.044 3.769 1.00 0.00 C ATOM 1741 CD2 PHE A 108 -13.609 28.182 1.756 1.00 0.00 C ATOM 1742 CE1 PHE A 108 -14.527 26.663 3.857 1.00 0.00 C ATOM 1743 CE2 PHE A 108 -14.975 27.801 1.844 1.00 0.00 C ATOM 1744 CZ PHE A 108 -15.405 27.050 2.893 1.00 0.00 C ATOM 0 H PHE A 108 -11.196 30.542 1.963 1.00 0.00 H new ATOM 0 HA PHE A 108 -11.401 29.218 4.555 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -11.056 28.552 1.612 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -10.638 27.327 2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -12.465 26.737 4.535 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -13.267 28.779 0.923 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -14.868 26.066 4.690 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -15.672 28.108 1.078 1.00 0.00 H new ATOM 0 HZ PHE A 108 -16.443 26.761 2.961 1.00 0.00 H new ATOM 1754 N PHE A 109 -8.554 29.465 2.917 1.00 0.00 N ATOM 1755 CA PHE A 109 -7.111 29.382 3.065 1.00 0.00 C ATOM 1756 C PHE A 109 -6.632 30.222 4.250 1.00 0.00 C ATOM 1757 O PHE A 109 -5.554 29.980 4.792 1.00 0.00 O ATOM 1758 CB PHE A 109 -6.496 29.938 1.779 1.00 0.00 C ATOM 1759 CG PHE A 109 -6.567 28.978 0.589 1.00 0.00 C ATOM 1760 CD1 PHE A 109 -6.193 27.679 0.741 1.00 0.00 C ATOM 1761 CD2 PHE A 109 -7.003 29.424 -0.619 1.00 0.00 C ATOM 1762 CE1 PHE A 109 -6.259 26.789 -0.363 1.00 0.00 C ATOM 1763 CE2 PHE A 109 -7.069 28.533 -1.723 1.00 0.00 C ATOM 1764 CZ PHE A 109 -6.695 27.234 -1.572 1.00 0.00 C ATOM 0 H PHE A 109 -8.871 29.768 1.996 1.00 0.00 H new ATOM 0 HA PHE A 109 -6.815 28.348 3.244 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -7.006 30.865 1.516 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -5.452 30.191 1.967 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -5.846 27.325 1.701 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -7.299 30.456 -0.739 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -5.963 25.757 -0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -7.416 28.887 -2.682 1.00 0.00 H new ATOM 0 HZ PHE A 109 -6.744 26.556 -2.412 1.00 0.00 H new ATOM 1774 N GLN A 110 -7.456 31.193 4.618 1.00 0.00 N ATOM 1775 CA GLN A 110 -7.130 32.071 5.729 1.00 0.00 C ATOM 1776 C GLN A 110 -7.310 31.334 7.058 1.00 0.00 C ATOM 1777 O GLN A 110 -6.675 31.678 8.053 1.00 0.00 O ATOM 1778 CB GLN A 110 -7.977 33.344 5.688 1.00 0.00 C ATOM 1779 CG GLN A 110 -7.128 34.555 5.298 1.00 0.00 C ATOM 1780 CD GLN A 110 -6.364 35.102 6.505 1.00 0.00 C ATOM 1781 OE1 GLN A 110 -5.178 34.533 6.698 1.00 0.00 O flip ATOM 1782 NE2 GLN A 110 -6.822 35.983 7.215 1.00 0.00 N flip ATOM 0 H GLN A 110 -8.349 31.391 4.166 1.00 0.00 H new ATOM 0 HA GLN A 110 -6.085 32.367 5.639 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -8.791 33.221 4.973 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -8.432 33.514 6.664 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -6.424 34.273 4.515 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -7.768 35.334 4.885 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -7.740 36.377 7.010 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -6.286 36.325 8.013 1.00 0.00 H new ATOM 1791 N GLN A 111 -8.179 30.334 7.030 1.00 0.00 N ATOM 1792 CA GLN A 111 -8.450 29.546 8.220 1.00 0.00 C ATOM 1793 C GLN A 111 -7.372 28.476 8.406 1.00 0.00 C ATOM 1794 O GLN A 111 -6.918 28.234 9.523 1.00 0.00 O ATOM 1795 CB GLN A 111 -9.843 28.916 8.155 1.00 0.00 C ATOM 1796 CG GLN A 111 -10.882 29.932 7.678 1.00 0.00 C ATOM 1797 CD GLN A 111 -12.204 29.243 7.333 1.00 0.00 C ATOM 1798 OE1 GLN A 111 -12.618 28.285 7.964 1.00 0.00 O ATOM 1799 NE2 GLN A 111 -12.842 29.784 6.298 1.00 0.00 N ATOM 0 H GLN A 111 -8.704 30.052 6.202 1.00 0.00 H new ATOM 0 HA GLN A 111 -8.427 30.210 9.084 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -9.828 28.061 7.479 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -10.122 28.540 9.139 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -11.049 30.679 8.454 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -10.504 30.461 6.803 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -12.439 30.586 5.813 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -13.734 29.397 5.989 1.00 0.00 H new ATOM 1808 N ALA A 112 -6.995 27.863 7.293 1.00 0.00 N ATOM 1809 CA ALA A 112 -5.980 26.824 7.319 1.00 0.00 C ATOM 1810 C ALA A 112 -4.692 27.390 7.922 1.00 0.00 C ATOM 1811 O ALA A 112 -4.099 26.780 8.811 1.00 0.00 O ATOM 1812 CB ALA A 112 -5.770 26.279 5.904 1.00 0.00 C ATOM 0 H ALA A 112 -7.374 28.066 6.368 1.00 0.00 H new ATOM 0 HA ALA A 112 -6.300 25.991 7.945 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -5.008 25.499 5.924 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -6.706 25.863 5.532 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -5.446 27.086 5.247 1.00 0.00 H new ATOM 1818 N VAL A 113 -4.298 28.548 7.415 1.00 0.00 N ATOM 1819 CA VAL A 113 -3.093 29.203 7.893 1.00 0.00 C ATOM 1820 C VAL A 113 -3.299 29.648 9.342 1.00 0.00 C ATOM 1821 O VAL A 113 -2.389 29.543 10.163 1.00 0.00 O ATOM 1822 CB VAL A 113 -2.719 30.357 6.960 1.00 0.00 C ATOM 1823 CG1 VAL A 113 -2.760 29.915 5.496 1.00 0.00 C ATOM 1824 CG2 VAL A 113 -3.628 31.566 7.193 1.00 0.00 C ATOM 0 H VAL A 113 -4.792 29.050 6.677 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.252 28.509 7.883 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.696 30.656 7.191 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.490 30.754 4.855 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.054 29.099 5.342 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -3.765 29.576 5.246 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -3.341 32.372 6.518 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.664 31.284 7.003 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -3.527 31.904 8.224 1.00 0.00 H new ATOM 1834 N ASP A 114 -4.501 30.136 9.612 1.00 0.00 N ATOM 1835 CA ASP A 114 -4.838 30.597 10.948 1.00 0.00 C ATOM 1836 C ASP A 114 -4.347 29.575 11.975 1.00 0.00 C ATOM 1837 O ASP A 114 -3.744 29.943 12.982 1.00 0.00 O ATOM 1838 CB ASP A 114 -6.352 30.744 11.114 1.00 0.00 C ATOM 1839 CG ASP A 114 -6.848 32.182 11.277 1.00 0.00 C ATOM 1840 OD1 ASP A 114 -6.447 32.894 12.210 1.00 0.00 O ATOM 1841 OD2 ASP A 114 -7.694 32.572 10.385 1.00 0.00 O ATOM 0 H ASP A 114 -5.253 30.222 8.928 1.00 0.00 H new ATOM 0 HA ASP A 114 -4.362 31.566 11.100 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -6.842 30.303 10.246 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -6.665 30.167 11.984 1.00 0.00 H new ATOM 1846 N GLU A 115 -4.624 28.312 11.685 1.00 0.00 N ATOM 1847 CA GLU A 115 -4.217 27.235 12.571 1.00 0.00 C ATOM 1848 C GLU A 115 -2.696 27.069 12.543 1.00 0.00 C ATOM 1849 O GLU A 115 -2.078 26.808 13.573 1.00 0.00 O ATOM 1850 CB GLU A 115 -4.918 25.926 12.200 1.00 0.00 C ATOM 1851 CG GLU A 115 -6.436 26.110 12.158 1.00 0.00 C ATOM 1852 CD GLU A 115 -7.130 25.177 13.152 1.00 0.00 C ATOM 1853 OE1 GLU A 115 -6.519 24.203 13.618 1.00 0.00 O ATOM 1854 OE2 GLU A 115 -8.347 25.492 13.438 1.00 0.00 O ATOM 0 H GLU A 115 -5.125 28.011 10.849 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.515 27.494 13.587 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -4.563 25.582 11.229 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -4.662 25.154 12.925 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -6.687 27.145 12.390 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -6.802 25.911 11.151 1.00 0.00 H new ATOM 1861 N GLN A 116 -2.138 27.229 11.352 1.00 0.00 N ATOM 1862 CA GLN A 116 -0.701 27.101 11.176 1.00 0.00 C ATOM 1863 C GLN A 116 -0.259 27.804 9.891 1.00 0.00 C ATOM 1864 O GLN A 116 -0.210 27.188 8.827 1.00 0.00 O ATOM 1865 CB GLN A 116 -0.279 25.630 11.170 1.00 0.00 C ATOM 1866 CG GLN A 116 1.074 25.451 10.477 1.00 0.00 C ATOM 1867 CD GLN A 116 1.937 24.427 11.216 1.00 0.00 C ATOM 1868 OE1 GLN A 116 1.454 23.599 11.971 1.00 0.00 O ATOM 1869 NE2 GLN A 116 3.238 24.528 10.957 1.00 0.00 N ATOM 0 H GLN A 116 -2.655 27.446 10.500 1.00 0.00 H new ATOM 0 HA GLN A 116 -0.206 27.584 12.019 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -0.219 25.261 12.194 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -1.035 25.033 10.660 1.00 0.00 H new ATOM 0 HG2 GLN A 116 0.919 25.127 9.448 1.00 0.00 H new ATOM 0 HG3 GLN A 116 1.594 26.408 10.435 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.576 25.244 10.314 1.00 0.00 H new ATOM 0 HE22 GLN A 116 3.897 23.889 11.401 1.00 0.00 H new ATOM 1878 N PRO A 117 0.060 29.118 10.036 1.00 0.00 N ATOM 1879 CA PRO A 117 0.497 29.911 8.899 1.00 0.00 C ATOM 1880 C PRO A 117 1.937 29.568 8.512 1.00 0.00 C ATOM 1881 O PRO A 117 2.461 30.092 7.530 1.00 0.00 O ATOM 1882 CB PRO A 117 0.329 31.356 9.341 1.00 0.00 C ATOM 1883 CG PRO A 117 0.247 31.322 10.858 1.00 0.00 C ATOM 1884 CD PRO A 117 0.015 29.880 11.280 1.00 0.00 C ATOM 0 HA PRO A 117 -0.085 29.713 7.999 1.00 0.00 H new ATOM 0 HB2 PRO A 117 1.169 31.966 9.009 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -0.572 31.794 8.911 1.00 0.00 H new ATOM 0 HG2 PRO A 117 1.167 31.705 11.299 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -0.565 31.958 11.211 1.00 0.00 H new ATOM 0 HD2 PRO A 117 0.781 29.544 11.978 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -0.946 29.764 11.781 1.00 0.00 H new ATOM 1892 N ASP A 118 2.536 28.691 9.304 1.00 0.00 N ATOM 1893 CA ASP A 118 3.905 28.272 9.056 1.00 0.00 C ATOM 1894 C ASP A 118 3.904 27.089 8.085 1.00 0.00 C ATOM 1895 O ASP A 118 4.950 26.710 7.562 1.00 0.00 O ATOM 1896 CB ASP A 118 4.586 27.822 10.350 1.00 0.00 C ATOM 1897 CG ASP A 118 5.200 28.948 11.183 1.00 0.00 C ATOM 1898 OD1 ASP A 118 5.921 29.810 10.660 1.00 0.00 O ATOM 1899 OD2 ASP A 118 4.907 28.919 12.439 1.00 0.00 O ATOM 0 H ASP A 118 2.098 28.259 10.118 1.00 0.00 H new ATOM 0 HA ASP A 118 4.447 29.121 8.640 1.00 0.00 H new ATOM 0 HB2 ASP A 118 3.855 27.294 10.963 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.369 27.106 10.101 1.00 0.00 H new ATOM 1904 N ASN A 119 2.717 26.538 7.875 1.00 0.00 N ATOM 1905 CA ASN A 119 2.566 25.406 6.977 1.00 0.00 C ATOM 1906 C ASN A 119 2.905 25.843 5.551 1.00 0.00 C ATOM 1907 O ASN A 119 2.168 26.619 4.944 1.00 0.00 O ATOM 1908 CB ASN A 119 1.127 24.886 6.984 1.00 0.00 C ATOM 1909 CG ASN A 119 1.043 23.513 7.654 1.00 0.00 C ATOM 1910 OD1 ASN A 119 1.717 23.228 8.630 1.00 0.00 O ATOM 1911 ND2 ASN A 119 0.181 22.682 7.077 1.00 0.00 N ATOM 0 H ASN A 119 1.851 26.855 8.311 1.00 0.00 H new ATOM 0 HA ASN A 119 3.236 24.616 7.315 1.00 0.00 H new ATOM 0 HB2 ASN A 119 0.484 25.591 7.511 1.00 0.00 H new ATOM 0 HB3 ASN A 119 0.756 24.819 5.961 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.052 21.741 7.449 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.352 22.985 6.262 1.00 0.00 H new ATOM 1918 N THR A 120 4.020 25.326 5.056 1.00 0.00 N ATOM 1919 CA THR A 120 4.465 25.653 3.712 1.00 0.00 C ATOM 1920 C THR A 120 3.385 25.292 2.690 1.00 0.00 C ATOM 1921 O THR A 120 3.348 25.853 1.597 1.00 0.00 O ATOM 1922 CB THR A 120 5.796 24.939 3.468 1.00 0.00 C ATOM 1923 OG1 THR A 120 5.466 23.555 3.542 1.00 0.00 O ATOM 1924 CG2 THR A 120 6.790 25.147 4.613 1.00 0.00 C ATOM 0 H THR A 120 4.629 24.683 5.562 1.00 0.00 H new ATOM 0 HA THR A 120 4.629 26.725 3.599 1.00 0.00 H new ATOM 0 HB THR A 120 6.235 25.297 2.537 1.00 0.00 H new ATOM 0 HG1 THR A 120 6.272 23.018 3.394 1.00 0.00 H new ATOM 0 HG21 THR A 120 7.718 24.620 4.390 1.00 0.00 H new ATOM 0 HG22 THR A 120 6.996 26.211 4.727 1.00 0.00 H new ATOM 0 HG23 THR A 120 6.365 24.758 5.539 1.00 0.00 H new ATOM 1932 N HIS A 121 2.533 24.356 3.083 1.00 0.00 N ATOM 1933 CA HIS A 121 1.456 23.913 2.214 1.00 0.00 C ATOM 1934 C HIS A 121 0.413 25.025 2.083 1.00 0.00 C ATOM 1935 O HIS A 121 0.129 25.488 0.979 1.00 0.00 O ATOM 1936 CB HIS A 121 0.859 22.597 2.717 1.00 0.00 C ATOM 1937 CG HIS A 121 1.874 21.650 3.311 1.00 0.00 C ATOM 1938 ND1 HIS A 121 2.524 21.678 4.510 1.00 0.00 N flip ATOM 1939 CD2 HIS A 121 2.321 20.519 2.651 1.00 0.00 C flip ATOM 1940 CE1 HIS A 121 3.324 20.621 4.579 1.00 0.00 C flip ATOM 1941 NE2 HIS A 121 3.199 19.901 3.427 1.00 0.00 N flip ATOM 0 H HIS A 121 2.567 23.893 3.991 1.00 0.00 H new ATOM 0 HA HIS A 121 1.848 23.710 1.217 1.00 0.00 H new ATOM 0 HB2 HIS A 121 0.100 22.818 3.468 1.00 0.00 H new ATOM 0 HB3 HIS A 121 0.354 22.099 1.889 1.00 0.00 H new ATOM 0 HD2 HIS A 121 2.007 20.195 1.670 1.00 0.00 H new ATOM 0 HE1 HIS A 121 3.968 20.372 5.410 1.00 0.00 H new ATOM 0 HE2 HIS A 121 3.695 19.038 3.203 1.00 0.00 H new ATOM 1949 N TYR A 122 -0.130 25.422 3.225 1.00 0.00 N ATOM 1950 CA TYR A 122 -1.135 26.470 3.251 1.00 0.00 C ATOM 1951 C TYR A 122 -0.597 27.761 2.631 1.00 0.00 C ATOM 1952 O TYR A 122 -1.340 28.503 1.989 1.00 0.00 O ATOM 1953 CB TYR A 122 -1.446 26.720 4.728 1.00 0.00 C ATOM 1954 CG TYR A 122 -1.964 25.487 5.472 1.00 0.00 C ATOM 1955 CD1 TYR A 122 -2.321 24.355 4.767 1.00 0.00 C ATOM 1956 CD2 TYR A 122 -2.074 25.506 6.847 1.00 0.00 C ATOM 1957 CE1 TYR A 122 -2.808 23.195 5.467 1.00 0.00 C ATOM 1958 CE2 TYR A 122 -2.561 24.346 7.547 1.00 0.00 C ATOM 1959 CZ TYR A 122 -2.904 23.248 6.822 1.00 0.00 C ATOM 1960 OH TYR A 122 -3.365 22.152 7.483 1.00 0.00 O ATOM 0 H TYR A 122 0.108 25.036 4.139 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.016 26.171 2.683 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -0.543 27.078 5.223 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -2.188 27.515 4.803 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.235 24.340 3.691 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -1.795 26.391 7.399 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -3.091 22.303 4.928 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -2.652 24.348 8.623 1.00 0.00 H new ATOM 0 HH TYR A 122 -4.323 22.256 7.660 1.00 0.00 H new ATOM 1970 N LEU A 123 0.690 27.991 2.843 1.00 0.00 N ATOM 1971 CA LEU A 123 1.336 29.179 2.313 1.00 0.00 C ATOM 1972 C LEU A 123 1.204 29.189 0.789 1.00 0.00 C ATOM 1973 O LEU A 123 0.787 30.188 0.205 1.00 0.00 O ATOM 1974 CB LEU A 123 2.782 29.268 2.805 1.00 0.00 C ATOM 1975 CG LEU A 123 3.788 29.877 1.826 1.00 0.00 C ATOM 1976 CD1 LEU A 123 4.276 28.832 0.821 1.00 0.00 C ATOM 1977 CD2 LEU A 123 3.202 31.109 1.134 1.00 0.00 C ATOM 0 H LEU A 123 1.303 27.374 3.375 1.00 0.00 H new ATOM 0 HA LEU A 123 0.842 30.078 2.683 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.797 29.856 3.723 1.00 0.00 H new ATOM 0 HB3 LEU A 123 3.119 28.264 3.064 1.00 0.00 H new ATOM 0 HG LEU A 123 4.658 30.210 2.392 1.00 0.00 H new ATOM 0 HD11 LEU A 123 4.990 29.291 0.137 1.00 0.00 H new ATOM 0 HD12 LEU A 123 4.759 28.013 1.354 1.00 0.00 H new ATOM 0 HD13 LEU A 123 3.427 28.447 0.256 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.937 31.523 0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 123 2.306 30.825 0.582 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.945 31.859 1.882 1.00 0.00 H new ATOM 1989 N LYS A 124 1.567 28.065 0.188 1.00 0.00 N ATOM 1990 CA LYS A 124 1.495 27.932 -1.257 1.00 0.00 C ATOM 1991 C LYS A 124 0.038 28.065 -1.705 1.00 0.00 C ATOM 1992 O LYS A 124 -0.252 28.737 -2.694 1.00 0.00 O ATOM 1993 CB LYS A 124 2.161 26.631 -1.709 1.00 0.00 C ATOM 1994 CG LYS A 124 3.153 26.889 -2.845 1.00 0.00 C ATOM 1995 CD LYS A 124 4.343 27.717 -2.357 1.00 0.00 C ATOM 1996 CE LYS A 124 5.453 27.754 -3.409 1.00 0.00 C ATOM 1997 NZ LYS A 124 6.646 28.453 -2.879 1.00 0.00 N ATOM 0 H LYS A 124 1.912 27.238 0.676 1.00 0.00 H new ATOM 0 HA LYS A 124 2.052 28.734 -1.742 1.00 0.00 H new ATOM 0 HB2 LYS A 124 2.678 26.171 -0.867 1.00 0.00 H new ATOM 0 HB3 LYS A 124 1.400 25.924 -2.040 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.507 25.939 -3.246 1.00 0.00 H new ATOM 0 HG3 LYS A 124 2.651 27.412 -3.659 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.016 28.732 -2.132 1.00 0.00 H new ATOM 0 HD3 LYS A 124 4.730 27.294 -1.430 1.00 0.00 H new ATOM 0 HE2 LYS A 124 5.719 26.738 -3.701 1.00 0.00 H new ATOM 0 HE3 LYS A 124 5.096 28.260 -4.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 7.390 28.469 -3.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 6.391 29.428 -2.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 6.996 27.953 -2.037 1.00 0.00 H new ATOM 2010 N SER A 125 -0.840 27.414 -0.956 1.00 0.00 N ATOM 2011 CA SER A 125 -2.259 27.452 -1.263 1.00 0.00 C ATOM 2012 C SER A 125 -2.746 28.901 -1.315 1.00 0.00 C ATOM 2013 O SER A 125 -3.424 29.298 -2.261 1.00 0.00 O ATOM 2014 CB SER A 125 -3.067 26.657 -0.235 1.00 0.00 C ATOM 2015 OG SER A 125 -2.243 25.780 0.529 1.00 0.00 O ATOM 0 H SER A 125 -0.596 26.857 -0.137 1.00 0.00 H new ATOM 0 HA SER A 125 -2.409 26.990 -2.239 1.00 0.00 H new ATOM 0 HB2 SER A 125 -3.581 27.347 0.435 1.00 0.00 H new ATOM 0 HB3 SER A 125 -3.836 26.078 -0.747 1.00 0.00 H new ATOM 0 HG SER A 125 -2.781 25.029 0.857 1.00 0.00 H new ATOM 2021 N LEU A 126 -2.380 29.652 -0.286 1.00 0.00 N ATOM 2022 CA LEU A 126 -2.771 31.049 -0.202 1.00 0.00 C ATOM 2023 C LEU A 126 -2.001 31.853 -1.252 1.00 0.00 C ATOM 2024 O LEU A 126 -2.579 32.685 -1.949 1.00 0.00 O ATOM 2025 CB LEU A 126 -2.593 31.570 1.225 1.00 0.00 C ATOM 2026 CG LEU A 126 -3.092 32.993 1.486 1.00 0.00 C ATOM 2027 CD1 LEU A 126 -4.619 33.057 1.434 1.00 0.00 C ATOM 2028 CD2 LEU A 126 -2.540 33.534 2.807 1.00 0.00 C ATOM 0 H LEU A 126 -1.817 29.319 0.497 1.00 0.00 H new ATOM 0 HA LEU A 126 -3.831 31.163 -0.428 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -3.111 30.894 1.905 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.534 31.526 1.477 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.716 33.638 0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.947 34.079 1.623 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.963 32.742 0.449 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.037 32.396 2.193 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.910 34.547 2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.866 32.894 3.627 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.451 33.548 2.768 1.00 0.00 H new ATOM 2040 N GLU A 127 -0.707 31.576 -1.331 1.00 0.00 N ATOM 2041 CA GLU A 127 0.148 32.263 -2.283 1.00 0.00 C ATOM 2042 C GLU A 127 -0.429 32.148 -3.695 1.00 0.00 C ATOM 2043 O GLU A 127 -0.514 33.140 -4.418 1.00 0.00 O ATOM 2044 CB GLU A 127 1.577 31.718 -2.229 1.00 0.00 C ATOM 2045 CG GLU A 127 2.438 32.327 -3.338 1.00 0.00 C ATOM 2046 CD GLU A 127 3.560 33.186 -2.752 1.00 0.00 C ATOM 2047 OE1 GLU A 127 4.602 32.651 -2.344 1.00 0.00 O ATOM 2048 OE2 GLU A 127 3.321 34.454 -2.730 1.00 0.00 O ATOM 0 H GLU A 127 -0.231 30.885 -0.751 1.00 0.00 H new ATOM 0 HA GLU A 127 0.185 33.318 -2.012 1.00 0.00 H new ATOM 0 HB2 GLU A 127 2.018 31.940 -1.257 1.00 0.00 H new ATOM 0 HB3 GLU A 127 1.560 30.633 -2.331 1.00 0.00 H new ATOM 0 HG2 GLU A 127 2.865 31.532 -3.949 1.00 0.00 H new ATOM 0 HG3 GLU A 127 1.815 32.935 -3.995 1.00 0.00 H new ATOM 2055 N MET A 128 -0.812 30.929 -4.046 1.00 0.00 N ATOM 2056 CA MET A 128 -1.379 30.671 -5.359 1.00 0.00 C ATOM 2057 C MET A 128 -2.746 31.343 -5.507 1.00 0.00 C ATOM 2058 O MET A 128 -3.069 31.875 -6.567 1.00 0.00 O ATOM 2059 CB MET A 128 -1.526 29.162 -5.564 1.00 0.00 C ATOM 2060 CG MET A 128 -0.605 28.669 -6.681 1.00 0.00 C ATOM 2061 SD MET A 128 -1.108 29.371 -8.243 1.00 0.00 S ATOM 2062 CE MET A 128 -2.196 28.081 -8.826 1.00 0.00 C ATOM 0 H MET A 128 -0.741 30.109 -3.444 1.00 0.00 H new ATOM 0 HA MET A 128 -0.708 31.085 -6.112 1.00 0.00 H new ATOM 0 HB2 MET A 128 -1.290 28.641 -4.636 1.00 0.00 H new ATOM 0 HB3 MET A 128 -2.561 28.924 -5.809 1.00 0.00 H new ATOM 0 HG2 MET A 128 0.426 28.948 -6.463 1.00 0.00 H new ATOM 0 HG3 MET A 128 -0.636 27.581 -6.735 1.00 0.00 H new ATOM 0 HE1 MET A 128 -2.475 28.280 -9.861 1.00 0.00 H new ATOM 0 HE2 MET A 128 -1.685 27.120 -8.767 1.00 0.00 H new ATOM 0 HE3 MET A 128 -3.093 28.054 -8.207 1.00 0.00 H new ATOM 2072 N THR A 129 -3.513 31.295 -4.427 1.00 0.00 N ATOM 2073 CA THR A 129 -4.838 31.892 -4.423 1.00 0.00 C ATOM 2074 C THR A 129 -4.747 33.394 -4.698 1.00 0.00 C ATOM 2075 O THR A 129 -5.732 34.018 -5.090 1.00 0.00 O ATOM 2076 CB THR A 129 -5.503 31.558 -3.087 1.00 0.00 C ATOM 2077 OG1 THR A 129 -6.634 30.770 -3.449 1.00 0.00 O ATOM 2078 CG2 THR A 129 -6.109 32.789 -2.410 1.00 0.00 C ATOM 0 H THR A 129 -3.242 30.852 -3.549 1.00 0.00 H new ATOM 0 HA THR A 129 -5.458 31.484 -5.222 1.00 0.00 H new ATOM 0 HB THR A 129 -4.770 31.102 -2.422 1.00 0.00 H new ATOM 0 HG1 THR A 129 -7.024 30.368 -2.645 1.00 0.00 H new ATOM 0 HG21 THR A 129 -6.568 32.496 -1.466 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.325 33.523 -2.220 1.00 0.00 H new ATOM 0 HG23 THR A 129 -6.866 33.227 -3.061 1.00 0.00 H new ATOM 2086 N ALA A 130 -3.556 33.932 -4.482 1.00 0.00 N ATOM 2087 CA ALA A 130 -3.323 35.349 -4.701 1.00 0.00 C ATOM 2088 C ALA A 130 -3.907 35.754 -6.056 1.00 0.00 C ATOM 2089 O ALA A 130 -4.644 36.733 -6.150 1.00 0.00 O ATOM 2090 CB ALA A 130 -1.825 35.642 -4.600 1.00 0.00 C ATOM 0 H ALA A 130 -2.741 33.411 -4.157 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.823 35.943 -3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -1.650 36.705 -4.764 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -1.466 35.364 -3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -1.290 35.066 -5.355 1.00 0.00 H new ATOM 2096 N LYS A 131 -3.554 34.979 -7.071 1.00 0.00 N ATOM 2097 CA LYS A 131 -4.034 35.244 -8.417 1.00 0.00 C ATOM 2098 C LYS A 131 -5.173 34.277 -8.748 1.00 0.00 C ATOM 2099 O LYS A 131 -5.229 33.732 -9.849 1.00 0.00 O ATOM 2100 CB LYS A 131 -2.878 35.197 -9.417 1.00 0.00 C ATOM 2101 CG LYS A 131 -2.248 36.581 -9.593 1.00 0.00 C ATOM 2102 CD LYS A 131 -0.920 36.487 -10.347 1.00 0.00 C ATOM 2103 CE LYS A 131 0.252 36.326 -9.377 1.00 0.00 C ATOM 2104 NZ LYS A 131 1.023 35.104 -9.694 1.00 0.00 N ATOM 0 H LYS A 131 -2.941 34.168 -6.989 1.00 0.00 H new ATOM 0 HA LYS A 131 -4.442 36.253 -8.484 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -2.123 34.491 -9.072 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -3.239 34.833 -10.379 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -2.934 37.230 -10.137 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -2.084 37.037 -8.617 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -0.947 35.641 -11.034 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -0.776 37.383 -10.951 1.00 0.00 H new ATOM 0 HE2 LYS A 131 0.902 37.199 -9.435 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -0.120 36.273 -8.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 1.815 35.010 -9.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 0.403 34.272 -9.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 1.394 35.169 -10.663 1.00 0.00 H new ATOM 2117 N ALA A 132 -6.053 34.094 -7.774 1.00 0.00 N ATOM 2118 CA ALA A 132 -7.187 33.203 -7.948 1.00 0.00 C ATOM 2119 C ALA A 132 -8.038 33.691 -9.122 1.00 0.00 C ATOM 2120 O ALA A 132 -8.374 32.915 -10.015 1.00 0.00 O ATOM 2121 CB ALA A 132 -7.982 33.127 -6.643 1.00 0.00 C ATOM 0 H ALA A 132 -6.003 34.548 -6.862 1.00 0.00 H new ATOM 0 HA ALA A 132 -6.849 32.194 -8.183 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -8.833 32.458 -6.774 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.341 32.747 -5.848 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -8.340 34.122 -6.376 1.00 0.00 H new ATOM 2127 N PRO A 133 -8.371 35.009 -9.081 1.00 0.00 N ATOM 2128 CA PRO A 133 -9.177 35.610 -10.131 1.00 0.00 C ATOM 2129 C PRO A 133 -8.353 35.822 -11.402 1.00 0.00 C ATOM 2130 O PRO A 133 -8.904 35.890 -12.499 1.00 0.00 O ATOM 2131 CB PRO A 133 -9.694 36.909 -9.535 1.00 0.00 C ATOM 2132 CG PRO A 133 -8.790 37.214 -8.352 1.00 0.00 C ATOM 2133 CD PRO A 133 -7.991 35.958 -8.040 1.00 0.00 C ATOM 0 HA PRO A 133 -10.005 34.973 -10.443 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -9.663 37.715 -10.268 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -10.732 36.807 -9.217 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -8.122 38.043 -8.586 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -9.381 37.515 -7.487 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -6.919 36.156 -8.057 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -8.229 35.574 -7.048 1.00 0.00 H new ATOM 2141 N GLN A 134 -7.045 35.920 -11.211 1.00 0.00 N ATOM 2142 CA GLN A 134 -6.139 36.122 -12.329 1.00 0.00 C ATOM 2143 C GLN A 134 -5.871 34.795 -13.042 1.00 0.00 C ATOM 2144 O GLN A 134 -5.938 34.721 -14.268 1.00 0.00 O ATOM 2145 CB GLN A 134 -4.832 36.769 -11.865 1.00 0.00 C ATOM 2146 CG GLN A 134 -3.761 36.681 -12.954 1.00 0.00 C ATOM 2147 CD GLN A 134 -4.140 37.533 -14.167 1.00 0.00 C ATOM 2148 OE1 GLN A 134 -4.846 38.522 -14.066 1.00 0.00 O ATOM 2149 NE2 GLN A 134 -3.633 37.094 -15.315 1.00 0.00 N ATOM 0 H GLN A 134 -6.591 35.863 -10.299 1.00 0.00 H new ATOM 0 HA GLN A 134 -6.612 36.803 -13.037 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -5.010 37.813 -11.608 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -4.478 36.274 -10.961 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -2.803 37.016 -12.555 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -3.633 35.643 -13.260 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -3.049 36.258 -15.328 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -3.828 37.593 -16.183 1.00 0.00 H new ATOM 2158 N LEU A 135 -5.574 33.781 -12.244 1.00 0.00 N ATOM 2159 CA LEU A 135 -5.296 32.460 -12.784 1.00 0.00 C ATOM 2160 C LEU A 135 -6.462 32.021 -13.672 1.00 0.00 C ATOM 2161 O LEU A 135 -6.255 31.394 -14.709 1.00 0.00 O ATOM 2162 CB LEU A 135 -4.978 31.477 -11.656 1.00 0.00 C ATOM 2163 CG LEU A 135 -3.674 31.728 -10.895 1.00 0.00 C ATOM 2164 CD1 LEU A 135 -3.748 31.154 -9.478 1.00 0.00 C ATOM 2165 CD2 LEU A 135 -2.473 31.187 -11.671 1.00 0.00 C ATOM 0 H LEU A 135 -5.520 33.847 -11.228 1.00 0.00 H new ATOM 0 HA LEU A 135 -4.407 32.485 -13.414 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -5.801 31.495 -10.942 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -4.943 30.472 -12.076 1.00 0.00 H new ATOM 0 HG LEU A 135 -3.536 32.805 -10.800 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -2.809 31.346 -8.958 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.566 31.628 -8.936 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.921 30.079 -9.529 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -1.560 31.379 -11.108 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -2.589 30.113 -11.819 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -2.413 31.683 -12.640 1.00 0.00 H new ATOM 2177 N HIS A 136 -7.663 32.369 -13.232 1.00 0.00 N ATOM 2178 CA HIS A 136 -8.862 32.018 -13.974 1.00 0.00 C ATOM 2179 C HIS A 136 -8.887 32.782 -15.299 1.00 0.00 C ATOM 2180 O HIS A 136 -9.205 32.213 -16.342 1.00 0.00 O ATOM 2181 CB HIS A 136 -10.114 32.257 -13.127 1.00 0.00 C ATOM 2182 CG HIS A 136 -11.397 31.819 -13.792 1.00 0.00 C ATOM 2183 ND1 HIS A 136 -12.247 32.702 -14.434 1.00 0.00 N ATOM 2184 CD2 HIS A 136 -11.965 30.585 -13.908 1.00 0.00 C ATOM 2185 CE1 HIS A 136 -13.278 32.019 -14.911 1.00 0.00 C ATOM 2186 NE2 HIS A 136 -13.101 30.707 -14.583 1.00 0.00 N ATOM 0 H HIS A 136 -7.831 32.890 -12.371 1.00 0.00 H new ATOM 0 HA HIS A 136 -8.851 30.954 -14.209 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -10.007 31.726 -12.181 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -10.183 33.319 -12.891 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -11.559 29.664 -13.517 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -14.111 32.429 -15.462 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -13.737 29.945 -14.818 1.00 0.00 H new ATOM 2194 N ALA A 137 -8.548 34.061 -15.214 1.00 0.00 N ATOM 2195 CA ALA A 137 -8.527 34.909 -16.394 1.00 0.00 C ATOM 2196 C ALA A 137 -7.495 34.370 -17.386 1.00 0.00 C ATOM 2197 O ALA A 137 -7.813 34.134 -18.551 1.00 0.00 O ATOM 2198 CB ALA A 137 -8.239 36.353 -15.979 1.00 0.00 C ATOM 0 H ALA A 137 -8.286 34.530 -14.347 1.00 0.00 H new ATOM 0 HA ALA A 137 -9.497 34.900 -16.891 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -8.223 36.990 -16.864 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -9.017 36.698 -15.298 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -7.271 36.402 -15.479 1.00 0.00 H new ATOM 2204 N GLU A 138 -6.280 34.190 -16.888 1.00 0.00 N ATOM 2205 CA GLU A 138 -5.199 33.683 -17.717 1.00 0.00 C ATOM 2206 C GLU A 138 -5.450 32.218 -18.078 1.00 0.00 C ATOM 2207 O GLU A 138 -5.039 31.758 -19.142 1.00 0.00 O ATOM 2208 CB GLU A 138 -3.848 33.853 -17.019 1.00 0.00 C ATOM 2209 CG GLU A 138 -3.916 33.372 -15.568 1.00 0.00 C ATOM 2210 CD GLU A 138 -2.823 32.340 -15.282 1.00 0.00 C ATOM 2211 OE1 GLU A 138 -1.708 32.711 -14.887 1.00 0.00 O ATOM 2212 OE2 GLU A 138 -3.167 31.113 -15.482 1.00 0.00 O ATOM 0 H GLU A 138 -6.020 34.386 -15.921 1.00 0.00 H new ATOM 0 HA GLU A 138 -5.170 34.264 -18.639 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -3.084 33.292 -17.557 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -3.551 34.901 -17.045 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -3.805 34.221 -14.894 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -4.895 32.935 -15.371 1.00 0.00 H new ATOM 2219 N ALA A 139 -6.123 31.525 -17.170 1.00 0.00 N ATOM 2220 CA ALA A 139 -6.433 30.121 -17.380 1.00 0.00 C ATOM 2221 C ALA A 139 -7.248 29.970 -18.666 1.00 0.00 C ATOM 2222 O ALA A 139 -6.919 29.150 -19.521 1.00 0.00 O ATOM 2223 CB ALA A 139 -7.168 29.572 -16.155 1.00 0.00 C ATOM 0 H ALA A 139 -6.462 31.910 -16.288 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.519 29.539 -17.499 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -7.401 28.519 -16.312 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.535 29.676 -15.274 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -8.093 30.129 -16.005 1.00 0.00 H new ATOM 2229 N TYR A 140 -8.297 30.773 -18.761 1.00 0.00 N ATOM 2230 CA TYR A 140 -9.163 30.739 -19.928 1.00 0.00 C ATOM 2231 C TYR A 140 -8.626 31.649 -21.035 1.00 0.00 C ATOM 2232 O TYR A 140 -8.658 31.287 -22.210 1.00 0.00 O ATOM 2233 CB TYR A 140 -10.520 31.269 -19.462 1.00 0.00 C ATOM 2234 CG TYR A 140 -11.281 30.310 -18.544 1.00 0.00 C ATOM 2235 CD1 TYR A 140 -10.723 29.915 -17.344 1.00 0.00 C ATOM 2236 CD2 TYR A 140 -12.524 29.840 -18.915 1.00 0.00 C ATOM 2237 CE1 TYR A 140 -11.439 29.013 -16.480 1.00 0.00 C ATOM 2238 CE2 TYR A 140 -13.239 28.937 -18.051 1.00 0.00 C ATOM 2239 CZ TYR A 140 -12.662 28.568 -16.876 1.00 0.00 C ATOM 2240 OH TYR A 140 -13.338 27.716 -16.060 1.00 0.00 O ATOM 0 H TYR A 140 -8.567 31.451 -18.049 1.00 0.00 H new ATOM 0 HA TYR A 140 -9.225 29.728 -20.331 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -10.370 32.213 -18.939 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -11.135 31.483 -20.336 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -9.750 30.283 -17.054 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -12.961 30.149 -19.853 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -11.015 28.697 -15.539 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -14.212 28.561 -18.330 1.00 0.00 H new ATOM 0 HH TYR A 140 -13.072 26.794 -16.257 1.00 0.00 H new ATOM 2250 N LYS A 141 -8.145 32.812 -20.620 1.00 0.00 N ATOM 2251 CA LYS A 141 -7.602 33.776 -21.562 1.00 0.00 C ATOM 2252 C LYS A 141 -6.455 33.130 -22.341 1.00 0.00 C ATOM 2253 O LYS A 141 -6.403 33.223 -23.567 1.00 0.00 O ATOM 2254 CB LYS A 141 -7.206 35.065 -20.840 1.00 0.00 C ATOM 2255 CG LYS A 141 -6.701 36.116 -21.831 1.00 0.00 C ATOM 2256 CD LYS A 141 -7.855 36.691 -22.655 1.00 0.00 C ATOM 2257 CE LYS A 141 -7.908 36.053 -24.045 1.00 0.00 C ATOM 2258 NZ LYS A 141 -6.900 36.669 -24.937 1.00 0.00 N ATOM 0 H LYS A 141 -8.120 33.108 -19.644 1.00 0.00 H new ATOM 0 HA LYS A 141 -8.359 34.066 -22.291 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -8.063 35.458 -20.293 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -6.430 34.851 -20.105 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -6.199 36.919 -21.291 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -5.962 35.669 -22.496 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -8.798 36.519 -22.136 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -7.736 37.770 -22.751 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -7.726 34.981 -23.967 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -8.904 36.177 -24.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -6.949 36.225 -25.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -7.091 37.687 -25.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -5.950 36.528 -24.537 1.00 0.00 H new ATOM 2271 N GLN A 142 -5.564 32.490 -21.599 1.00 0.00 N ATOM 2272 CA GLN A 142 -4.420 31.829 -22.205 1.00 0.00 C ATOM 2273 C GLN A 142 -4.799 30.415 -22.650 1.00 0.00 C ATOM 2274 O GLN A 142 -4.998 29.531 -21.818 1.00 0.00 O ATOM 2275 CB GLN A 142 -3.230 31.801 -21.244 1.00 0.00 C ATOM 2276 CG GLN A 142 -1.928 32.137 -21.974 1.00 0.00 C ATOM 2277 CD GLN A 142 -1.538 33.601 -21.754 1.00 0.00 C ATOM 2278 OE1 GLN A 142 -1.681 34.445 -22.623 1.00 0.00 O ATOM 2279 NE2 GLN A 142 -1.039 33.852 -20.547 1.00 0.00 N ATOM 0 H GLN A 142 -5.611 32.415 -20.583 1.00 0.00 H new ATOM 0 HA GLN A 142 -4.120 32.398 -23.085 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -3.393 32.515 -20.437 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -3.151 30.815 -20.786 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -1.129 31.487 -21.618 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -2.045 31.944 -23.040 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -0.947 33.098 -19.866 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -0.749 34.799 -20.302 1.00 0.00 H new