USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 877 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 89 ASN : amide:sc= 0.853 K(o=1.9,f=-3.3!) USER MOD Set 1.2: A 94 ASN : amide:sc= 1.05 K(o=1.9,f=-1.5!) USER MOD Set 2.1: A 82 CYS SG : rot -79:sc= -2.81! USER MOD Set 2.2: A 102 THR OG1 : rot 172:sc= 0.492 USER MOD Set 3.1: A 59 ASN : amide:sc= 0.999 K(o=3.5,f=-9!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 155:sc= 2.55 (180deg=0.215) USER MOD Set 4.1: A 16 HIS : no HD1:sc= 1.06 K(o=1.6,f=-3.3!) USER MOD Set 4.2: A 54 THR OG1 : rot -19:sc= 0.574 USER MOD Set 5.1: A 28 LYS NZ :NH3+ 178:sc= 0.766 (180deg=-0.331) USER MOD Set 5.2: A 32 SER OG : rot 69:sc= 2.07 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0.23) USER MOD Single : A 25 LYS NZ :NH3+ 165:sc= -0.0147 (180deg=-0.196) USER MOD Single : A 29 THR OG1 : rot 83:sc= 1.27 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot -105:sc= 0.416 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.681 USER MOD Single : A 47 SER OG : rot 84:sc= 1.28 USER MOD Single : A 51 ASN :FLIP amide:sc= -0.0659 F(o=-2.2!,f=-0.066) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 89:sc= 1.09 USER MOD Single : A 67 SER OG : rot -13:sc= 1.02 USER MOD Single : A 71 HIS : no HD1:sc= -0.0711 X(o=-0.071,f=-0.073) USER MOD Single : A 76 SER OG : rot 109:sc= 1.31 USER MOD Single : A 81 ASN : amide:sc= -1.75! C(o=-1.8!,f=-5.2!) USER MOD Single : A 85 THR OG1 : rot 102:sc= 1.24 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0.867 K(o=0.87,f=-0.054) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 MET CE :methyl -175:sc= -0.31 (180deg=-0.38) USER MOD Single : A 113 GLN :FLIP amide:sc= -5.34! C(o=-7.7!,f=-5.3!) USER MOD Single : A 114 MET CE :methyl -163:sc= -0.0137 (180deg=-0.304) USER MOD Single : A 115 GLN :FLIP amide:sc= -0.236 F(o=-1.3,f=-0.24) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.166 K(o=-0.17,f=-0.92) USER MOD Single : A 125 GLN :FLIP amide:sc= -0.0828 F(o=-1.5!,f=-0.083) USER MOD Single : A 129 THR OG1 : rot -119:sc= -0.348 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -125:sc= -0.108 (180deg=-1.01) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 2.735 8.589 4.012 1.00 0.00 N ATOM 2 CA PRO A 1 3.272 8.077 2.770 1.00 0.00 C ATOM 3 C PRO A 1 4.778 8.301 2.751 1.00 0.00 C ATOM 4 O PRO A 1 5.371 8.566 3.791 1.00 0.00 O ATOM 5 CB PRO A 1 2.567 8.776 1.607 1.00 0.00 C ATOM 6 CG PRO A 1 1.727 9.810 2.270 1.00 0.00 C ATOM 7 CD PRO A 1 1.523 9.337 3.702 1.00 0.00 C ATOM 0 H2 PRO A 1 3.417 9.190 4.475 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.528 7.824 4.654 1.00 0.00 H new ATOM 0 HA PRO A 1 3.097 7.005 2.674 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.282 9.224 0.917 1.00 0.00 H new ATOM 0 HB3 PRO A 1 1.961 8.078 1.029 1.00 0.00 H new ATOM 0 HG2 PRO A 1 2.218 10.783 2.248 1.00 0.00 H new ATOM 0 HG3 PRO A 1 0.772 9.923 1.757 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.390 10.178 4.383 1.00 0.00 H new ATOM 0 HD3 PRO A 1 0.635 8.710 3.791 1.00 0.00 H new ATOM 17 N VAL A 2 5.404 8.164 1.608 1.00 0.00 N ATOM 18 CA VAL A 2 6.830 8.337 1.504 1.00 0.00 C ATOM 19 C VAL A 2 7.152 9.127 0.254 1.00 0.00 C ATOM 20 O VAL A 2 6.730 8.755 -0.838 1.00 0.00 O ATOM 21 CB VAL A 2 7.582 6.966 1.482 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.044 7.166 1.158 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.484 6.280 2.818 1.00 0.00 C ATOM 0 H VAL A 2 4.942 7.931 0.729 1.00 0.00 H new ATOM 0 HA VAL A 2 7.170 8.882 2.385 1.00 0.00 H new ATOM 0 HB VAL A 2 7.112 6.349 0.716 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.550 6.200 1.148 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.139 7.636 0.179 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.500 7.806 1.913 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.014 5.329 2.778 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.930 6.913 3.585 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.436 6.101 3.059 1.00 0.00 H new ATOM 33 N THR A 3 7.861 10.198 0.415 1.00 0.00 N ATOM 34 CA THR A 3 8.258 11.018 -0.687 1.00 0.00 C ATOM 35 C THR A 3 9.773 10.909 -0.848 1.00 0.00 C ATOM 36 O THR A 3 10.484 10.509 0.092 1.00 0.00 O ATOM 37 CB THR A 3 7.796 12.495 -0.474 1.00 0.00 C ATOM 38 OG1 THR A 3 8.179 13.322 -1.574 1.00 0.00 O ATOM 39 CG2 THR A 3 8.354 13.078 0.816 1.00 0.00 C ATOM 0 H THR A 3 8.184 10.532 1.323 1.00 0.00 H new ATOM 0 HA THR A 3 7.779 10.674 -1.604 1.00 0.00 H new ATOM 0 HB THR A 3 6.708 12.476 -0.405 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.875 14.240 -1.414 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.011 14.106 0.929 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.008 12.485 1.663 1.00 0.00 H new ATOM 0 HG23 THR A 3 9.443 13.061 0.782 1.00 0.00 H new ATOM 228 N HIS A 16 10.087 10.153 5.129 1.00 0.00 N ATOM 229 CA HIS A 16 8.835 9.519 5.422 1.00 0.00 C ATOM 230 C HIS A 16 7.880 10.632 5.723 1.00 0.00 C ATOM 231 O HIS A 16 8.169 11.495 6.561 1.00 0.00 O ATOM 232 CB HIS A 16 8.925 8.557 6.626 1.00 0.00 C ATOM 233 CG HIS A 16 7.654 7.769 6.877 1.00 0.00 C ATOM 234 ND1 HIS A 16 6.690 8.133 7.783 1.00 0.00 N ATOM 235 CD2 HIS A 16 7.208 6.622 6.317 1.00 0.00 C ATOM 236 CE1 HIS A 16 5.714 7.246 7.763 1.00 0.00 C ATOM 237 NE2 HIS A 16 6.009 6.324 6.878 1.00 0.00 N ATOM 0 HA HIS A 16 8.516 8.908 4.578 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.747 7.860 6.461 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.168 9.131 7.520 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.716 6.045 5.558 1.00 0.00 H new ATOM 0 HE1 HIS A 16 4.823 7.274 8.372 1.00 0.00 H new ATOM 0 HE2 HIS A 16 5.431 5.515 6.649 1.00 0.00 H new ATOM 246 N ASN A 17 6.790 10.646 5.047 1.00 0.00 N ATOM 247 CA ASN A 17 5.857 11.714 5.186 1.00 0.00 C ATOM 248 C ASN A 17 4.619 11.250 5.905 1.00 0.00 C ATOM 249 O ASN A 17 4.236 10.077 5.785 1.00 0.00 O ATOM 250 CB ASN A 17 5.496 12.215 3.793 1.00 0.00 C ATOM 251 CG ASN A 17 5.043 13.634 3.811 1.00 0.00 C ATOM 252 OD1 ASN A 17 3.870 13.929 3.954 1.00 0.00 O ATOM 253 ND2 ASN A 17 5.980 14.526 3.663 1.00 0.00 N ATOM 0 H ASN A 17 6.516 9.922 4.383 1.00 0.00 H new ATOM 0 HA ASN A 17 6.303 12.517 5.774 1.00 0.00 H new ATOM 0 HB2 ASN A 17 6.362 12.119 3.137 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.708 11.588 3.375 1.00 0.00 H new ATOM 0 HD21 ASN A 17 5.744 15.518 3.664 1.00 0.00 H new ATOM 0 HD22 ASN A 17 6.950 14.232 3.546 1.00 0.00 H new ATOM 260 N GLY A 18 3.999 12.153 6.637 1.00 0.00 N ATOM 261 CA GLY A 18 2.777 11.852 7.344 1.00 0.00 C ATOM 262 C GLY A 18 1.612 11.762 6.381 1.00 0.00 C ATOM 263 O GLY A 18 1.770 12.023 5.179 1.00 0.00 O ATOM 0 H GLY A 18 4.328 13.111 6.757 1.00 0.00 H new ATOM 0 HA2 GLY A 18 2.884 10.910 7.882 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.582 12.624 8.088 1.00 0.00 H new ATOM 267 N PHE A 19 0.465 11.383 6.859 1.00 0.00 N ATOM 268 CA PHE A 19 -0.687 11.274 5.995 1.00 0.00 C ATOM 269 C PHE A 19 -1.150 12.617 5.540 1.00 0.00 C ATOM 270 O PHE A 19 -1.369 13.504 6.357 1.00 0.00 O ATOM 271 CB PHE A 19 -1.855 10.526 6.646 1.00 0.00 C ATOM 272 CG PHE A 19 -1.639 9.054 6.741 1.00 0.00 C ATOM 273 CD1 PHE A 19 -1.728 8.271 5.604 1.00 0.00 C ATOM 274 CD2 PHE A 19 -1.353 8.451 7.947 1.00 0.00 C ATOM 275 CE1 PHE A 19 -1.531 6.915 5.670 1.00 0.00 C ATOM 276 CE2 PHE A 19 -1.158 7.091 8.013 1.00 0.00 C ATOM 277 CZ PHE A 19 -1.248 6.330 6.875 1.00 0.00 C ATOM 0 H PHE A 19 0.295 11.144 7.836 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.358 10.690 5.135 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.020 10.926 7.646 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.762 10.716 6.073 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.955 8.732 4.654 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.282 9.049 8.844 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.599 6.312 4.776 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -0.934 6.623 8.960 1.00 0.00 H new ATOM 0 HZ PHE A 19 -1.095 5.262 6.930 1.00 0.00 H new ATOM 287 N ASP A 20 -1.266 12.781 4.236 1.00 0.00 N ATOM 288 CA ASP A 20 -1.815 13.987 3.677 1.00 0.00 C ATOM 289 C ASP A 20 -3.281 13.943 3.947 1.00 0.00 C ATOM 290 O ASP A 20 -3.948 12.949 3.591 1.00 0.00 O ATOM 291 CB ASP A 20 -1.586 14.036 2.172 1.00 0.00 C ATOM 292 CG ASP A 20 -2.074 15.319 1.564 1.00 0.00 C ATOM 293 OD1 ASP A 20 -1.392 16.356 1.718 1.00 0.00 O ATOM 294 OD2 ASP A 20 -3.139 15.335 0.939 1.00 0.00 O ATOM 0 H ASP A 20 -0.983 12.085 3.546 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.341 14.865 4.116 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.522 13.919 1.964 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.097 13.196 1.701 1.00 0.00 H new ATOM 299 N PHE A 21 -3.799 14.964 4.572 1.00 0.00 N ATOM 300 CA PHE A 21 -5.163 14.929 4.967 1.00 0.00 C ATOM 301 C PHE A 21 -6.071 14.984 3.770 1.00 0.00 C ATOM 302 O PHE A 21 -7.034 14.291 3.736 1.00 0.00 O ATOM 303 CB PHE A 21 -5.524 16.009 5.975 1.00 0.00 C ATOM 304 CG PHE A 21 -6.890 15.776 6.567 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.138 14.628 7.313 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.931 16.668 6.350 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.389 14.382 7.834 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.189 16.420 6.869 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.415 15.280 7.611 1.00 0.00 C ATOM 0 H PHE A 21 -3.296 15.818 4.813 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.310 13.976 5.475 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.780 16.029 6.771 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.498 16.985 5.490 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.340 13.921 7.486 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.757 17.563 5.771 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.567 13.489 8.415 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.994 17.119 6.693 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.397 15.089 8.019 1.00 0.00 H new ATOM 319 N ALA A 22 -5.727 15.802 2.794 1.00 0.00 N ATOM 320 CA ALA A 22 -6.495 15.933 1.558 1.00 0.00 C ATOM 321 C ALA A 22 -6.671 14.584 0.852 1.00 0.00 C ATOM 322 O ALA A 22 -7.755 14.271 0.368 1.00 0.00 O ATOM 323 CB ALA A 22 -5.847 16.939 0.638 1.00 0.00 C ATOM 0 H ALA A 22 -4.902 16.401 2.831 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.489 16.292 1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.432 17.024 -0.278 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.804 17.909 1.133 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.837 16.611 0.394 1.00 0.00 H new ATOM 329 N VAL A 23 -5.605 13.801 0.831 1.00 0.00 N ATOM 330 CA VAL A 23 -5.615 12.454 0.271 1.00 0.00 C ATOM 331 C VAL A 23 -6.586 11.555 1.061 1.00 0.00 C ATOM 332 O VAL A 23 -7.519 10.982 0.483 1.00 0.00 O ATOM 333 CB VAL A 23 -4.174 11.851 0.267 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.172 10.401 -0.138 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.273 12.627 -0.682 1.00 0.00 C ATOM 0 H VAL A 23 -4.699 14.082 1.205 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.961 12.507 -0.761 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.797 11.928 1.287 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.150 10.022 -0.127 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.779 9.827 0.562 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.585 10.303 -1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.273 12.193 -0.671 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.680 12.577 -1.692 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.220 13.668 -0.363 1.00 0.00 H new ATOM 345 N ILE A 24 -6.390 11.481 2.395 1.00 0.00 N ATOM 346 CA ILE A 24 -7.250 10.687 3.288 1.00 0.00 C ATOM 347 C ILE A 24 -8.710 11.107 3.121 1.00 0.00 C ATOM 348 O ILE A 24 -9.589 10.292 2.901 1.00 0.00 O ATOM 349 CB ILE A 24 -6.844 10.879 4.798 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.419 10.386 5.062 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.825 10.193 5.749 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.186 8.935 4.692 1.00 0.00 C ATOM 0 H ILE A 24 -5.635 11.968 2.877 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.123 9.639 3.016 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.882 11.950 4.995 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.721 11.009 4.502 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.190 10.521 6.119 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.505 10.352 6.779 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.821 10.613 5.610 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.849 9.124 5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.153 8.665 4.910 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.857 8.300 5.271 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.381 8.795 3.629 1.00 0.00 H new ATOM 364 N LYS A 25 -8.908 12.386 3.198 1.00 0.00 N ATOM 365 CA LYS A 25 -10.192 13.057 3.104 1.00 0.00 C ATOM 366 C LYS A 25 -10.883 12.700 1.811 1.00 0.00 C ATOM 367 O LYS A 25 -12.061 12.337 1.805 1.00 0.00 O ATOM 368 CB LYS A 25 -9.922 14.564 3.174 1.00 0.00 C ATOM 369 CG LYS A 25 -11.111 15.493 3.227 1.00 0.00 C ATOM 370 CD LYS A 25 -10.621 16.948 3.275 1.00 0.00 C ATOM 371 CE LYS A 25 -10.138 17.441 1.923 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.227 17.544 0.935 1.00 0.00 N ATOM 0 H LYS A 25 -8.138 13.040 3.337 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.848 12.747 3.917 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.310 14.753 4.056 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.323 14.837 2.305 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.745 15.340 2.354 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.719 15.273 4.105 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.430 17.590 3.625 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.811 17.032 4.000 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.668 18.417 2.043 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.373 16.763 1.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.908 18.113 0.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.490 16.593 0.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.053 17.999 1.374 1.00 0.00 H new ATOM 386 N GLU A 26 -10.154 12.762 0.722 1.00 0.00 N ATOM 387 CA GLU A 26 -10.729 12.459 -0.559 1.00 0.00 C ATOM 388 C GLU A 26 -11.018 10.968 -0.713 1.00 0.00 C ATOM 389 O GLU A 26 -12.112 10.600 -1.170 1.00 0.00 O ATOM 390 CB GLU A 26 -9.866 12.976 -1.694 1.00 0.00 C ATOM 391 CG GLU A 26 -10.568 12.976 -3.027 1.00 0.00 C ATOM 392 CD GLU A 26 -9.750 13.626 -4.084 1.00 0.00 C ATOM 393 OE1 GLU A 26 -9.699 14.872 -4.131 1.00 0.00 O ATOM 394 OE2 GLU A 26 -9.146 12.916 -4.906 1.00 0.00 O ATOM 0 H GLU A 26 -9.167 13.018 0.701 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.685 12.980 -0.611 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.543 13.991 -1.462 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.967 12.364 -1.765 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.791 11.950 -3.320 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.522 13.496 -2.935 1.00 0.00 H new ATOM 401 N LEU A 27 -10.078 10.111 -0.286 1.00 0.00 N ATOM 402 CA LEU A 27 -10.292 8.668 -0.414 1.00 0.00 C ATOM 403 C LEU A 27 -11.436 8.245 0.508 1.00 0.00 C ATOM 404 O LEU A 27 -12.079 7.281 0.257 1.00 0.00 O ATOM 405 CB LEU A 27 -9.007 7.817 -0.150 1.00 0.00 C ATOM 406 CG LEU A 27 -8.984 6.424 -0.770 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.239 6.525 -2.240 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.630 5.781 -0.538 1.00 0.00 C ATOM 0 H LEU A 27 -9.191 10.383 0.137 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.557 8.469 -1.452 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.146 8.372 -0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.879 7.715 0.928 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.759 5.814 -0.306 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.222 5.529 -2.682 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.215 6.981 -2.410 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.466 7.140 -2.702 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.619 4.786 -0.983 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.853 6.393 -0.997 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.444 5.702 0.533 1.00 0.00 H new ATOM 420 N LYS A 28 -11.672 9.020 1.565 1.00 0.00 N ATOM 421 CA LYS A 28 -12.796 8.818 2.486 1.00 0.00 C ATOM 422 C LYS A 28 -14.124 9.299 1.863 1.00 0.00 C ATOM 423 O LYS A 28 -15.187 8.672 2.032 1.00 0.00 O ATOM 424 CB LYS A 28 -12.520 9.525 3.834 1.00 0.00 C ATOM 425 CG LYS A 28 -13.705 9.610 4.772 1.00 0.00 C ATOM 426 CD LYS A 28 -14.277 8.253 5.092 1.00 0.00 C ATOM 427 CE LYS A 28 -15.502 8.375 5.973 1.00 0.00 C ATOM 428 NZ LYS A 28 -16.597 9.160 5.336 1.00 0.00 N ATOM 0 H LYS A 28 -11.083 9.816 1.811 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.895 7.749 2.675 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.711 9.000 4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.165 10.535 3.630 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -13.400 10.101 5.696 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -14.479 10.231 4.321 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -14.539 7.738 4.168 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.523 7.646 5.593 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.870 7.378 6.216 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -15.221 8.849 6.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -17.422 9.182 5.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -16.270 10.131 5.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -16.864 8.715 4.435 1.00 0.00 H new ATOM 442 N THR A 29 -14.059 10.370 1.108 1.00 0.00 N ATOM 443 CA THR A 29 -15.221 10.921 0.462 1.00 0.00 C ATOM 444 C THR A 29 -15.695 9.931 -0.599 1.00 0.00 C ATOM 445 O THR A 29 -16.881 9.489 -0.622 1.00 0.00 O ATOM 446 CB THR A 29 -14.877 12.290 -0.175 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.379 13.178 0.845 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.093 12.917 -0.846 1.00 0.00 C ATOM 0 H THR A 29 -13.196 10.883 0.926 1.00 0.00 H new ATOM 0 HA THR A 29 -16.016 11.084 1.189 1.00 0.00 H new ATOM 0 HB THR A 29 -14.117 12.128 -0.940 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.425 13.008 0.989 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.814 13.876 -1.282 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.458 12.254 -1.631 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.879 13.070 -0.106 1.00 0.00 H new ATOM 456 N ALA A 30 -14.760 9.528 -1.435 1.00 0.00 N ATOM 457 CA ALA A 30 -15.004 8.581 -2.415 1.00 0.00 C ATOM 458 C ALA A 30 -15.287 7.230 -1.778 1.00 0.00 C ATOM 459 O ALA A 30 -16.046 6.521 -2.264 1.00 0.00 O ATOM 460 CB ALA A 30 -13.870 8.549 -3.387 1.00 0.00 C ATOM 0 H ALA A 30 -13.802 9.878 -1.423 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.895 8.850 -2.982 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.070 7.801 -4.155 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.763 9.528 -3.853 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -12.949 8.294 -2.863 1.00 0.00 H new ATOM 466 N ALA A 31 -14.707 6.949 -0.644 1.00 0.00 N ATOM 467 CA ALA A 31 -15.007 5.720 0.096 1.00 0.00 C ATOM 468 C ALA A 31 -16.486 5.617 0.459 1.00 0.00 C ATOM 469 O ALA A 31 -17.057 4.513 0.524 1.00 0.00 O ATOM 470 CB ALA A 31 -14.244 5.709 1.372 1.00 0.00 C ATOM 0 H ALA A 31 -14.016 7.550 -0.196 1.00 0.00 H new ATOM 0 HA ALA A 31 -14.733 4.886 -0.550 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.468 4.795 1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.176 5.752 1.158 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.528 6.573 1.973 1.00 0.00 H new ATOM 476 N SER A 32 -17.112 6.752 0.699 1.00 0.00 N ATOM 477 CA SER A 32 -18.468 6.738 1.125 1.00 0.00 C ATOM 478 C SER A 32 -19.403 6.511 -0.082 1.00 0.00 C ATOM 479 O SER A 32 -20.305 5.681 -0.034 1.00 0.00 O ATOM 480 CB SER A 32 -18.771 8.037 1.874 1.00 0.00 C ATOM 481 OG SER A 32 -17.768 8.262 2.894 1.00 0.00 O ATOM 0 H SER A 32 -16.696 7.678 0.603 1.00 0.00 H new ATOM 0 HA SER A 32 -18.643 5.911 1.813 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.787 8.874 1.176 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.760 7.983 2.329 1.00 0.00 H new ATOM 0 HG SER A 32 -16.910 8.472 2.469 1.00 0.00 H new ATOM 487 N GLN A 33 -19.147 7.213 -1.165 1.00 0.00 N ATOM 488 CA GLN A 33 -19.986 7.127 -2.362 1.00 0.00 C ATOM 489 C GLN A 33 -19.519 6.047 -3.330 1.00 0.00 C ATOM 490 O GLN A 33 -20.266 5.170 -3.754 1.00 0.00 O ATOM 491 CB GLN A 33 -19.872 8.444 -3.086 1.00 0.00 C ATOM 492 CG GLN A 33 -20.305 9.627 -2.295 1.00 0.00 C ATOM 493 CD GLN A 33 -21.779 9.666 -2.204 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.379 9.160 -1.260 1.00 0.00 O ATOM 495 NE2 GLN A 33 -22.378 10.214 -3.199 1.00 0.00 N ATOM 0 H GLN A 33 -18.361 7.857 -1.250 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.001 6.889 -2.045 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.835 8.587 -3.391 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.468 8.395 -3.997 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.872 9.584 -1.295 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.938 10.541 -2.762 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.835 10.621 -3.960 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -23.397 10.242 -3.228 1.00 0.00 H new ATOM 504 N TYR A 34 -18.278 6.139 -3.644 1.00 0.00 N ATOM 505 CA TYR A 34 -17.613 5.430 -4.714 1.00 0.00 C ATOM 506 C TYR A 34 -16.718 4.305 -4.175 1.00 0.00 C ATOM 507 O TYR A 34 -15.847 3.832 -4.893 1.00 0.00 O ATOM 508 CB TYR A 34 -16.706 6.466 -5.405 1.00 0.00 C ATOM 509 CG TYR A 34 -17.413 7.728 -5.837 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.577 7.686 -6.584 1.00 0.00 C ATOM 511 CD2 TYR A 34 -16.910 8.968 -5.478 1.00 0.00 C ATOM 512 CE1 TYR A 34 -19.219 8.845 -6.953 1.00 0.00 C ATOM 513 CE2 TYR A 34 -17.543 10.125 -5.845 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.693 10.063 -6.580 1.00 0.00 C ATOM 515 OH TYR A 34 -19.323 11.230 -6.945 1.00 0.00 O ATOM 0 H TYR A 34 -17.642 6.751 -3.133 1.00 0.00 H new ATOM 0 HA TYR A 34 -18.351 4.984 -5.381 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -15.897 6.733 -4.725 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -16.248 6.004 -6.279 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.986 6.732 -6.881 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -16.001 9.023 -4.897 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -20.130 8.801 -7.532 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.135 11.082 -5.555 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.819 11.996 -6.599 1.00 0.00 H new ATOM 525 N GLY A 35 -16.972 3.868 -2.923 1.00 0.00 N ATOM 526 CA GLY A 35 -16.095 2.887 -2.250 1.00 0.00 C ATOM 527 C GLY A 35 -16.012 1.571 -2.980 1.00 0.00 C ATOM 528 O GLY A 35 -14.944 0.996 -3.171 1.00 0.00 O ATOM 0 H GLY A 35 -17.768 4.175 -2.363 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -15.094 3.308 -2.156 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -16.463 2.713 -1.239 1.00 0.00 H new ATOM 532 N ALA A 36 -17.145 1.092 -3.335 1.00 0.00 N ATOM 533 CA ALA A 36 -17.266 -0.079 -4.154 1.00 0.00 C ATOM 534 C ALA A 36 -17.170 0.393 -5.558 1.00 0.00 C ATOM 535 O ALA A 36 -17.500 1.544 -5.823 1.00 0.00 O ATOM 536 CB ALA A 36 -18.549 -0.818 -3.876 1.00 0.00 C ATOM 0 H ALA A 36 -18.039 1.503 -3.065 1.00 0.00 H new ATOM 0 HA ALA A 36 -16.478 -0.801 -3.941 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -18.607 -1.700 -4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -18.573 -1.125 -2.830 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -19.397 -0.165 -4.082 1.00 0.00 H new ATOM 542 N THR A 37 -16.834 -0.510 -6.416 1.00 0.00 N ATOM 543 CA THR A 37 -16.292 -0.286 -7.752 1.00 0.00 C ATOM 544 C THR A 37 -16.811 0.897 -8.616 1.00 0.00 C ATOM 545 O THR A 37 -17.530 0.705 -9.610 1.00 0.00 O ATOM 546 CB THR A 37 -16.326 -1.566 -8.520 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.647 -2.137 -8.429 1.00 0.00 O ATOM 548 CG2 THR A 37 -15.352 -2.495 -7.899 1.00 0.00 C ATOM 0 H THR A 37 -16.931 -1.503 -6.205 1.00 0.00 H new ATOM 0 HA THR A 37 -15.281 0.061 -7.537 1.00 0.00 H new ATOM 0 HB THR A 37 -16.078 -1.392 -9.567 1.00 0.00 H new ATOM 0 HG1 THR A 37 -17.676 -2.977 -8.933 1.00 0.00 H new ATOM 0 HG21 THR A 37 -15.355 -3.441 -8.441 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.355 -2.057 -7.939 1.00 0.00 H new ATOM 0 HG23 THR A 37 -15.629 -2.671 -6.860 1.00 0.00 H new ATOM 556 N ALA A 38 -16.498 2.086 -8.190 1.00 0.00 N ATOM 557 CA ALA A 38 -16.665 3.272 -8.956 1.00 0.00 C ATOM 558 C ALA A 38 -15.281 3.819 -9.121 1.00 0.00 C ATOM 559 O ALA A 38 -14.751 4.396 -8.168 1.00 0.00 O ATOM 560 CB ALA A 38 -17.570 4.264 -8.228 1.00 0.00 C ATOM 0 H ALA A 38 -16.105 2.255 -7.264 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.142 3.080 -9.917 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.684 5.164 -8.832 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.548 3.811 -8.063 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.125 4.526 -7.268 1.00 0.00 H new ATOM 566 N PRO A 39 -14.654 3.573 -10.326 1.00 0.00 N ATOM 567 CA PRO A 39 -13.233 3.816 -10.665 1.00 0.00 C ATOM 568 C PRO A 39 -12.453 4.847 -9.840 1.00 0.00 C ATOM 569 O PRO A 39 -11.296 4.599 -9.492 1.00 0.00 O ATOM 570 CB PRO A 39 -13.314 4.247 -12.119 1.00 0.00 C ATOM 571 CG PRO A 39 -14.460 3.477 -12.683 1.00 0.00 C ATOM 572 CD PRO A 39 -15.323 3.013 -11.523 1.00 0.00 C ATOM 0 HA PRO A 39 -12.659 2.915 -10.448 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.479 5.321 -12.204 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.388 4.024 -12.650 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.039 4.099 -13.365 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.101 2.623 -13.257 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.345 3.379 -11.616 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.377 1.925 -11.477 1.00 0.00 H new ATOM 580 N TYR A 40 -13.096 5.955 -9.518 1.00 0.00 N ATOM 581 CA TYR A 40 -12.477 7.078 -8.854 1.00 0.00 C ATOM 582 C TYR A 40 -11.666 6.684 -7.605 1.00 0.00 C ATOM 583 O TYR A 40 -10.442 6.849 -7.600 1.00 0.00 O ATOM 584 CB TYR A 40 -13.529 8.136 -8.503 1.00 0.00 C ATOM 585 CG TYR A 40 -12.946 9.426 -8.012 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.267 10.259 -8.881 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.055 9.803 -6.693 1.00 0.00 C ATOM 588 CE1 TYR A 40 -11.709 11.436 -8.455 1.00 0.00 C ATOM 589 CE2 TYR A 40 -12.502 10.984 -6.247 1.00 0.00 C ATOM 590 CZ TYR A 40 -11.824 11.800 -7.142 1.00 0.00 C ATOM 591 OH TYR A 40 -11.251 12.979 -6.721 1.00 0.00 O ATOM 0 H TYR A 40 -14.086 6.098 -9.717 1.00 0.00 H new ATOM 0 HA TYR A 40 -11.760 7.496 -9.561 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.139 8.335 -9.384 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.195 7.734 -7.739 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -12.174 9.976 -9.919 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.581 9.165 -5.998 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -11.182 12.072 -9.151 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.595 11.272 -5.210 1.00 0.00 H new ATOM 0 HH TYR A 40 -10.434 12.784 -6.217 1.00 0.00 H new ATOM 601 N THR A 41 -12.319 6.133 -6.570 1.00 0.00 N ATOM 602 CA THR A 41 -11.637 5.853 -5.314 1.00 0.00 C ATOM 603 C THR A 41 -10.530 4.793 -5.487 1.00 0.00 C ATOM 604 O THR A 41 -9.464 4.896 -4.888 1.00 0.00 O ATOM 605 CB THR A 41 -12.652 5.433 -4.166 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.211 5.927 -2.905 1.00 0.00 O ATOM 607 CG2 THR A 41 -12.791 3.933 -4.036 1.00 0.00 C ATOM 0 H THR A 41 -13.307 5.878 -6.585 1.00 0.00 H new ATOM 0 HA THR A 41 -11.160 6.783 -5.005 1.00 0.00 H new ATOM 0 HB THR A 41 -13.615 5.861 -4.446 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.848 5.661 -2.209 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.496 3.701 -3.238 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.157 3.519 -4.975 1.00 0.00 H new ATOM 0 HG23 THR A 41 -11.820 3.497 -3.801 1.00 0.00 H new ATOM 615 N LEU A 42 -10.733 3.844 -6.383 1.00 0.00 N ATOM 616 CA LEU A 42 -9.814 2.739 -6.477 1.00 0.00 C ATOM 617 C LEU A 42 -8.590 3.201 -7.248 1.00 0.00 C ATOM 618 O LEU A 42 -7.480 2.703 -7.039 1.00 0.00 O ATOM 619 CB LEU A 42 -10.422 1.460 -7.128 1.00 0.00 C ATOM 620 CG LEU A 42 -11.869 1.010 -6.773 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.049 0.755 -5.299 1.00 0.00 C ATOM 622 CD2 LEU A 42 -12.931 1.950 -7.314 1.00 0.00 C ATOM 0 H LEU A 42 -11.512 3.820 -7.041 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.552 2.443 -5.461 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.383 1.598 -8.208 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.758 0.629 -6.889 1.00 0.00 H new ATOM 0 HG LEU A 42 -12.012 0.056 -7.281 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.076 0.444 -5.106 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.365 -0.032 -4.980 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -11.836 1.668 -4.743 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -13.918 1.583 -7.034 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -12.782 2.946 -6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -12.856 1.997 -8.400 1.00 0.00 H new ATOM 634 N ALA A 43 -8.804 4.192 -8.128 1.00 0.00 N ATOM 635 CA ALA A 43 -7.729 4.833 -8.863 1.00 0.00 C ATOM 636 C ALA A 43 -6.834 5.583 -7.897 1.00 0.00 C ATOM 637 O ALA A 43 -5.607 5.636 -8.046 1.00 0.00 O ATOM 638 CB ALA A 43 -8.270 5.766 -9.945 1.00 0.00 C ATOM 0 H ALA A 43 -9.730 4.563 -8.342 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.145 4.064 -9.368 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.438 6.229 -10.476 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.876 5.195 -10.648 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.883 6.541 -9.484 1.00 0.00 H new ATOM 644 N ILE A 44 -7.438 6.107 -6.876 1.00 0.00 N ATOM 645 CA ILE A 44 -6.695 6.809 -5.879 1.00 0.00 C ATOM 646 C ILE A 44 -5.932 5.788 -5.015 1.00 0.00 C ATOM 647 O ILE A 44 -4.792 6.032 -4.629 1.00 0.00 O ATOM 648 CB ILE A 44 -7.609 7.686 -5.026 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.463 8.566 -5.950 1.00 0.00 C ATOM 650 CG2 ILE A 44 -6.783 8.548 -4.049 1.00 0.00 C ATOM 651 CD1 ILE A 44 -9.567 9.301 -5.255 1.00 0.00 C ATOM 0 H ILE A 44 -8.444 6.061 -6.712 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.980 7.475 -6.362 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.265 7.053 -4.428 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.815 9.290 -6.443 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -8.895 7.940 -6.731 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -7.454 9.165 -3.451 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.204 7.899 -3.391 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.106 9.190 -4.613 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.120 9.898 -5.980 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.241 8.585 -4.785 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.145 9.956 -4.493 1.00 0.00 H new ATOM 663 N VAL A 45 -6.553 4.616 -4.775 1.00 0.00 N ATOM 664 CA VAL A 45 -5.902 3.501 -4.053 1.00 0.00 C ATOM 665 C VAL A 45 -4.559 3.155 -4.713 1.00 0.00 C ATOM 666 O VAL A 45 -3.496 3.187 -4.063 1.00 0.00 O ATOM 667 CB VAL A 45 -6.787 2.204 -4.039 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.053 1.030 -3.428 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.096 2.412 -3.304 1.00 0.00 C ATOM 0 H VAL A 45 -7.508 4.415 -5.071 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.756 3.837 -3.026 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.006 1.981 -5.083 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.699 0.152 -3.437 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.152 0.823 -4.006 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.778 1.268 -2.400 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.674 1.488 -3.321 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.892 2.694 -2.271 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.665 3.204 -3.791 1.00 0.00 H new ATOM 679 N GLU A 46 -4.608 2.874 -6.017 1.00 0.00 N ATOM 680 CA GLU A 46 -3.422 2.515 -6.777 1.00 0.00 C ATOM 681 C GLU A 46 -2.402 3.652 -6.828 1.00 0.00 C ATOM 682 O GLU A 46 -1.205 3.396 -6.870 1.00 0.00 O ATOM 683 CB GLU A 46 -3.787 1.961 -8.172 1.00 0.00 C ATOM 684 CG GLU A 46 -4.823 2.782 -8.905 1.00 0.00 C ATOM 685 CD GLU A 46 -5.149 2.281 -10.288 1.00 0.00 C ATOM 686 OE1 GLU A 46 -4.382 2.553 -11.235 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.203 1.628 -10.463 1.00 0.00 O ATOM 0 H GLU A 46 -5.467 2.890 -6.567 1.00 0.00 H new ATOM 0 HA GLU A 46 -2.927 1.702 -6.245 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.883 1.908 -8.779 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.157 0.942 -8.062 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.738 2.802 -8.314 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.469 3.810 -8.978 1.00 0.00 H new ATOM 694 N SER A 47 -2.885 4.897 -6.747 1.00 0.00 N ATOM 695 CA SER A 47 -2.019 6.060 -6.706 1.00 0.00 C ATOM 696 C SER A 47 -1.255 6.116 -5.366 1.00 0.00 C ATOM 697 O SER A 47 -0.072 6.437 -5.328 1.00 0.00 O ATOM 698 CB SER A 47 -2.838 7.349 -6.877 1.00 0.00 C ATOM 699 OG SER A 47 -3.560 7.361 -8.097 1.00 0.00 O ATOM 0 H SER A 47 -3.880 5.116 -6.709 1.00 0.00 H new ATOM 0 HA SER A 47 -1.305 5.978 -7.525 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.533 7.450 -6.043 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.171 8.210 -6.842 1.00 0.00 H new ATOM 0 HG SER A 47 -4.401 6.871 -7.984 1.00 0.00 H new ATOM 705 N VAL A 48 -1.924 5.770 -4.279 1.00 0.00 N ATOM 706 CA VAL A 48 -1.302 5.829 -2.956 1.00 0.00 C ATOM 707 C VAL A 48 -0.331 4.649 -2.756 1.00 0.00 C ATOM 708 O VAL A 48 0.745 4.808 -2.178 1.00 0.00 O ATOM 709 CB VAL A 48 -2.356 5.861 -1.810 1.00 0.00 C ATOM 710 CG1 VAL A 48 -1.678 5.940 -0.447 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.319 7.036 -1.974 1.00 0.00 C ATOM 0 H VAL A 48 -2.891 5.447 -4.280 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.741 6.763 -2.910 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.926 4.933 -1.869 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.436 5.961 0.336 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.037 5.069 -0.308 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.075 6.846 -0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.042 7.030 -1.158 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.759 7.971 -1.956 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.844 6.946 -2.925 1.00 0.00 H new ATOM 721 N ALA A 49 -0.690 3.477 -3.292 1.00 0.00 N ATOM 722 CA ALA A 49 0.159 2.285 -3.168 1.00 0.00 C ATOM 723 C ALA A 49 1.323 2.345 -4.155 1.00 0.00 C ATOM 724 O ALA A 49 2.156 1.464 -4.189 1.00 0.00 O ATOM 725 CB ALA A 49 -0.644 1.012 -3.412 1.00 0.00 C ATOM 0 H ALA A 49 -1.555 3.328 -3.812 1.00 0.00 H new ATOM 0 HA ALA A 49 0.550 2.267 -2.151 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.010 0.145 -3.314 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.449 0.944 -2.681 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.067 1.036 -4.416 1.00 0.00 H new ATOM 731 N ASP A 50 1.332 3.371 -4.986 1.00 0.00 N ATOM 732 CA ASP A 50 2.390 3.609 -5.982 1.00 0.00 C ATOM 733 C ASP A 50 3.628 4.255 -5.322 1.00 0.00 C ATOM 734 O ASP A 50 4.618 4.576 -5.963 1.00 0.00 O ATOM 735 CB ASP A 50 1.806 4.472 -7.124 1.00 0.00 C ATOM 736 CG ASP A 50 2.804 4.935 -8.181 1.00 0.00 C ATOM 737 OD1 ASP A 50 3.194 4.137 -9.071 1.00 0.00 O ATOM 738 OD2 ASP A 50 3.166 6.125 -8.168 1.00 0.00 O ATOM 0 H ASP A 50 0.599 4.080 -4.997 1.00 0.00 H new ATOM 0 HA ASP A 50 2.732 2.664 -6.405 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.019 3.903 -7.619 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.335 5.352 -6.685 1.00 0.00 H new ATOM 743 N ASN A 51 3.556 4.396 -4.019 1.00 0.00 N ATOM 744 CA ASN A 51 4.620 5.009 -3.216 1.00 0.00 C ATOM 745 C ASN A 51 5.447 3.897 -2.550 1.00 0.00 C ATOM 746 O ASN A 51 5.129 2.733 -2.680 1.00 0.00 O ATOM 747 CB ASN A 51 4.020 5.895 -2.095 1.00 0.00 C ATOM 748 CG ASN A 51 3.189 7.113 -2.528 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.535 7.053 -3.670 1.00 0.00 O flip ATOM 750 ND2 ASN A 51 3.127 8.103 -1.800 1.00 0.00 N flip ATOM 0 H ASN A 51 2.754 4.089 -3.469 1.00 0.00 H new ATOM 0 HA ASN A 51 5.238 5.622 -3.872 1.00 0.00 H new ATOM 0 HB2 ASN A 51 3.391 5.264 -1.466 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.840 6.251 -1.471 1.00 0.00 H new ATOM 0 HD21 ASN A 51 3.644 8.123 -0.921 1.00 0.00 H new ATOM 0 HD22 ASN A 51 2.559 8.904 -2.076 1.00 0.00 H new ATOM 757 N TRP A 52 6.473 4.279 -1.801 1.00 0.00 N ATOM 758 CA TRP A 52 7.306 3.305 -1.055 1.00 0.00 C ATOM 759 C TRP A 52 6.818 3.221 0.393 1.00 0.00 C ATOM 760 O TRP A 52 7.537 2.749 1.282 1.00 0.00 O ATOM 761 CB TRP A 52 8.784 3.737 -1.051 1.00 0.00 C ATOM 762 CG TRP A 52 9.378 3.839 -2.405 1.00 0.00 C ATOM 763 CD1 TRP A 52 9.858 2.816 -3.172 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.579 5.038 -3.153 1.00 0.00 C ATOM 765 NE1 TRP A 52 10.324 3.308 -4.364 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.162 4.666 -4.377 1.00 0.00 C ATOM 767 CE3 TRP A 52 9.308 6.399 -2.914 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.483 5.593 -5.354 1.00 0.00 C ATOM 769 CZ3 TRP A 52 9.628 7.314 -3.886 1.00 0.00 C ATOM 770 CH2 TRP A 52 10.208 6.906 -5.097 1.00 0.00 C ATOM 0 H TRP A 52 6.759 5.251 -1.685 1.00 0.00 H new ATOM 0 HA TRP A 52 7.219 2.335 -1.545 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.870 4.702 -0.552 1.00 0.00 H new ATOM 0 HB3 TRP A 52 9.361 3.023 -0.464 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.869 1.775 -2.883 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.726 2.752 -5.118 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.858 6.716 -1.985 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 10.935 5.289 -6.286 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 9.431 8.362 -3.716 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.443 7.649 -5.845 1.00 0.00 H new ATOM 781 N LEU A 53 5.640 3.803 0.598 1.00 0.00 N ATOM 782 CA LEU A 53 4.948 3.856 1.891 1.00 0.00 C ATOM 783 C LEU A 53 5.045 2.536 2.676 1.00 0.00 C ATOM 784 O LEU A 53 4.911 1.441 2.131 1.00 0.00 O ATOM 785 CB LEU A 53 3.481 4.302 1.748 1.00 0.00 C ATOM 786 CG LEU A 53 2.444 3.304 1.190 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.070 3.948 1.189 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.787 2.842 -0.210 1.00 0.00 C ATOM 0 H LEU A 53 5.122 4.265 -0.149 1.00 0.00 H new ATOM 0 HA LEU A 53 5.472 4.614 2.473 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.136 4.618 2.733 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.467 5.184 1.107 1.00 0.00 H new ATOM 0 HG LEU A 53 2.452 2.426 1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.338 3.243 0.795 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.797 4.224 2.208 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.087 4.841 0.564 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.028 2.142 -0.558 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.821 3.702 -0.879 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.759 2.349 -0.203 1.00 0.00 H new ATOM 800 N THR A 54 5.281 2.683 3.952 1.00 0.00 N ATOM 801 CA THR A 54 5.543 1.572 4.837 1.00 0.00 C ATOM 802 C THR A 54 4.228 0.860 5.278 1.00 0.00 C ATOM 803 O THR A 54 3.128 1.365 4.996 1.00 0.00 O ATOM 804 CB THR A 54 6.343 2.086 6.058 1.00 0.00 C ATOM 805 OG1 THR A 54 5.609 3.100 6.741 1.00 0.00 O ATOM 806 CG2 THR A 54 7.678 2.655 5.612 1.00 0.00 C ATOM 0 H THR A 54 5.298 3.591 4.416 1.00 0.00 H new ATOM 0 HA THR A 54 6.132 0.825 4.305 1.00 0.00 H new ATOM 0 HB THR A 54 6.513 1.246 6.731 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.926 3.469 6.143 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.230 3.013 6.481 1.00 0.00 H new ATOM 0 HG22 THR A 54 8.255 1.878 5.110 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.509 3.483 4.924 1.00 0.00 H new ATOM 814 N PRO A 55 4.306 -0.310 5.995 1.00 0.00 N ATOM 815 CA PRO A 55 3.118 -1.050 6.454 1.00 0.00 C ATOM 816 C PRO A 55 2.225 -0.218 7.370 1.00 0.00 C ATOM 817 O PRO A 55 1.001 -0.366 7.351 1.00 0.00 O ATOM 818 CB PRO A 55 3.710 -2.260 7.210 1.00 0.00 C ATOM 819 CG PRO A 55 5.072 -2.411 6.648 1.00 0.00 C ATOM 820 CD PRO A 55 5.546 -1.020 6.377 1.00 0.00 C ATOM 0 HA PRO A 55 2.472 -1.332 5.623 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.741 -2.081 8.285 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.113 -3.158 7.053 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.732 -2.921 7.349 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.056 -3.006 5.735 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.011 -0.574 7.256 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.287 -0.995 5.578 1.00 0.00 H new ATOM 828 N THR A 56 2.824 0.678 8.140 1.00 0.00 N ATOM 829 CA THR A 56 2.054 1.526 9.013 1.00 0.00 C ATOM 830 C THR A 56 1.230 2.527 8.173 1.00 0.00 C ATOM 831 O THR A 56 0.079 2.823 8.512 1.00 0.00 O ATOM 832 CB THR A 56 2.934 2.237 10.109 1.00 0.00 C ATOM 833 OG1 THR A 56 2.106 3.028 10.988 1.00 0.00 O ATOM 834 CG2 THR A 56 4.016 3.124 9.489 1.00 0.00 C ATOM 0 H THR A 56 3.832 0.830 8.173 1.00 0.00 H new ATOM 0 HA THR A 56 1.363 0.896 9.573 1.00 0.00 H new ATOM 0 HB THR A 56 3.428 1.451 10.681 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.668 3.462 11.664 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.599 3.594 10.281 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.673 2.516 8.867 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.548 3.895 8.876 1.00 0.00 H new ATOM 842 N ASP A 57 1.814 2.999 7.055 1.00 0.00 N ATOM 843 CA ASP A 57 1.106 3.869 6.111 1.00 0.00 C ATOM 844 C ASP A 57 -0.035 3.111 5.495 1.00 0.00 C ATOM 845 O ASP A 57 -1.166 3.574 5.486 1.00 0.00 O ATOM 846 CB ASP A 57 2.004 4.380 4.962 1.00 0.00 C ATOM 847 CG ASP A 57 3.117 5.296 5.372 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.875 6.490 5.579 1.00 0.00 O ATOM 849 OD2 ASP A 57 4.275 4.848 5.457 1.00 0.00 O ATOM 0 H ASP A 57 2.776 2.789 6.788 1.00 0.00 H new ATOM 0 HA ASP A 57 0.764 4.731 6.684 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.435 3.519 4.451 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.377 4.900 4.238 1.00 0.00 H new ATOM 854 N TRP A 58 0.284 1.928 4.980 1.00 0.00 N ATOM 855 CA TRP A 58 -0.693 1.055 4.361 1.00 0.00 C ATOM 856 C TRP A 58 -1.862 0.751 5.273 1.00 0.00 C ATOM 857 O TRP A 58 -3.005 1.138 4.990 1.00 0.00 O ATOM 858 CB TRP A 58 -0.074 -0.277 3.937 1.00 0.00 C ATOM 859 CG TRP A 58 0.439 -0.348 2.538 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.254 0.552 1.534 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.166 -1.434 1.972 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.845 0.102 0.383 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.410 -1.114 0.626 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.640 -2.647 2.477 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.109 -1.957 -0.223 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.334 -3.487 1.631 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.558 -3.137 0.290 1.00 0.00 C ATOM 0 H TRP A 58 1.232 1.551 4.983 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.049 1.601 3.487 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.748 -0.504 4.616 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.821 -1.060 4.068 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.281 1.485 1.631 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.860 0.596 -0.509 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.467 -2.921 3.507 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.291 -1.689 -1.253 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.710 -4.427 2.006 1.00 0.00 H new ATOM 0 HH2 TRP A 58 3.099 -3.819 -0.350 1.00 0.00 H new ATOM 878 N ASN A 59 -1.582 0.057 6.369 1.00 0.00 N ATOM 879 CA ASN A 59 -2.627 -0.396 7.255 1.00 0.00 C ATOM 880 C ASN A 59 -3.452 0.736 7.784 1.00 0.00 C ATOM 881 O ASN A 59 -4.629 0.598 7.891 1.00 0.00 O ATOM 882 CB ASN A 59 -2.119 -1.324 8.366 1.00 0.00 C ATOM 883 CG ASN A 59 -1.693 -2.689 7.816 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.243 -3.178 6.793 1.00 0.00 O ATOM 885 ND2 ASN A 59 -0.752 -3.317 8.473 1.00 0.00 N ATOM 0 H ASN A 59 -0.638 -0.200 6.659 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.291 -1.008 6.645 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.275 -0.856 8.872 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.902 -1.461 9.112 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.439 -4.236 8.161 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.331 -2.887 9.297 1.00 0.00 H new ATOM 892 N THR A 60 -2.842 1.895 7.995 1.00 0.00 N ATOM 893 CA THR A 60 -3.617 3.014 8.492 1.00 0.00 C ATOM 894 C THR A 60 -4.473 3.668 7.369 1.00 0.00 C ATOM 895 O THR A 60 -5.569 4.162 7.634 1.00 0.00 O ATOM 896 CB THR A 60 -2.744 4.050 9.233 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.974 3.371 10.239 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.612 5.108 9.915 1.00 0.00 C ATOM 0 H THR A 60 -1.851 2.078 7.836 1.00 0.00 H new ATOM 0 HA THR A 60 -4.311 2.612 9.230 1.00 0.00 H new ATOM 0 HB THR A 60 -2.094 4.541 8.508 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.126 3.068 9.853 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.973 5.826 10.430 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.210 5.626 9.165 1.00 0.00 H new ATOM 0 HG23 THR A 60 -4.272 4.627 10.637 1.00 0.00 H new ATOM 906 N LEU A 61 -4.003 3.597 6.123 1.00 0.00 N ATOM 907 CA LEU A 61 -4.715 4.151 4.964 1.00 0.00 C ATOM 908 C LEU A 61 -6.050 3.431 4.811 1.00 0.00 C ATOM 909 O LEU A 61 -7.098 4.059 4.907 1.00 0.00 O ATOM 910 CB LEU A 61 -3.819 3.992 3.686 1.00 0.00 C ATOM 911 CG LEU A 61 -4.268 4.613 2.324 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.458 3.904 1.718 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.542 6.099 2.467 1.00 0.00 C ATOM 0 H LEU A 61 -3.116 3.153 5.885 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.916 5.213 5.105 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.841 4.410 3.924 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.678 2.924 3.522 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.436 4.475 1.633 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.723 4.380 0.774 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.206 2.859 1.539 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.304 3.961 2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.853 6.506 1.505 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.334 6.254 3.199 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.636 6.606 2.800 1.00 0.00 H new ATOM 925 N VAL A 62 -5.997 2.108 4.651 1.00 0.00 N ATOM 926 CA VAL A 62 -7.208 1.289 4.436 1.00 0.00 C ATOM 927 C VAL A 62 -8.133 1.368 5.649 1.00 0.00 C ATOM 928 O VAL A 62 -9.360 1.492 5.530 1.00 0.00 O ATOM 929 CB VAL A 62 -6.843 -0.211 4.119 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.923 -0.811 5.175 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.099 -1.057 3.992 1.00 0.00 C ATOM 0 H VAL A 62 -5.129 1.572 4.665 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.731 1.695 3.570 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.310 -0.213 3.168 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.698 -1.846 4.916 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.997 -0.238 5.219 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.415 -0.779 6.147 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.822 -2.088 3.773 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.658 -1.022 4.927 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.719 -0.668 3.184 1.00 0.00 H new ATOM 941 N ARG A 63 -7.496 1.361 6.782 1.00 0.00 N ATOM 942 CA ARG A 63 -8.129 1.397 8.117 1.00 0.00 C ATOM 943 C ARG A 63 -9.021 2.614 8.285 1.00 0.00 C ATOM 944 O ARG A 63 -10.058 2.556 8.953 1.00 0.00 O ATOM 945 CB ARG A 63 -7.009 1.459 9.104 1.00 0.00 C ATOM 946 CG ARG A 63 -7.296 1.390 10.572 1.00 0.00 C ATOM 947 CD ARG A 63 -5.942 1.375 11.274 1.00 0.00 C ATOM 948 NE ARG A 63 -6.033 1.317 12.726 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.989 1.305 13.572 1.00 0.00 C ATOM 950 NH1 ARG A 63 -3.724 1.319 13.109 1.00 0.00 N ATOM 951 NH2 ARG A 63 -5.213 1.291 14.881 1.00 0.00 N ATOM 0 H ARG A 63 -6.478 1.329 6.830 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.761 0.520 8.258 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.325 0.643 8.869 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.470 2.389 8.923 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.890 2.246 10.892 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.869 0.495 10.814 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.370 0.517 10.921 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.386 2.268 10.990 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.967 1.283 13.135 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.549 1.339 12.104 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.941 1.310 13.763 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.170 1.289 15.235 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.428 1.282 15.533 1.00 0.00 H new ATOM 965 N ALA A 64 -8.627 3.699 7.679 1.00 0.00 N ATOM 966 CA ALA A 64 -9.370 4.922 7.794 1.00 0.00 C ATOM 967 C ALA A 64 -10.340 5.132 6.625 1.00 0.00 C ATOM 968 O ALA A 64 -11.553 5.257 6.829 1.00 0.00 O ATOM 969 CB ALA A 64 -8.400 6.089 7.899 1.00 0.00 C ATOM 0 H ALA A 64 -7.791 3.761 7.098 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.979 4.861 8.696 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.959 7.020 7.987 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.770 5.960 8.779 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.775 6.124 7.007 1.00 0.00 H new ATOM 975 N VAL A 65 -9.762 5.271 5.454 1.00 0.00 N ATOM 976 CA VAL A 65 -10.524 5.581 4.223 1.00 0.00 C ATOM 977 C VAL A 65 -11.831 4.762 4.031 1.00 0.00 C ATOM 978 O VAL A 65 -12.916 5.336 4.113 1.00 0.00 O ATOM 979 CB VAL A 65 -9.651 5.641 2.948 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.529 6.657 3.163 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.091 4.270 2.542 1.00 0.00 C ATOM 0 H VAL A 65 -8.757 5.177 5.307 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.872 6.600 4.393 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.283 5.957 2.118 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.907 6.707 2.269 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.960 7.639 3.361 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.919 6.351 4.013 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.487 4.376 1.641 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.473 3.876 3.349 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.915 3.583 2.348 1.00 0.00 H new ATOM 991 N LEU A 66 -11.760 3.461 3.806 1.00 0.00 N ATOM 992 CA LEU A 66 -12.977 2.669 3.679 1.00 0.00 C ATOM 993 C LEU A 66 -13.341 2.068 5.024 1.00 0.00 C ATOM 994 O LEU A 66 -12.576 2.171 5.998 1.00 0.00 O ATOM 995 CB LEU A 66 -12.866 1.537 2.599 1.00 0.00 C ATOM 996 CG LEU A 66 -13.225 1.847 1.125 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.690 2.155 0.990 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.369 2.958 0.569 1.00 0.00 C ATOM 0 H LEU A 66 -10.891 2.936 3.709 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.762 3.346 3.343 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.839 1.171 2.614 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.502 0.714 2.923 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.014 0.957 0.532 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.922 2.370 -0.053 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.274 1.297 1.322 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -14.938 3.022 1.603 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.648 3.149 -0.467 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.520 3.863 1.158 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.320 2.666 0.614 1.00 0.00 H new ATOM 1010 N SER A 67 -14.473 1.452 5.064 1.00 0.00 N ATOM 1011 CA SER A 67 -14.970 0.814 6.268 1.00 0.00 C ATOM 1012 C SER A 67 -16.012 -0.241 5.917 1.00 0.00 C ATOM 1013 O SER A 67 -17.058 0.064 5.339 1.00 0.00 O ATOM 1014 CB SER A 67 -15.533 1.845 7.271 1.00 0.00 C ATOM 1015 OG SER A 67 -14.509 2.768 7.696 1.00 0.00 O ATOM 0 H SER A 67 -15.097 1.368 4.262 1.00 0.00 H new ATOM 0 HA SER A 67 -14.130 0.320 6.757 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.354 2.395 6.810 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.943 1.327 8.138 1.00 0.00 H new ATOM 0 HG SER A 67 -13.631 2.431 7.421 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.692 -1.460 6.218 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.569 -2.550 5.975 1.00 0.00 C ATOM 1023 C GLY A 68 -16.036 -3.409 4.864 1.00 0.00 C ATOM 1024 O GLY A 68 -15.336 -4.412 5.109 1.00 0.00 O ATOM 0 H GLY A 68 -14.804 -1.724 6.644 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.681 -3.144 6.882 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.559 -2.178 5.713 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.336 -3.014 3.651 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.890 -3.732 2.492 1.00 0.00 C ATOM 1030 C GLY A 69 -14.373 -3.816 2.368 1.00 0.00 C ATOM 1031 O GLY A 69 -13.844 -4.836 1.892 1.00 0.00 O ATOM 0 H GLY A 69 -16.895 -2.187 3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.300 -4.742 2.521 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.292 -3.251 1.601 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.691 -2.750 2.802 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.216 -2.641 2.757 1.00 0.00 C ATOM 1037 C ASP A 70 -11.543 -3.898 3.221 1.00 0.00 C ATOM 1038 O ASP A 70 -10.941 -4.604 2.422 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.692 -1.427 3.579 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.903 -1.526 5.085 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.049 -1.597 5.520 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.919 -1.619 5.835 1.00 0.00 O ATOM 0 H ASP A 70 -14.145 -1.928 3.199 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.961 -2.481 1.709 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.626 -1.309 3.384 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.184 -0.524 3.218 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.731 -4.228 4.464 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.058 -5.318 5.053 1.00 0.00 C ATOM 1049 C HIS A 71 -11.410 -6.625 4.401 1.00 0.00 C ATOM 1050 O HIS A 71 -10.526 -7.394 4.063 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.184 -5.332 6.590 1.00 0.00 C ATOM 1052 CG HIS A 71 -12.575 -5.278 7.162 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -13.308 -6.396 7.483 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -13.338 -4.223 7.513 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -14.457 -6.032 8.004 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -14.506 -4.720 8.037 1.00 0.00 N ATOM 0 H HIS A 71 -12.365 -3.735 5.093 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.995 -5.176 4.859 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -10.700 -6.235 6.961 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -10.623 -4.485 6.984 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -13.079 -3.180 7.402 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -15.233 -6.700 8.348 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -15.283 -4.163 8.393 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.672 -6.811 4.093 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.080 -8.047 3.517 1.00 0.00 C ATOM 1067 C LEU A 72 -12.483 -8.299 2.133 1.00 0.00 C ATOM 1068 O LEU A 72 -11.737 -9.248 1.971 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.600 -8.368 3.692 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.657 -7.283 3.404 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.961 -7.153 1.930 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.920 -7.566 4.182 1.00 0.00 C ATOM 0 H LEU A 72 -13.416 -6.127 4.233 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.619 -8.825 4.125 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.827 -9.220 3.051 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.745 -8.696 4.721 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.240 -6.330 3.728 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.711 -6.376 1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.051 -6.887 1.393 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.341 -8.102 1.552 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.659 -6.793 3.970 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.318 -8.538 3.889 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.697 -7.572 5.249 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.681 -7.429 1.186 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.114 -7.708 -0.124 1.00 0.00 C ATOM 1086 C LEU A 73 -10.667 -7.277 -0.252 1.00 0.00 C ATOM 1087 O LEU A 73 -9.792 -8.140 -0.488 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.967 -7.200 -1.269 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.986 -8.209 -1.897 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.335 -9.520 -2.337 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -15.149 -8.493 -0.976 1.00 0.00 C ATOM 0 H LEU A 73 -13.203 -6.557 1.274 1.00 0.00 H new ATOM 0 HA LEU A 73 -12.117 -8.795 -0.205 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.523 -6.331 -0.918 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.302 -6.854 -2.060 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.365 -7.713 -2.791 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.093 -10.177 -2.764 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.570 -9.313 -3.086 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.877 -10.006 -1.475 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.829 -9.198 -1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.779 -8.921 -0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.680 -7.565 -0.763 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.398 -5.968 -0.066 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.049 -5.425 -0.131 1.00 0.00 C ATOM 1105 C TRP A 74 -8.106 -6.237 0.752 1.00 0.00 C ATOM 1106 O TRP A 74 -7.057 -6.641 0.358 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.980 -3.957 0.392 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.634 -2.779 -0.397 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.514 -2.786 -1.452 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.350 -1.392 -0.149 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.852 -1.466 -1.805 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.155 -0.599 -0.989 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.512 -0.793 0.727 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.138 0.819 -0.942 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.458 0.618 0.801 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.285 1.419 -0.022 1.00 0.00 C ATOM 0 H TRP A 74 -11.115 -5.270 0.132 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.759 -5.464 -1.181 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.421 -3.955 1.389 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.925 -3.712 0.510 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -10.891 -3.673 -1.939 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.504 -1.195 -2.542 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.884 -1.392 1.370 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.763 1.409 -1.595 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.777 1.090 1.494 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.254 2.495 0.064 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.512 -6.470 1.932 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.629 -7.032 2.921 1.00 0.00 C ATOM 1129 C LYS A 75 -7.511 -8.538 2.994 1.00 0.00 C ATOM 1130 O LYS A 75 -6.405 -9.032 3.255 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.739 -6.329 4.244 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.562 -4.831 4.051 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.126 -4.442 3.705 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.253 -4.462 4.975 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.899 -3.887 4.776 1.00 0.00 N ATOM 0 H LYS A 75 -9.459 -6.285 2.261 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.638 -6.808 2.526 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.710 -6.534 4.695 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.982 -6.708 4.931 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.227 -4.491 3.257 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.864 -4.314 4.962 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.722 -5.133 2.965 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.108 -3.449 3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.761 -3.908 5.764 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.154 -5.491 5.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.531 -3.542 5.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.263 -4.619 4.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.953 -3.097 4.102 1.00 0.00 H new ATOM 1149 N SER A 76 -8.598 -9.292 2.778 1.00 0.00 N ATOM 1150 CA SER A 76 -8.448 -10.753 2.770 1.00 0.00 C ATOM 1151 C SER A 76 -7.527 -11.120 1.628 1.00 0.00 C ATOM 1152 O SER A 76 -6.603 -11.937 1.769 1.00 0.00 O ATOM 1153 CB SER A 76 -9.787 -11.464 2.629 1.00 0.00 C ATOM 1154 OG SER A 76 -10.704 -11.003 3.603 1.00 0.00 O ATOM 0 H SER A 76 -9.541 -8.940 2.615 1.00 0.00 H new ATOM 0 HA SER A 76 -8.027 -11.075 3.722 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.192 -11.293 1.632 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.646 -12.540 2.735 1.00 0.00 H new ATOM 0 HG SER A 76 -11.393 -10.456 3.171 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.706 -10.423 0.524 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.882 -10.640 -0.607 1.00 0.00 C ATOM 1162 C GLU A 77 -5.508 -10.075 -0.420 1.00 0.00 C ATOM 1163 O GLU A 77 -4.580 -10.607 -0.997 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.500 -10.090 -1.850 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.705 -10.841 -2.322 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.378 -12.252 -2.711 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.794 -12.442 -3.800 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.722 -13.195 -1.973 1.00 0.00 O ATOM 0 H GLU A 77 -8.420 -9.705 0.404 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.788 -11.720 -0.717 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.779 -9.051 -1.674 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.753 -10.089 -2.644 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.458 -10.849 -1.534 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.142 -10.323 -3.175 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.365 -8.988 0.382 1.00 0.00 N ATOM 1176 CA PHE A 78 -4.052 -8.411 0.640 1.00 0.00 C ATOM 1177 C PHE A 78 -3.149 -9.452 1.185 1.00 0.00 C ATOM 1178 O PHE A 78 -2.112 -9.714 0.621 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.106 -7.202 1.609 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.742 -6.654 1.971 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.900 -6.124 1.001 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.304 -6.683 3.287 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.652 -5.638 1.344 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.061 -6.198 3.628 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.235 -5.678 2.656 1.00 0.00 C ATOM 0 H PHE A 78 -6.138 -8.512 0.847 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.671 -8.039 -0.311 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.698 -6.408 1.154 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.622 -7.501 2.521 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.223 -6.091 -0.029 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.946 -7.091 4.054 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.004 -5.227 0.584 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.734 -6.225 4.657 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.741 -5.301 2.923 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.586 -10.079 2.241 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.831 -11.094 2.905 1.00 0.00 C ATOM 1197 C PHE A 79 -2.521 -12.254 1.982 1.00 0.00 C ATOM 1198 O PHE A 79 -1.383 -12.738 1.948 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.579 -11.553 4.139 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.483 -10.569 5.301 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -4.384 -9.530 5.427 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -2.465 -10.672 6.244 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -4.284 -8.613 6.454 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -2.361 -9.755 7.285 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.277 -8.721 7.383 1.00 0.00 C ATOM 0 H PHE A 79 -4.493 -9.893 2.669 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.872 -10.674 3.209 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.628 -11.704 3.885 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.186 -12.519 4.456 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.183 -9.433 4.707 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -1.746 -11.474 6.167 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.000 -7.808 6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.569 -9.849 8.014 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.200 -8.003 8.186 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.502 -12.667 1.220 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.330 -13.748 0.304 1.00 0.00 C ATOM 1217 C GLU A 80 -2.325 -13.435 -0.789 1.00 0.00 C ATOM 1218 O GLU A 80 -1.297 -14.066 -0.856 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.668 -14.186 -0.258 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.511 -14.901 0.771 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.823 -16.138 1.296 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.879 -17.192 0.635 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.202 -16.086 2.383 1.00 0.00 O ATOM 0 H GLU A 80 -4.437 -12.260 1.223 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.907 -14.584 0.861 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.209 -13.314 -0.626 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.504 -14.844 -1.112 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.725 -14.225 1.599 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.468 -15.177 0.329 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.575 -12.413 -1.575 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.727 -12.122 -2.728 1.00 0.00 C ATOM 1232 C ASN A 81 -0.313 -11.659 -2.361 1.00 0.00 C ATOM 1233 O ASN A 81 0.631 -11.948 -3.101 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.405 -11.189 -3.778 1.00 0.00 C ATOM 1235 CG ASN A 81 -2.702 -9.759 -3.306 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -1.995 -9.187 -2.486 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -3.766 -9.179 -3.814 1.00 0.00 N ATOM 0 H ASN A 81 -3.353 -11.767 -1.445 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.599 -13.087 -3.218 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.763 -11.135 -4.657 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.341 -11.649 -4.094 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -4.017 -8.233 -3.527 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.340 -9.675 -4.496 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.141 -10.981 -1.228 1.00 0.00 N ATOM 1245 CA CYS A 82 1.195 -10.546 -0.854 1.00 0.00 C ATOM 1246 C CYS A 82 2.031 -11.751 -0.432 1.00 0.00 C ATOM 1247 O CYS A 82 3.127 -11.976 -0.963 1.00 0.00 O ATOM 1248 CB CYS A 82 1.171 -9.440 0.223 1.00 0.00 C ATOM 1249 SG CYS A 82 0.426 -9.920 1.796 1.00 0.00 S ATOM 0 H CYS A 82 -0.884 -10.730 -0.576 1.00 0.00 H new ATOM 0 HA CYS A 82 1.666 -10.093 -1.726 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.194 -9.112 0.408 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.628 -8.581 -0.172 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.869 -9.886 1.691 1.00 0.00 H new ATOM 1255 N ARG A 83 1.468 -12.584 0.442 1.00 0.00 N ATOM 1256 CA ARG A 83 2.150 -13.776 0.898 1.00 0.00 C ATOM 1257 C ARG A 83 2.356 -14.735 -0.256 1.00 0.00 C ATOM 1258 O ARG A 83 3.393 -15.341 -0.351 1.00 0.00 O ATOM 1259 CB ARG A 83 1.391 -14.442 2.042 1.00 0.00 C ATOM 1260 CG ARG A 83 1.448 -13.675 3.361 1.00 0.00 C ATOM 1261 CD ARG A 83 2.853 -13.655 3.896 1.00 0.00 C ATOM 1262 NE ARG A 83 2.994 -12.890 5.137 1.00 0.00 N ATOM 1263 CZ ARG A 83 2.661 -13.307 6.374 1.00 0.00 C ATOM 1264 NH1 ARG A 83 1.909 -14.398 6.570 1.00 0.00 N ATOM 1265 NH2 ARG A 83 3.056 -12.603 7.407 1.00 0.00 N ATOM 0 H ARG A 83 0.540 -12.448 0.844 1.00 0.00 H new ATOM 0 HA ARG A 83 3.128 -13.487 1.283 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.348 -14.563 1.750 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.796 -15.442 2.198 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.095 -12.655 3.211 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.782 -14.139 4.088 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.182 -14.680 4.071 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.515 -13.232 3.140 1.00 0.00 H new ATOM 0 HE ARG A 83 3.382 -11.950 5.057 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.573 -14.936 5.771 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.672 -14.691 7.518 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.606 -11.755 7.266 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.814 -12.903 8.351 1.00 0.00 H new ATOM 1279 N ASP A 84 1.376 -14.803 -1.142 1.00 0.00 N ATOM 1280 CA ASP A 84 1.396 -15.612 -2.387 1.00 0.00 C ATOM 1281 C ASP A 84 2.630 -15.283 -3.200 1.00 0.00 C ATOM 1282 O ASP A 84 3.460 -16.146 -3.526 1.00 0.00 O ATOM 1283 CB ASP A 84 0.187 -15.197 -3.212 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.037 -16.009 -4.456 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.666 -17.091 -4.374 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.356 -15.558 -5.546 1.00 0.00 O ATOM 0 H ASP A 84 0.506 -14.284 -1.026 1.00 0.00 H new ATOM 0 HA ASP A 84 1.389 -16.674 -2.140 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.703 -15.265 -2.586 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.299 -14.150 -3.494 1.00 0.00 H new ATOM 1291 N THR A 85 2.752 -14.020 -3.476 1.00 0.00 N ATOM 1292 CA THR A 85 3.832 -13.451 -4.233 1.00 0.00 C ATOM 1293 C THR A 85 5.194 -13.710 -3.536 1.00 0.00 C ATOM 1294 O THR A 85 6.232 -13.974 -4.190 1.00 0.00 O ATOM 1295 CB THR A 85 3.538 -11.942 -4.368 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.334 -11.757 -5.151 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.688 -11.162 -4.965 1.00 0.00 C ATOM 0 H THR A 85 2.073 -13.325 -3.167 1.00 0.00 H new ATOM 0 HA THR A 85 3.904 -13.911 -5.219 1.00 0.00 H new ATOM 0 HB THR A 85 3.396 -11.546 -3.363 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.583 -11.557 -4.554 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.417 -10.108 -5.033 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.569 -11.270 -4.332 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.909 -11.544 -5.962 1.00 0.00 H new ATOM 1305 N ALA A 86 5.148 -13.755 -2.237 1.00 0.00 N ATOM 1306 CA ALA A 86 6.319 -13.941 -1.476 1.00 0.00 C ATOM 1307 C ALA A 86 6.720 -15.405 -1.456 1.00 0.00 C ATOM 1308 O ALA A 86 7.896 -15.710 -1.482 1.00 0.00 O ATOM 1309 CB ALA A 86 6.144 -13.381 -0.102 1.00 0.00 C ATOM 0 H ALA A 86 4.293 -13.663 -1.689 1.00 0.00 H new ATOM 0 HA ALA A 86 7.137 -13.394 -1.945 1.00 0.00 H new ATOM 0 HB1 ALA A 86 7.058 -13.533 0.472 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.931 -12.314 -0.168 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.315 -13.886 0.394 1.00 0.00 H new ATOM 1315 N LYS A 87 5.729 -16.296 -1.442 1.00 0.00 N ATOM 1316 CA LYS A 87 5.946 -17.747 -1.498 1.00 0.00 C ATOM 1317 C LYS A 87 6.732 -18.111 -2.726 1.00 0.00 C ATOM 1318 O LYS A 87 7.682 -18.890 -2.657 1.00 0.00 O ATOM 1319 CB LYS A 87 4.619 -18.506 -1.531 1.00 0.00 C ATOM 1320 CG LYS A 87 3.773 -18.347 -0.294 1.00 0.00 C ATOM 1321 CD LYS A 87 2.450 -19.095 -0.403 1.00 0.00 C ATOM 1322 CE LYS A 87 2.655 -20.588 -0.561 1.00 0.00 C ATOM 1323 NZ LYS A 87 1.376 -21.334 -0.532 1.00 0.00 N ATOM 0 H LYS A 87 4.745 -16.032 -1.391 1.00 0.00 H new ATOM 0 HA LYS A 87 6.498 -18.027 -0.601 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.044 -18.169 -2.394 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.826 -19.566 -1.680 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.325 -18.713 0.572 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.577 -17.288 -0.123 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.850 -18.903 0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 87 1.887 -18.714 -1.255 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.167 -20.785 -1.503 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.303 -20.951 0.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 1.565 -22.351 -0.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 0.898 -21.168 0.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.766 -21.008 -1.309 1.00 0.00 H new ATOM 1337 N ARG A 88 6.357 -17.517 -3.846 1.00 0.00 N ATOM 1338 CA ARG A 88 7.070 -17.759 -5.089 1.00 0.00 C ATOM 1339 C ARG A 88 8.475 -17.203 -5.017 1.00 0.00 C ATOM 1340 O ARG A 88 9.406 -17.818 -5.513 1.00 0.00 O ATOM 1341 CB ARG A 88 6.301 -17.285 -6.347 1.00 0.00 C ATOM 1342 CG ARG A 88 5.179 -18.241 -6.793 1.00 0.00 C ATOM 1343 CD ARG A 88 4.063 -18.340 -5.763 1.00 0.00 C ATOM 1344 NE ARG A 88 3.067 -19.367 -6.088 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.794 -19.112 -6.426 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.420 -17.884 -6.705 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.910 -20.101 -6.523 1.00 0.00 N ATOM 0 H ARG A 88 5.572 -16.870 -3.921 1.00 0.00 H new ATOM 0 HA ARG A 88 7.145 -18.840 -5.206 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.870 -16.304 -6.149 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.008 -17.163 -7.168 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.766 -17.896 -7.741 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.597 -19.232 -6.969 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.496 -18.559 -4.787 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.566 -17.373 -5.681 1.00 0.00 H new ATOM 0 HE ARG A 88 3.363 -20.343 -6.055 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.098 -17.123 -6.665 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.452 -17.692 -6.962 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.198 -21.062 -6.340 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.056 -19.898 -6.781 1.00 0.00 H new ATOM 1361 N ASN A 89 8.640 -16.082 -4.320 1.00 0.00 N ATOM 1362 CA ASN A 89 9.959 -15.522 -4.120 1.00 0.00 C ATOM 1363 C ASN A 89 10.814 -16.404 -3.219 1.00 0.00 C ATOM 1364 O ASN A 89 12.017 -16.492 -3.422 1.00 0.00 O ATOM 1365 CB ASN A 89 9.922 -14.058 -3.606 1.00 0.00 C ATOM 1366 CG ASN A 89 9.597 -13.052 -4.702 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.846 -13.298 -5.872 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.083 -11.914 -4.336 1.00 0.00 N ATOM 0 H ASN A 89 7.881 -15.553 -3.891 1.00 0.00 H new ATOM 0 HA ASN A 89 10.428 -15.493 -5.103 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.179 -13.976 -2.813 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.887 -13.809 -3.166 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.877 -11.199 -5.034 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.886 -11.737 -3.351 1.00 0.00 H new ATOM 1375 N GLN A 90 10.201 -17.078 -2.229 1.00 0.00 N ATOM 1376 CA GLN A 90 10.965 -17.924 -1.292 1.00 0.00 C ATOM 1377 C GLN A 90 11.377 -19.219 -1.953 1.00 0.00 C ATOM 1378 O GLN A 90 12.536 -19.612 -1.843 1.00 0.00 O ATOM 1379 CB GLN A 90 10.216 -18.228 0.042 1.00 0.00 C ATOM 1380 CG GLN A 90 9.629 -17.009 0.775 1.00 0.00 C ATOM 1381 CD GLN A 90 10.587 -15.838 0.877 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.358 -15.716 1.825 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.513 -14.956 -0.087 1.00 0.00 N ATOM 0 H GLN A 90 9.196 -17.055 -2.058 1.00 0.00 H new ATOM 0 HA GLN A 90 11.848 -17.342 -1.028 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.406 -18.926 -0.170 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.906 -18.736 0.716 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.727 -16.684 0.257 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.329 -17.310 1.779 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.858 -15.096 -0.857 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.110 -14.129 -0.069 1.00 0.00 H new ATOM 1392 N GLN A 91 10.451 -19.888 -2.641 1.00 0.00 N ATOM 1393 CA GLN A 91 10.792 -21.130 -3.324 1.00 0.00 C ATOM 1394 C GLN A 91 11.781 -20.898 -4.478 1.00 0.00 C ATOM 1395 O GLN A 91 12.621 -21.754 -4.755 1.00 0.00 O ATOM 1396 CB GLN A 91 9.544 -21.881 -3.798 1.00 0.00 C ATOM 1397 CG GLN A 91 8.614 -21.056 -4.670 1.00 0.00 C ATOM 1398 CD GLN A 91 7.458 -21.838 -5.220 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.564 -22.418 -6.296 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.354 -21.873 -4.517 1.00 0.00 N ATOM 0 H GLN A 91 9.478 -19.596 -2.738 1.00 0.00 H new ATOM 0 HA GLN A 91 11.293 -21.764 -2.592 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.855 -22.765 -4.354 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.991 -22.231 -2.926 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.231 -20.218 -4.088 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.184 -20.635 -5.498 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.301 -21.379 -3.626 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.547 -22.394 -4.860 1.00 0.00 H new ATOM 1409 N ALA A 92 11.692 -19.738 -5.129 1.00 0.00 N ATOM 1410 CA ALA A 92 12.631 -19.383 -6.184 1.00 0.00 C ATOM 1411 C ALA A 92 13.981 -19.044 -5.566 1.00 0.00 C ATOM 1412 O ALA A 92 15.025 -19.304 -6.149 1.00 0.00 O ATOM 1413 CB ALA A 92 12.116 -18.198 -7.006 1.00 0.00 C ATOM 0 H ALA A 92 10.980 -19.032 -4.942 1.00 0.00 H new ATOM 0 HA ALA A 92 12.738 -20.235 -6.856 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.838 -17.955 -7.786 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.162 -18.460 -7.463 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.982 -17.334 -6.355 1.00 0.00 H new ATOM 1419 N GLY A 93 13.939 -18.512 -4.368 1.00 0.00 N ATOM 1420 CA GLY A 93 15.132 -18.144 -3.661 1.00 0.00 C ATOM 1421 C GLY A 93 15.593 -16.752 -4.030 1.00 0.00 C ATOM 1422 O GLY A 93 16.770 -16.514 -4.344 1.00 0.00 O ATOM 0 H GLY A 93 13.075 -18.324 -3.860 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.949 -18.194 -2.588 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.923 -18.860 -3.884 1.00 0.00 H new ATOM 1426 N ASN A 94 14.652 -15.839 -4.019 1.00 0.00 N ATOM 1427 CA ASN A 94 14.908 -14.445 -4.320 1.00 0.00 C ATOM 1428 C ASN A 94 15.292 -13.718 -3.067 1.00 0.00 C ATOM 1429 O ASN A 94 14.950 -14.155 -1.962 1.00 0.00 O ATOM 1430 CB ASN A 94 13.692 -13.758 -4.986 1.00 0.00 C ATOM 1431 CG ASN A 94 13.525 -14.132 -6.446 1.00 0.00 C ATOM 1432 OD1 ASN A 94 14.502 -14.411 -7.134 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.304 -14.109 -6.939 1.00 0.00 N ATOM 0 H ASN A 94 13.677 -16.041 -3.799 1.00 0.00 H new ATOM 0 HA ASN A 94 15.730 -14.407 -5.034 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.787 -14.028 -4.442 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.803 -12.677 -4.904 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.147 -14.328 -7.923 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.515 -13.873 -6.337 1.00 0.00 H new ATOM 1440 N GLY A 95 15.961 -12.591 -3.211 1.00 0.00 N ATOM 1441 CA GLY A 95 16.407 -11.827 -2.048 1.00 0.00 C ATOM 1442 C GLY A 95 15.282 -11.084 -1.342 1.00 0.00 C ATOM 1443 O GLY A 95 15.519 -10.321 -0.414 1.00 0.00 O ATOM 0 H GLY A 95 16.209 -12.181 -4.111 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.885 -12.504 -1.340 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.164 -11.109 -2.363 1.00 0.00 H new ATOM 1447 N TRP A 96 14.063 -11.334 -1.756 1.00 0.00 N ATOM 1448 CA TRP A 96 12.935 -10.706 -1.175 1.00 0.00 C ATOM 1449 C TRP A 96 12.234 -11.650 -0.281 1.00 0.00 C ATOM 1450 O TRP A 96 12.271 -12.866 -0.477 1.00 0.00 O ATOM 1451 CB TRP A 96 12.034 -10.074 -2.206 1.00 0.00 C ATOM 1452 CG TRP A 96 12.779 -8.998 -2.883 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.202 -7.840 -2.310 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.245 -8.985 -4.219 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.898 -7.102 -3.199 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.944 -7.781 -4.396 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.140 -9.871 -5.284 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.540 -7.449 -5.603 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.731 -9.535 -6.476 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.424 -8.336 -6.625 1.00 0.00 C ATOM 0 H TRP A 96 13.841 -11.984 -2.510 1.00 0.00 H new ATOM 0 HA TRP A 96 13.280 -9.874 -0.562 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.705 -10.820 -2.930 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.138 -9.674 -1.731 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.008 -7.552 -1.287 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.320 -6.192 -3.015 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.605 -10.803 -5.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 15.076 -6.520 -5.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.657 -10.213 -7.314 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.880 -8.106 -7.576 1.00 0.00 H new ATOM 1471 N ASP A 97 11.563 -11.115 0.650 1.00 0.00 N ATOM 1472 CA ASP A 97 11.102 -11.900 1.756 1.00 0.00 C ATOM 1473 C ASP A 97 9.717 -11.465 2.122 1.00 0.00 C ATOM 1474 O ASP A 97 9.362 -10.310 1.886 1.00 0.00 O ATOM 1475 CB ASP A 97 12.087 -11.671 2.908 1.00 0.00 C ATOM 1476 CG ASP A 97 11.822 -12.468 4.145 1.00 0.00 C ATOM 1477 OD1 ASP A 97 10.900 -12.146 4.886 1.00 0.00 O ATOM 1478 OD2 ASP A 97 12.593 -13.420 4.418 1.00 0.00 O ATOM 0 H ASP A 97 11.308 -10.128 0.686 1.00 0.00 H new ATOM 0 HA ASP A 97 11.060 -12.962 1.515 1.00 0.00 H new ATOM 0 HB2 ASP A 97 13.092 -11.902 2.556 1.00 0.00 H new ATOM 0 HB3 ASP A 97 12.076 -10.613 3.168 1.00 0.00 H new ATOM 1483 N PHE A 98 8.945 -12.373 2.684 1.00 0.00 N ATOM 1484 CA PHE A 98 7.582 -12.113 3.046 1.00 0.00 C ATOM 1485 C PHE A 98 7.406 -11.154 4.222 1.00 0.00 C ATOM 1486 O PHE A 98 6.305 -10.720 4.475 1.00 0.00 O ATOM 1487 CB PHE A 98 6.702 -13.378 3.128 1.00 0.00 C ATOM 1488 CG PHE A 98 6.871 -14.263 4.278 1.00 0.00 C ATOM 1489 CD1 PHE A 98 8.015 -14.970 4.479 1.00 0.00 C ATOM 1490 CD2 PHE A 98 5.835 -14.404 5.150 1.00 0.00 C ATOM 1491 CE1 PHE A 98 8.118 -15.803 5.555 1.00 0.00 C ATOM 1492 CE2 PHE A 98 5.904 -15.218 6.213 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.057 -15.936 6.436 1.00 0.00 C ATOM 0 H PHE A 98 9.257 -13.319 2.901 1.00 0.00 H new ATOM 0 HA PHE A 98 7.187 -11.557 2.196 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.660 -13.061 3.102 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.879 -13.965 2.227 1.00 0.00 H new ATOM 0 HD1 PHE A 98 8.840 -14.873 3.789 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.929 -13.842 4.980 1.00 0.00 H new ATOM 0 HE1 PHE A 98 9.029 -16.360 5.720 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.065 -15.309 6.887 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.134 -16.595 7.288 1.00 0.00 H new ATOM 1503 N ASP A 99 8.456 -10.941 5.025 1.00 0.00 N ATOM 1504 CA ASP A 99 8.371 -9.928 6.075 1.00 0.00 C ATOM 1505 C ASP A 99 8.786 -8.584 5.541 1.00 0.00 C ATOM 1506 O ASP A 99 8.564 -7.591 6.163 1.00 0.00 O ATOM 1507 CB ASP A 99 9.224 -10.240 7.265 1.00 0.00 C ATOM 1508 CG ASP A 99 8.525 -9.884 8.519 1.00 0.00 C ATOM 1509 OD1 ASP A 99 7.739 -10.706 9.029 1.00 0.00 O ATOM 1510 OD2 ASP A 99 8.739 -8.793 9.038 1.00 0.00 O ATOM 0 H ASP A 99 9.344 -11.439 4.970 1.00 0.00 H new ATOM 0 HA ASP A 99 7.329 -9.918 6.396 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.474 -11.301 7.271 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.164 -9.692 7.199 1.00 0.00 H new ATOM 1515 N MET A 100 9.478 -8.562 4.415 1.00 0.00 N ATOM 1516 CA MET A 100 9.825 -7.274 3.805 1.00 0.00 C ATOM 1517 C MET A 100 8.678 -6.828 2.960 1.00 0.00 C ATOM 1518 O MET A 100 8.367 -5.647 2.854 1.00 0.00 O ATOM 1519 CB MET A 100 11.149 -7.300 2.993 1.00 0.00 C ATOM 1520 CG MET A 100 12.366 -7.603 3.855 1.00 0.00 C ATOM 1521 SD MET A 100 13.951 -7.297 3.023 1.00 0.00 S ATOM 1522 CE MET A 100 13.847 -8.393 1.619 1.00 0.00 C ATOM 0 H MET A 100 9.805 -9.387 3.912 1.00 0.00 H new ATOM 0 HA MET A 100 10.007 -6.561 4.609 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.072 -8.050 2.206 1.00 0.00 H new ATOM 0 HB3 MET A 100 11.288 -6.336 2.503 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.319 -6.997 4.760 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.327 -8.646 4.168 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.789 -8.373 1.071 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.649 -9.408 1.964 1.00 0.00 H new ATOM 0 HE3 MET A 100 13.039 -8.068 0.963 1.00 0.00 H new ATOM 1532 N LEU A 101 8.069 -7.798 2.341 1.00 0.00 N ATOM 1533 CA LEU A 101 6.899 -7.612 1.578 1.00 0.00 C ATOM 1534 C LEU A 101 5.749 -8.161 2.386 1.00 0.00 C ATOM 1535 O LEU A 101 5.458 -9.334 2.282 1.00 0.00 O ATOM 1536 CB LEU A 101 7.047 -8.293 0.187 1.00 0.00 C ATOM 1537 CG LEU A 101 5.893 -8.151 -0.819 1.00 0.00 C ATOM 1538 CD1 LEU A 101 6.449 -8.188 -2.227 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.918 -9.296 -0.695 1.00 0.00 C ATOM 0 H LEU A 101 8.394 -8.765 2.363 1.00 0.00 H new ATOM 0 HA LEU A 101 6.715 -6.558 1.371 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.948 -7.898 -0.282 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.214 -9.357 0.354 1.00 0.00 H new ATOM 0 HG LEU A 101 5.386 -7.209 -0.611 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.633 -8.088 -2.943 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.153 -7.367 -2.362 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.961 -9.136 -2.391 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.113 -9.168 -1.419 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.434 -10.236 -0.889 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.501 -9.312 0.312 1.00 0.00 H new ATOM 1551 N THR A 102 5.207 -7.305 3.259 1.00 0.00 N ATOM 1552 CA THR A 102 4.048 -7.558 4.173 1.00 0.00 C ATOM 1553 C THR A 102 4.459 -8.169 5.552 1.00 0.00 C ATOM 1554 O THR A 102 5.630 -8.324 5.866 1.00 0.00 O ATOM 1555 CB THR A 102 2.867 -8.405 3.534 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.626 -8.063 4.183 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.064 -9.914 3.744 1.00 0.00 C ATOM 0 H THR A 102 5.574 -6.359 3.366 1.00 0.00 H new ATOM 0 HA THR A 102 3.659 -6.555 4.347 1.00 0.00 H new ATOM 0 HB THR A 102 2.855 -8.177 2.468 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.881 -8.484 3.706 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.234 -10.456 3.291 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.998 -10.227 3.278 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.100 -10.131 4.812 1.00 0.00 H new ATOM 1661 N ASP A 111 12.930 0.709 6.569 1.00 0.00 N ATOM 1662 CA ASP A 111 14.140 0.337 5.831 1.00 0.00 C ATOM 1663 C ASP A 111 13.917 -0.527 4.595 1.00 0.00 C ATOM 1664 O ASP A 111 14.436 -0.209 3.511 1.00 0.00 O ATOM 1665 CB ASP A 111 15.131 -0.345 6.774 1.00 0.00 C ATOM 1666 CG ASP A 111 15.732 0.608 7.768 1.00 0.00 C ATOM 1667 OD1 ASP A 111 15.059 0.943 8.779 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.880 1.066 7.564 1.00 0.00 O ATOM 0 HA ASP A 111 14.540 1.276 5.448 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.624 -1.149 7.308 1.00 0.00 H new ATOM 0 HB3 ASP A 111 15.928 -0.803 6.188 1.00 0.00 H new ATOM 1673 N ALA A 112 13.102 -1.560 4.705 1.00 0.00 N ATOM 1674 CA ALA A 112 13.008 -2.544 3.645 1.00 0.00 C ATOM 1675 C ALA A 112 12.483 -1.962 2.347 1.00 0.00 C ATOM 1676 O ALA A 112 13.085 -2.155 1.288 1.00 0.00 O ATOM 1677 CB ALA A 112 12.167 -3.718 4.081 1.00 0.00 C ATOM 0 H ALA A 112 12.501 -1.738 5.510 1.00 0.00 H new ATOM 0 HA ALA A 112 14.023 -2.888 3.446 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.109 -4.445 3.271 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.620 -4.185 4.956 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.164 -3.374 4.332 1.00 0.00 H new ATOM 1683 N GLN A 113 11.382 -1.245 2.423 1.00 0.00 N ATOM 1684 CA GLN A 113 10.778 -0.691 1.208 1.00 0.00 C ATOM 1685 C GLN A 113 11.401 0.638 0.834 1.00 0.00 C ATOM 1686 O GLN A 113 11.483 0.962 -0.351 1.00 0.00 O ATOM 1687 CB GLN A 113 9.231 -0.530 1.293 1.00 0.00 C ATOM 1688 CG GLN A 113 8.542 -1.578 2.148 1.00 0.00 C ATOM 1689 CD GLN A 113 8.481 -1.191 3.622 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.272 -0.210 4.033 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 7.644 -1.667 4.342 1.00 0.00 N flip ATOM 0 H GLN A 113 10.888 -1.030 3.289 1.00 0.00 H new ATOM 0 HA GLN A 113 10.985 -1.427 0.431 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.001 0.457 1.693 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.817 -0.570 0.285 1.00 0.00 H new ATOM 0 HG2 GLN A 113 7.530 -1.735 1.776 1.00 0.00 H new ATOM 0 HG3 GLN A 113 9.070 -2.527 2.048 1.00 0.00 H new ATOM 0 HE21 GLN A 113 7.048 -2.421 4.002 1.00 0.00 H new ATOM 0 HE22 GLN A 113 7.530 -1.316 5.293 1.00 0.00 H new ATOM 1700 N MET A 114 11.883 1.403 1.831 1.00 0.00 N ATOM 1701 CA MET A 114 12.396 2.728 1.565 1.00 0.00 C ATOM 1702 C MET A 114 13.640 2.704 0.730 1.00 0.00 C ATOM 1703 O MET A 114 13.844 3.566 -0.113 1.00 0.00 O ATOM 1704 CB MET A 114 12.595 3.560 2.855 1.00 0.00 C ATOM 1705 CG MET A 114 13.380 4.863 2.654 1.00 0.00 C ATOM 1706 SD MET A 114 13.343 5.966 4.076 1.00 0.00 S ATOM 1707 CE MET A 114 11.640 6.528 4.015 1.00 0.00 C ATOM 0 H MET A 114 11.921 1.117 2.809 1.00 0.00 H new ATOM 0 HA MET A 114 11.627 3.231 0.979 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.617 3.800 3.273 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.114 2.947 3.592 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.417 4.619 2.423 1.00 0.00 H new ATOM 0 HG3 MET A 114 12.976 5.389 1.789 1.00 0.00 H new ATOM 0 HE1 MET A 114 11.531 7.426 4.623 1.00 0.00 H new ATOM 0 HE2 MET A 114 11.368 6.753 2.984 1.00 0.00 H new ATOM 0 HE3 MET A 114 10.985 5.747 4.401 1.00 0.00 H new ATOM 1717 N GLN A 115 14.459 1.709 0.935 1.00 0.00 N ATOM 1718 CA GLN A 115 15.670 1.634 0.185 1.00 0.00 C ATOM 1719 C GLN A 115 15.491 1.217 -1.256 1.00 0.00 C ATOM 1720 O GLN A 115 16.397 1.412 -2.063 1.00 0.00 O ATOM 1721 CB GLN A 115 16.809 0.965 0.909 1.00 0.00 C ATOM 1722 CG GLN A 115 17.630 1.971 1.709 1.00 0.00 C ATOM 1723 CD GLN A 115 16.930 2.582 2.910 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.141 1.822 3.584 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 17.154 3.742 3.247 1.00 0.00 N flip ATOM 0 H GLN A 115 14.309 0.954 1.604 1.00 0.00 H new ATOM 0 HA GLN A 115 15.998 2.670 0.103 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.417 0.200 1.579 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.452 0.459 0.189 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.540 1.479 2.053 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.936 2.776 1.041 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.785 4.321 2.693 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.709 4.126 4.081 1.00 0.00 H new ATOM 1734 N TYR A 116 14.307 0.681 -1.570 1.00 0.00 N ATOM 1735 CA TYR A 116 13.879 0.454 -2.945 1.00 0.00 C ATOM 1736 C TYR A 116 14.653 -0.599 -3.732 1.00 0.00 C ATOM 1737 O TYR A 116 15.830 -0.464 -4.034 1.00 0.00 O ATOM 1738 CB TYR A 116 13.786 1.806 -3.686 1.00 0.00 C ATOM 1739 CG TYR A 116 13.562 1.748 -5.188 1.00 0.00 C ATOM 1740 CD1 TYR A 116 12.398 1.204 -5.729 1.00 0.00 C ATOM 1741 CD2 TYR A 116 14.500 2.280 -6.067 1.00 0.00 C ATOM 1742 CE1 TYR A 116 12.187 1.189 -7.088 1.00 0.00 C ATOM 1743 CE2 TYR A 116 14.288 2.262 -7.431 1.00 0.00 C ATOM 1744 CZ TYR A 116 13.128 1.716 -7.930 1.00 0.00 C ATOM 1745 OH TYR A 116 12.897 1.712 -9.275 1.00 0.00 O ATOM 0 H TYR A 116 13.620 0.393 -0.873 1.00 0.00 H new ATOM 0 HA TYR A 116 12.891 -0.001 -2.875 1.00 0.00 H new ATOM 0 HB2 TYR A 116 12.973 2.381 -3.243 1.00 0.00 H new ATOM 0 HB3 TYR A 116 14.706 2.360 -3.501 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.650 0.788 -5.070 1.00 0.00 H new ATOM 0 HD2 TYR A 116 15.408 2.714 -5.676 1.00 0.00 H new ATOM 0 HE1 TYR A 116 11.280 0.762 -7.490 1.00 0.00 H new ATOM 0 HE2 TYR A 116 15.028 2.674 -8.102 1.00 0.00 H new ATOM 0 HH TYR A 116 13.657 2.122 -9.739 1.00 0.00 H new ATOM 1755 N ASP A 117 13.937 -1.626 -4.078 1.00 0.00 N ATOM 1756 CA ASP A 117 14.409 -2.642 -4.974 1.00 0.00 C ATOM 1757 C ASP A 117 13.393 -2.706 -6.056 1.00 0.00 C ATOM 1758 O ASP A 117 12.195 -2.625 -5.753 1.00 0.00 O ATOM 1759 CB ASP A 117 14.469 -4.033 -4.334 1.00 0.00 C ATOM 1760 CG ASP A 117 15.435 -4.178 -3.208 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.636 -3.994 -3.410 1.00 0.00 O ATOM 1762 OD2 ASP A 117 14.998 -4.542 -2.104 1.00 0.00 O ATOM 0 H ASP A 117 12.988 -1.786 -3.739 1.00 0.00 H new ATOM 0 HA ASP A 117 15.418 -2.391 -5.299 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.474 -4.291 -3.972 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.725 -4.759 -5.106 1.00 0.00 H new ATOM 1767 N PRO A 118 13.799 -2.827 -7.317 1.00 0.00 N ATOM 1768 CA PRO A 118 12.864 -2.908 -8.452 1.00 0.00 C ATOM 1769 C PRO A 118 11.882 -4.083 -8.322 1.00 0.00 C ATOM 1770 O PRO A 118 10.733 -3.985 -8.744 1.00 0.00 O ATOM 1771 CB PRO A 118 13.792 -3.120 -9.655 1.00 0.00 C ATOM 1772 CG PRO A 118 15.083 -2.515 -9.226 1.00 0.00 C ATOM 1773 CD PRO A 118 15.208 -2.843 -7.771 1.00 0.00 C ATOM 0 HA PRO A 118 12.235 -2.021 -8.526 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.906 -4.178 -9.890 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.402 -2.635 -10.550 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.918 -2.925 -9.795 1.00 0.00 H new ATOM 0 HG3 PRO A 118 15.085 -1.437 -9.388 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.674 -3.815 -7.613 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.814 -2.109 -7.240 1.00 0.00 H new ATOM 1781 N GLY A 119 12.296 -5.124 -7.611 1.00 0.00 N ATOM 1782 CA GLY A 119 11.489 -6.317 -7.538 1.00 0.00 C ATOM 1783 C GLY A 119 10.478 -6.178 -6.432 1.00 0.00 C ATOM 1784 O GLY A 119 9.275 -6.273 -6.665 1.00 0.00 O ATOM 0 H GLY A 119 13.171 -5.160 -7.088 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.982 -6.484 -8.488 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.122 -7.186 -7.358 1.00 0.00 H new ATOM 1788 N LEU A 120 10.993 -5.906 -5.229 1.00 0.00 N ATOM 1789 CA LEU A 120 10.182 -5.671 -4.042 1.00 0.00 C ATOM 1790 C LEU A 120 9.106 -4.617 -4.331 1.00 0.00 C ATOM 1791 O LEU A 120 7.921 -4.861 -4.119 1.00 0.00 O ATOM 1792 CB LEU A 120 11.076 -5.161 -2.914 1.00 0.00 C ATOM 1793 CG LEU A 120 10.413 -5.008 -1.536 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.961 -6.369 -0.994 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.354 -4.318 -0.576 1.00 0.00 C ATOM 0 H LEU A 120 11.996 -5.843 -5.056 1.00 0.00 H new ATOM 0 HA LEU A 120 9.703 -6.607 -3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.921 -5.842 -2.813 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.480 -4.192 -3.209 1.00 0.00 H new ATOM 0 HG LEU A 120 9.524 -4.387 -1.644 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.495 -6.235 -0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.242 -6.814 -1.682 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.825 -7.027 -0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.872 -4.216 0.396 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.263 -4.909 -0.470 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.607 -3.330 -0.961 1.00 0.00 H new ATOM 1807 N PHE A 121 9.533 -3.460 -4.870 1.00 0.00 N ATOM 1808 CA PHE A 121 8.615 -2.371 -5.175 1.00 0.00 C ATOM 1809 C PHE A 121 7.535 -2.744 -6.193 1.00 0.00 C ATOM 1810 O PHE A 121 6.360 -2.460 -5.959 1.00 0.00 O ATOM 1811 CB PHE A 121 9.342 -1.089 -5.597 1.00 0.00 C ATOM 1812 CG PHE A 121 8.392 0.020 -5.961 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.633 0.657 -4.992 1.00 0.00 C ATOM 1814 CD2 PHE A 121 8.239 0.406 -7.276 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.748 1.654 -5.340 1.00 0.00 C ATOM 1816 CE2 PHE A 121 7.353 1.402 -7.622 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.610 2.021 -6.653 1.00 0.00 C ATOM 0 H PHE A 121 10.508 -3.265 -5.099 1.00 0.00 H new ATOM 0 HA PHE A 121 8.102 -2.171 -4.234 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.988 -0.757 -4.784 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.987 -1.305 -6.449 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.736 0.370 -3.956 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.822 -0.079 -8.045 1.00 0.00 H new ATOM 0 HE1 PHE A 121 6.163 2.147 -4.578 1.00 0.00 H new ATOM 0 HE2 PHE A 121 7.245 1.694 -8.656 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.913 2.801 -6.924 1.00 0.00 H new ATOM 1827 N ALA A 122 7.918 -3.379 -7.296 1.00 0.00 N ATOM 1828 CA ALA A 122 6.953 -3.747 -8.328 1.00 0.00 C ATOM 1829 C ALA A 122 5.875 -4.635 -7.750 1.00 0.00 C ATOM 1830 O ALA A 122 4.671 -4.474 -8.038 1.00 0.00 O ATOM 1831 CB ALA A 122 7.644 -4.458 -9.484 1.00 0.00 C ATOM 0 H ALA A 122 8.881 -3.648 -7.498 1.00 0.00 H new ATOM 0 HA ALA A 122 6.495 -2.832 -8.704 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.906 -4.723 -10.241 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.393 -3.798 -9.922 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.129 -5.363 -9.117 1.00 0.00 H new ATOM 1837 N GLN A 123 6.298 -5.528 -6.882 1.00 0.00 N ATOM 1838 CA GLN A 123 5.405 -6.481 -6.301 1.00 0.00 C ATOM 1839 C GLN A 123 4.502 -5.880 -5.232 1.00 0.00 C ATOM 1840 O GLN A 123 3.322 -6.194 -5.198 1.00 0.00 O ATOM 1841 CB GLN A 123 6.148 -7.692 -5.775 1.00 0.00 C ATOM 1842 CG GLN A 123 6.905 -8.462 -6.841 1.00 0.00 C ATOM 1843 CD GLN A 123 6.005 -8.976 -7.950 1.00 0.00 C ATOM 1844 OE1 GLN A 123 4.824 -9.283 -7.737 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.536 -9.078 -9.129 1.00 0.00 N ATOM 0 H GLN A 123 7.265 -5.606 -6.567 1.00 0.00 H new ATOM 0 HA GLN A 123 4.750 -6.810 -7.108 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.850 -7.369 -5.007 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.435 -8.362 -5.294 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.672 -7.818 -7.271 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.419 -9.304 -6.378 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.512 -8.817 -9.273 1.00 0.00 H new ATOM 0 HE22 GLN A 123 5.978 -9.419 -9.912 1.00 0.00 H new ATOM 1854 N ILE A 124 5.037 -5.006 -4.369 1.00 0.00 N ATOM 1855 CA ILE A 124 4.217 -4.406 -3.304 1.00 0.00 C ATOM 1856 C ILE A 124 3.127 -3.505 -3.852 1.00 0.00 C ATOM 1857 O ILE A 124 1.987 -3.557 -3.393 1.00 0.00 O ATOM 1858 CB ILE A 124 5.031 -3.647 -2.202 1.00 0.00 C ATOM 1859 CG1 ILE A 124 6.024 -2.640 -2.804 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.741 -4.623 -1.284 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.666 -1.707 -1.789 1.00 0.00 C ATOM 0 H ILE A 124 6.011 -4.703 -4.383 1.00 0.00 H new ATOM 0 HA ILE A 124 3.758 -5.266 -2.816 1.00 0.00 H new ATOM 0 HB ILE A 124 4.314 -3.077 -1.611 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.810 -3.189 -3.323 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.506 -2.041 -3.553 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.299 -4.071 -0.528 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.007 -5.264 -0.797 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.429 -5.236 -1.867 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.352 -1.031 -2.299 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.891 -1.128 -1.287 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.216 -2.293 -1.053 1.00 0.00 H new ATOM 1873 N GLN A 125 3.486 -2.719 -4.851 1.00 0.00 N ATOM 1874 CA GLN A 125 2.597 -1.785 -5.516 1.00 0.00 C ATOM 1875 C GLN A 125 1.420 -2.584 -6.074 1.00 0.00 C ATOM 1876 O GLN A 125 0.223 -2.321 -5.763 1.00 0.00 O ATOM 1877 CB GLN A 125 3.401 -1.164 -6.675 1.00 0.00 C ATOM 1878 CG GLN A 125 3.024 0.226 -7.117 1.00 0.00 C ATOM 1879 CD GLN A 125 1.612 0.372 -7.587 1.00 0.00 C ATOM 1880 OE1 GLN A 125 0.765 0.657 -6.684 1.00 0.00 O flip ATOM 1881 NE2 GLN A 125 1.298 0.223 -8.767 1.00 0.00 N flip ATOM 0 H GLN A 125 4.432 -2.713 -5.233 1.00 0.00 H new ATOM 0 HA GLN A 125 2.227 -1.009 -4.846 1.00 0.00 H new ATOM 0 HB2 GLN A 125 4.452 -1.152 -6.386 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.315 -1.826 -7.537 1.00 0.00 H new ATOM 0 HG2 GLN A 125 3.189 0.913 -6.287 1.00 0.00 H new ATOM 0 HG3 GLN A 125 3.693 0.531 -7.921 1.00 0.00 H new ATOM 0 HE21 GLN A 125 2.011 -0.006 -9.460 1.00 0.00 H new ATOM 0 HE22 GLN A 125 0.325 0.328 -9.053 1.00 0.00 H new ATOM 1890 N ALA A 126 1.793 -3.605 -6.835 1.00 0.00 N ATOM 1891 CA ALA A 126 0.881 -4.482 -7.501 1.00 0.00 C ATOM 1892 C ALA A 126 -0.031 -5.185 -6.504 1.00 0.00 C ATOM 1893 O ALA A 126 -1.253 -5.079 -6.617 1.00 0.00 O ATOM 1894 CB ALA A 126 1.661 -5.517 -8.310 1.00 0.00 C ATOM 0 H ALA A 126 2.772 -3.840 -7.001 1.00 0.00 H new ATOM 0 HA ALA A 126 0.259 -3.887 -8.170 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.963 -6.184 -8.816 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.280 -5.009 -9.050 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.297 -6.097 -7.642 1.00 0.00 H new ATOM 1900 N ALA A 127 0.571 -5.850 -5.497 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.168 -6.672 -4.535 1.00 0.00 C ATOM 1902 C ALA A 127 -1.121 -5.850 -3.725 1.00 0.00 C ATOM 1903 O ALA A 127 -2.265 -6.276 -3.490 1.00 0.00 O ATOM 1904 CB ALA A 127 0.778 -7.456 -3.622 1.00 0.00 C ATOM 0 H ALA A 127 1.578 -5.829 -5.334 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.751 -7.390 -5.112 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.195 -8.054 -2.922 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.405 -8.112 -4.225 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.408 -6.761 -3.068 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.685 -4.649 -3.334 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.504 -3.797 -2.539 1.00 0.00 C ATOM 1912 C ALA A 128 -2.776 -3.444 -3.251 1.00 0.00 C ATOM 1913 O ALA A 128 -3.792 -3.852 -2.830 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.773 -2.539 -2.148 1.00 0.00 C ATOM 0 H ALA A 128 0.231 -4.266 -3.566 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.752 -4.350 -1.633 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.427 -1.912 -1.542 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.116 -2.798 -1.573 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.478 -1.995 -3.046 1.00 0.00 H new ATOM 1920 N THR A 129 -2.710 -2.773 -4.373 1.00 0.00 N ATOM 1921 CA THR A 129 -3.961 -2.340 -5.019 1.00 0.00 C ATOM 1922 C THR A 129 -4.808 -3.556 -5.546 1.00 0.00 C ATOM 1923 O THR A 129 -6.088 -3.518 -5.575 1.00 0.00 O ATOM 1924 CB THR A 129 -3.703 -1.279 -6.117 1.00 0.00 C ATOM 1925 OG1 THR A 129 -4.942 -0.816 -6.675 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.809 -1.833 -7.204 1.00 0.00 C ATOM 0 H THR A 129 -1.850 -2.514 -4.856 1.00 0.00 H new ATOM 0 HA THR A 129 -4.566 -1.856 -4.252 1.00 0.00 H new ATOM 0 HB THR A 129 -3.194 -0.433 -5.655 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.966 -1.020 -7.633 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.643 -1.069 -7.963 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.853 -2.130 -6.773 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.286 -2.700 -7.661 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.080 -4.672 -5.742 1.00 0.00 N ATOM 1935 CA LYS A 130 -4.651 -5.907 -6.292 1.00 0.00 C ATOM 1936 C LYS A 130 -5.701 -6.391 -5.340 1.00 0.00 C ATOM 1937 O LYS A 130 -6.730 -6.893 -5.725 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.548 -6.970 -6.448 1.00 0.00 C ATOM 1939 CG LYS A 130 -3.950 -8.250 -7.168 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.349 -7.975 -8.589 1.00 0.00 C ATOM 1941 CE LYS A 130 -4.611 -9.266 -9.356 1.00 0.00 C ATOM 1942 NZ LYS A 130 -5.067 -8.993 -10.728 1.00 0.00 N ATOM 0 H LYS A 130 -3.086 -4.739 -5.524 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.087 -5.721 -7.273 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -2.713 -6.522 -6.986 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.183 -7.234 -5.455 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.119 -8.955 -7.151 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.779 -8.722 -6.640 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -5.245 -7.354 -8.603 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.561 -7.409 -9.086 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.700 -9.864 -9.386 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -5.363 -9.856 -8.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -5.236 -9.892 -11.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -5.949 -8.443 -10.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -4.338 -8.451 -11.235 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.397 -6.212 -4.112 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.227 -6.459 -3.009 1.00 0.00 C ATOM 1958 C ALA A 131 -7.120 -5.271 -2.792 1.00 0.00 C ATOM 1959 O ALA A 131 -8.343 -5.381 -2.933 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.280 -6.633 -1.880 1.00 0.00 C ATOM 0 H ALA A 131 -4.481 -5.858 -3.834 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.876 -7.326 -3.130 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.838 -6.832 -0.965 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.615 -7.471 -2.089 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.691 -5.724 -1.756 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.500 -4.109 -2.595 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.158 -2.878 -2.157 1.00 0.00 C ATOM 1968 C TRP A 132 -8.084 -2.212 -3.207 1.00 0.00 C ATOM 1969 O TRP A 132 -8.259 -1.005 -3.222 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.176 -1.838 -1.622 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.318 -2.285 -0.479 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.907 -3.523 -0.256 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.757 -1.497 0.578 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.068 -3.583 0.744 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -3.954 -2.369 1.309 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.815 -0.150 0.973 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.218 -1.967 2.378 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.083 0.225 2.052 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.294 -0.678 2.727 1.00 0.00 C ATOM 0 H TRP A 132 -5.497 -3.994 -2.740 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.799 -3.226 -1.347 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.527 -1.524 -2.439 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.740 -0.960 -1.308 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.226 -4.380 -0.831 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.575 -4.422 1.049 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.422 0.563 0.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.596 -2.661 2.924 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.120 1.251 2.387 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.714 -0.333 3.570 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.624 -2.961 -4.090 1.00 0.00 N ATOM 1991 CA ARG A 133 -9.697 -2.446 -4.928 1.00 0.00 C ATOM 1992 C ARG A 133 -11.105 -3.110 -4.817 1.00 0.00 C ATOM 1993 O ARG A 133 -12.122 -2.428 -4.698 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.262 -2.162 -6.377 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.420 -2.066 -7.387 1.00 0.00 C ATOM 1996 CD ARG A 133 -10.796 -3.437 -7.872 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.274 -3.688 -7.927 1.00 0.00 N ATOM 1998 CZ ARG A 133 -12.796 -4.665 -8.741 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.104 -5.087 -9.774 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.006 -5.152 -8.544 1.00 0.00 N ATOM 0 H ARG A 133 -8.361 -3.930 -4.270 1.00 0.00 H new ATOM 0 HA ARG A 133 -9.887 -1.484 -4.452 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.701 -1.228 -6.397 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -8.581 -2.950 -6.699 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.281 -1.588 -6.920 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.127 -1.441 -8.230 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.377 -3.585 -8.867 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -10.337 -4.179 -7.219 1.00 0.00 H new ATOM 0 HE ARG A 133 -12.901 -3.125 -7.352 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.185 -4.690 -9.969 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.486 -5.812 -10.382 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -14.577 -4.804 -7.774 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.371 -5.877 -9.162 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.112 -4.406 -4.854 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.277 -5.257 -5.269 1.00 0.00 C ATOM 2016 C LYS A 134 -13.616 -5.228 -4.469 1.00 0.00 C ATOM 2017 O LYS A 134 -14.282 -6.240 -4.383 1.00 0.00 O ATOM 2018 CB LYS A 134 -11.778 -6.651 -5.470 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.303 -7.266 -4.202 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.524 -8.518 -4.421 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.171 -8.181 -4.938 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.447 -9.353 -5.498 1.00 0.00 N ATOM 0 H LYS A 134 -10.295 -4.959 -4.594 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.627 -4.773 -6.181 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.575 -7.263 -5.892 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -10.964 -6.643 -6.195 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -10.683 -6.548 -3.665 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.161 -7.484 -3.566 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.439 -9.073 -3.487 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.045 -9.163 -5.129 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.264 -7.417 -5.710 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.579 -7.748 -4.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.525 -9.449 -5.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.007 -10.215 -5.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.302 -9.216 -6.519 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.047 -4.098 -4.020 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.301 -3.986 -3.258 1.00 0.00 C ATOM 2038 C LEU A 135 -16.552 -4.049 -4.116 1.00 0.00 C ATOM 2039 O LEU A 135 -16.744 -3.209 -4.996 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.308 -2.699 -2.450 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.751 -2.769 -1.038 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.512 -3.598 -1.002 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.420 -1.371 -0.579 1.00 0.00 C ATOM 0 H LEU A 135 -13.560 -3.212 -4.156 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.329 -4.855 -2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -14.740 -1.949 -3.001 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.336 -2.341 -2.392 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.495 -3.223 -0.384 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.129 -3.636 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.740 -4.608 -1.341 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.760 -3.157 -1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.019 -1.406 0.434 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.679 -0.934 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.323 -0.761 -0.591 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.384 -5.085 -3.905 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.693 -5.193 -4.490 1.00 0.00 C ATOM 2057 C PRO A 136 -19.791 -4.780 -3.483 1.00 0.00 C ATOM 2058 O PRO A 136 -19.888 -5.353 -2.374 1.00 0.00 O ATOM 2059 CB PRO A 136 -18.814 -6.695 -4.788 1.00 0.00 C ATOM 2060 CG PRO A 136 -17.799 -7.373 -3.903 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.081 -6.292 -3.135 1.00 0.00 C ATOM 0 HA PRO A 136 -18.816 -4.551 -5.363 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -19.820 -7.056 -4.576 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -18.616 -6.902 -5.840 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -18.288 -8.069 -3.221 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -17.095 -7.953 -4.500 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.442 -6.218 -2.109 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.008 -6.479 -3.082 1.00 0.00 H new