USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 914 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 396 HIS : no HD1:sc= -2.66! K(o=-3.7!,f=-7.3) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 148:sc= -1.08 (180deg=-2.35) USER MOD Set 2.1: A 384 ASN : amide:sc= 0.367 K(o=1.4,f=-2.4) USER MOD Set 2.2: A 389 LYS NZ :NH3+ -140:sc= 1.02 (180deg=0.751) USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 333 HIS : no HE2:sc= 0.469 K(o=0.47,f=-1.6!) USER MOD Single : A 334 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 340 TYR OH : rot 119:sc= 0.0914 USER MOD Single : A 342 TYR OH : rot 119:sc= -0.487 USER MOD Single : A 343 GLN : amide:sc= -1.81 K(o=-1.8,f=-0.6) USER MOD Single : A 346 SER OG : rot 180:sc= 0 USER MOD Single : A 348 SER OG : rot 180:sc= 0.114 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 180:sc= 0 USER MOD Single : A 362 LYS NZ :NH3+ -160:sc= 0.969 (180deg=0.308) USER MOD Single : A 370 ASN : amide:sc= -1.1! K(o=-1.1!,f=-0.11) USER MOD Single : A 378 ASN : amide:sc= 1.18 K(o=1.2,f=-0.14) USER MOD Single : A 379 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-1.8) USER MOD Single : A 380 LYS NZ :NH3+ -163:sc= 0.967 (180deg=0.664) USER MOD Single : A 381 ASN : amide:sc= -0.244 K(o=-0.24,f=-1.1) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 385 MET CE :methyl 150:sc= -2.23! (180deg=-5.04!) USER MOD Single : A 386 THR OG1 : rot -163:sc= -1.77 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 390 MET CE :methyl -161:sc= -0.594 (180deg=-1.03) USER MOD Single : A 391 SER OG : rot 180:sc= 0.913 USER MOD Single : A 397 TYR OH : rot 91:sc= -0.39! USER MOD Single : A 398 TYR OH : rot -17:sc= 0.34 USER MOD Single : A 401 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.17) USER MOD Single : A 405 LYS NZ :NH3+ -168:sc= 0.456 (180deg=0.257) USER MOD Single : A 409 GLN : amide:sc= -6.06! K(o=-6.1!,f=-1.3) USER MOD Single : A 416 MET CE :methyl -161:sc= -0.279 (180deg=-1) USER MOD Single : A 417 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0.00483 USER MOD Single : A 423 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 424 SER OG : rot -103:sc= 1.24 USER MOD Single : A 427 THR OG1 : rot -44:sc= -0.932! USER MOD Single : A 432 HIS : no HD1:sc= -3.24! K(o=-3.2!,f=-1.1) USER MOD Single : A 435 SER OG : rot -77:sc= 1.23 USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -11.363 -2.995 14.418 1.00 6.78 N ATOM 2 CA GLY A 331 -10.376 -1.895 14.332 1.00 6.11 C ATOM 3 C GLY A 331 -10.827 -0.807 13.382 1.00 5.22 C ATOM 4 O GLY A 331 -11.999 -0.427 13.374 1.00 5.14 O ATOM 0 HA2 GLY A 331 -10.219 -1.470 15.323 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -9.417 -2.293 14.000 1.00 6.11 H new ATOM 10 N SER A 332 -9.909 -0.323 12.560 1.00 4.99 N ATOM 11 CA SER A 332 -10.199 0.757 11.628 1.00 4.63 C ATOM 12 C SER A 332 -10.831 0.199 10.353 1.00 3.82 C ATOM 13 O SER A 332 -10.277 0.331 9.262 1.00 4.13 O ATOM 14 CB SER A 332 -8.905 1.507 11.307 1.00 5.44 C ATOM 15 OG SER A 332 -8.235 1.884 12.503 1.00 6.08 O ATOM 0 H SER A 332 -8.949 -0.664 12.519 1.00 4.99 H new ATOM 0 HA SER A 332 -10.908 1.449 12.081 1.00 4.63 H new ATOM 0 HB2 SER A 332 -8.253 0.876 10.702 1.00 5.44 H new ATOM 0 HB3 SER A 332 -9.130 2.394 10.715 1.00 5.44 H new ATOM 0 HG SER A 332 -7.409 2.361 12.279 1.00 6.08 H new ATOM 21 N HIS A 333 -12.004 -0.421 10.514 1.00 3.28 N ATOM 22 CA HIS A 333 -12.679 -1.143 9.434 1.00 2.94 C ATOM 23 C HIS A 333 -11.808 -2.297 8.949 1.00 2.02 C ATOM 24 O HIS A 333 -11.860 -3.407 9.485 1.00 2.49 O ATOM 25 CB HIS A 333 -13.014 -0.233 8.238 1.00 3.89 C ATOM 26 CG HIS A 333 -14.039 0.824 8.500 1.00 4.68 C ATOM 27 ND1 HIS A 333 -14.033 2.044 7.858 1.00 5.34 N ATOM 28 CD2 HIS A 333 -15.127 0.829 9.300 1.00 5.35 C ATOM 29 CE1 HIS A 333 -15.072 2.749 8.254 1.00 6.24 C ATOM 30 NE2 HIS A 333 -15.757 2.036 9.129 1.00 6.26 N ATOM 0 H HIS A 333 -12.512 -0.436 11.398 1.00 3.28 H new ATOM 0 HA HIS A 333 -13.616 -1.520 9.845 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -12.096 0.251 7.904 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -13.363 -0.857 7.416 1.00 3.89 H new ATOM 0 HD1 HIS A 333 -13.334 2.352 7.182 1.00 5.34 H new ATOM 0 HD2 HIS A 333 -15.443 0.030 9.954 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -15.322 3.745 7.919 1.00 6.24 H new ATOM 39 N MET A 334 -10.998 -1.998 7.947 1.00 1.20 N ATOM 40 CA MET A 334 -10.021 -2.915 7.388 1.00 0.62 C ATOM 41 C MET A 334 -8.950 -2.093 6.700 1.00 0.57 C ATOM 42 O MET A 334 -9.253 -1.057 6.107 1.00 0.92 O ATOM 43 CB MET A 334 -10.661 -3.883 6.380 1.00 1.35 C ATOM 44 CG MET A 334 -11.194 -5.160 7.008 1.00 2.01 C ATOM 45 SD MET A 334 -9.911 -6.081 7.879 1.00 3.03 S ATOM 46 CE MET A 334 -10.840 -7.507 8.440 1.00 3.71 C ATOM 0 H MET A 334 -11.003 -1.087 7.489 1.00 1.20 H new ATOM 0 HA MET A 334 -9.597 -3.518 8.191 1.00 0.62 H new ATOM 0 HB2 MET A 334 -11.477 -3.373 5.869 1.00 1.35 H new ATOM 0 HB3 MET A 334 -9.923 -4.143 5.621 1.00 1.35 H new ATOM 0 HG2 MET A 334 -11.996 -4.913 7.703 1.00 2.01 H new ATOM 0 HG3 MET A 334 -11.628 -5.791 6.232 1.00 2.01 H new ATOM 0 HE1 MET A 334 -10.182 -8.174 8.997 1.00 3.71 H new ATOM 0 HE2 MET A 334 -11.655 -7.179 9.085 1.00 3.71 H new ATOM 0 HE3 MET A 334 -11.249 -8.037 7.579 1.00 3.71 H new ATOM 56 N ARG A 335 -7.703 -2.526 6.801 1.00 0.40 N ATOM 57 CA ARG A 335 -6.606 -1.790 6.190 1.00 0.32 C ATOM 58 C ARG A 335 -6.776 -1.754 4.678 1.00 0.28 C ATOM 59 O ARG A 335 -7.045 -2.780 4.052 1.00 0.42 O ATOM 60 CB ARG A 335 -5.237 -2.402 6.528 1.00 0.37 C ATOM 61 CG ARG A 335 -4.952 -2.539 8.015 1.00 0.56 C ATOM 62 CD ARG A 335 -5.464 -3.850 8.583 1.00 0.93 C ATOM 63 NE ARG A 335 -5.150 -3.992 10.002 1.00 1.32 N ATOM 64 CZ ARG A 335 -4.641 -5.099 10.547 1.00 2.05 C ATOM 65 NH1 ARG A 335 -4.344 -6.148 9.791 1.00 2.81 N ATOM 66 NH2 ARG A 335 -4.426 -5.161 11.852 1.00 2.51 N ATOM 0 H ARG A 335 -7.426 -3.374 7.295 1.00 0.40 H new ATOM 0 HA ARG A 335 -6.635 -0.779 6.596 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.171 -3.388 6.067 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.458 -1.787 6.078 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -3.878 -2.467 8.185 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -5.415 -1.709 8.549 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -6.543 -3.909 8.443 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -5.025 -4.681 8.030 1.00 0.93 H new ATOM 0 HE ARG A 335 -5.331 -3.196 10.614 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -4.504 -6.113 8.784 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -3.955 -6.990 10.216 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -4.649 -4.361 12.444 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -4.037 -6.009 12.265 1.00 2.51 H new ATOM 80 N LEU A 336 -6.646 -0.564 4.108 1.00 0.23 N ATOM 81 CA LEU A 336 -6.619 -0.400 2.657 1.00 0.28 C ATOM 82 C LEU A 336 -5.330 -0.988 2.134 1.00 0.14 C ATOM 83 O LEU A 336 -4.546 -1.501 2.910 1.00 0.20 O ATOM 84 CB LEU A 336 -6.695 1.077 2.252 1.00 0.48 C ATOM 85 CG LEU A 336 -8.000 1.805 2.568 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.534 2.458 1.318 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.029 0.864 3.145 1.00 0.67 C ATOM 0 H LEU A 336 -6.557 0.308 4.630 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.485 -0.909 2.235 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -5.880 1.608 2.745 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.517 1.146 1.179 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.792 2.569 3.317 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.465 2.976 1.548 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.804 3.174 0.941 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.720 1.696 0.561 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -9.946 1.414 3.359 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.240 0.071 2.427 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.645 0.426 4.067 1.00 0.67 H new ATOM 99 N LEU A 337 -5.083 -0.904 0.844 1.00 0.15 N ATOM 100 CA LEU A 337 -3.846 -1.442 0.314 1.00 0.12 C ATOM 101 C LEU A 337 -2.671 -0.648 0.876 1.00 0.11 C ATOM 102 O LEU A 337 -1.702 -1.225 1.362 1.00 0.12 O ATOM 103 CB LEU A 337 -3.882 -1.435 -1.220 1.00 0.14 C ATOM 104 CG LEU A 337 -2.683 -2.042 -1.938 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.620 -0.999 -2.132 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.126 -3.226 -1.171 1.00 0.15 C ATOM 0 H LEU A 337 -5.705 -0.479 0.156 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.722 -2.480 0.622 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.776 -1.969 -1.541 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.990 -0.403 -1.553 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.014 -2.401 -2.912 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.766 -1.441 -2.646 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.019 -0.180 -2.730 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.302 -0.619 -1.161 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.272 -3.638 -1.708 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.809 -2.901 -0.180 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -2.896 -3.991 -1.073 1.00 0.15 H new ATOM 118 N TRP A 338 -2.785 0.674 0.866 1.00 0.12 N ATOM 119 CA TRP A 338 -1.752 1.519 1.459 1.00 0.14 C ATOM 120 C TRP A 338 -1.747 1.372 2.984 1.00 0.14 C ATOM 121 O TRP A 338 -0.694 1.417 3.616 1.00 0.17 O ATOM 122 CB TRP A 338 -1.928 2.999 1.054 1.00 0.16 C ATOM 123 CG TRP A 338 -3.210 3.623 1.510 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.340 3.801 0.772 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.490 4.168 2.803 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.305 4.406 1.528 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.810 4.638 2.778 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.755 4.293 3.981 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.411 5.225 3.882 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.351 4.872 5.077 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.671 5.333 5.020 1.00 0.21 C ATOM 0 H TRP A 338 -3.571 1.181 0.460 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.789 1.185 1.074 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.095 3.574 1.459 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.869 3.074 -0.032 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.457 3.507 -0.261 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.244 4.645 1.209 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.735 3.941 4.032 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.429 5.583 3.840 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.792 4.972 5.995 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.112 5.784 5.897 1.00 0.21 H new ATOM 142 N ASP A 339 -2.928 1.172 3.567 1.00 0.14 N ATOM 143 CA ASP A 339 -3.057 1.029 5.020 1.00 0.17 C ATOM 144 C ASP A 339 -2.463 -0.306 5.445 1.00 0.16 C ATOM 145 O ASP A 339 -1.944 -0.467 6.550 1.00 0.23 O ATOM 146 CB ASP A 339 -4.533 1.108 5.438 1.00 0.23 C ATOM 147 CG ASP A 339 -4.712 1.509 6.892 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.614 2.713 7.197 1.00 1.15 O ATOM 149 OD2 ASP A 339 -4.974 0.623 7.728 1.00 0.86 O ATOM 0 H ASP A 339 -3.809 1.105 3.058 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.519 1.841 5.510 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.048 1.827 4.801 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.005 0.140 5.272 1.00 0.23 H new ATOM 154 N TYR A 340 -2.540 -1.249 4.526 1.00 0.11 N ATOM 155 CA TYR A 340 -2.021 -2.588 4.712 1.00 0.10 C ATOM 156 C TYR A 340 -0.502 -2.595 4.662 1.00 0.08 C ATOM 157 O TYR A 340 0.145 -3.203 5.515 1.00 0.09 O ATOM 158 CB TYR A 340 -2.576 -3.490 3.623 1.00 0.11 C ATOM 159 CG TYR A 340 -2.357 -4.939 3.897 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.770 -5.490 5.093 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.737 -5.750 2.969 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.571 -6.817 5.365 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.533 -7.085 3.227 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.951 -7.619 4.432 1.00 0.16 C ATOM 165 OH TYR A 340 -1.747 -8.953 4.704 1.00 0.20 O ATOM 0 H TYR A 340 -2.973 -1.102 3.614 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.329 -2.952 5.692 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.645 -3.304 3.515 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.110 -3.231 2.672 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.258 -4.865 5.826 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.408 -5.332 2.029 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.898 -7.233 6.306 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.049 -7.713 2.493 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.228 -9.498 4.047 1.00 0.20 H new ATOM 175 N VAL A 341 0.073 -1.918 3.665 1.00 0.08 N ATOM 176 CA VAL A 341 1.526 -1.892 3.523 1.00 0.07 C ATOM 177 C VAL A 341 2.155 -1.311 4.775 1.00 0.08 C ATOM 178 O VAL A 341 3.236 -1.710 5.160 1.00 0.08 O ATOM 179 CB VAL A 341 2.021 -1.095 2.283 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.227 -1.448 1.044 1.00 0.07 C ATOM 181 CG2 VAL A 341 2.008 0.406 2.511 1.00 0.09 C ATOM 0 H VAL A 341 -0.437 -1.390 2.957 1.00 0.08 H new ATOM 0 HA VAL A 341 1.835 -2.927 3.375 1.00 0.07 H new ATOM 0 HB VAL A 341 3.058 -1.391 2.126 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.600 -0.873 0.197 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.333 -2.512 0.835 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.175 -1.214 1.207 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.363 0.913 1.614 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.992 0.731 2.734 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.660 0.652 3.349 1.00 0.09 H new ATOM 191 N TYR A 342 1.456 -0.379 5.412 1.00 0.08 N ATOM 192 CA TYR A 342 1.906 0.189 6.685 1.00 0.10 C ATOM 193 C TYR A 342 2.118 -0.895 7.738 1.00 0.11 C ATOM 194 O TYR A 342 3.121 -0.887 8.452 1.00 0.14 O ATOM 195 CB TYR A 342 0.900 1.211 7.225 1.00 0.11 C ATOM 196 CG TYR A 342 1.155 2.628 6.782 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.295 3.301 7.199 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.257 3.300 5.971 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.531 4.605 6.816 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.490 4.601 5.582 1.00 0.19 C ATOM 201 CZ TYR A 342 1.629 5.250 6.006 1.00 0.17 C ATOM 202 OH TYR A 342 1.859 6.551 5.626 1.00 0.21 O ATOM 0 H TYR A 342 0.574 0.002 5.070 1.00 0.08 H new ATOM 0 HA TYR A 342 2.856 0.685 6.485 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.101 0.919 6.909 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.914 1.176 8.314 1.00 0.11 H new ATOM 0 HD1 TYR A 342 3.008 2.796 7.833 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.639 2.797 5.638 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.421 5.116 7.152 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.219 5.111 4.946 1.00 0.19 H new ATOM 0 HH TYR A 342 1.937 6.598 4.650 1.00 0.21 H new ATOM 212 N GLN A 343 1.182 -1.834 7.820 1.00 0.12 N ATOM 213 CA GLN A 343 1.241 -2.877 8.827 1.00 0.18 C ATOM 214 C GLN A 343 2.362 -3.839 8.475 1.00 0.18 C ATOM 215 O GLN A 343 3.041 -4.389 9.339 1.00 0.25 O ATOM 216 CB GLN A 343 -0.112 -3.600 8.897 1.00 0.28 C ATOM 217 CG GLN A 343 -0.188 -4.899 8.118 1.00 0.55 C ATOM 218 CD GLN A 343 -0.155 -6.114 9.021 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.196 -6.631 9.417 1.00 1.40 O ATOM 220 NE2 GLN A 343 1.038 -6.549 9.386 1.00 1.15 N ATOM 0 H GLN A 343 0.375 -1.891 7.199 1.00 0.12 H new ATOM 0 HA GLN A 343 1.445 -2.447 9.808 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.342 -3.807 9.942 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.886 -2.927 8.528 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.104 -4.913 7.528 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.644 -4.948 7.416 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.878 -6.090 9.033 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.119 -7.344 10.020 1.00 1.15 H new ATOM 229 N LEU A 344 2.542 -4.022 7.181 1.00 0.15 N ATOM 230 CA LEU A 344 3.576 -4.891 6.664 1.00 0.16 C ATOM 231 C LEU A 344 4.944 -4.229 6.800 1.00 0.18 C ATOM 232 O LEU A 344 5.958 -4.884 7.022 1.00 0.27 O ATOM 233 CB LEU A 344 3.271 -5.184 5.199 1.00 0.13 C ATOM 234 CG LEU A 344 1.861 -5.704 4.931 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.589 -5.735 3.449 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.670 -7.086 5.516 1.00 0.18 C ATOM 0 H LEU A 344 1.976 -3.572 6.462 1.00 0.15 H new ATOM 0 HA LEU A 344 3.596 -5.821 7.232 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.423 -4.272 4.621 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.989 -5.917 4.832 1.00 0.13 H new ATOM 0 HG LEU A 344 1.156 -5.026 5.412 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.580 -6.108 3.272 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.681 -4.728 3.041 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.309 -6.391 2.961 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.657 -7.431 5.310 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.386 -7.774 5.066 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.829 -7.050 6.594 1.00 0.18 H new ATOM 248 N LEU A 345 4.931 -2.915 6.673 1.00 0.12 N ATOM 249 CA LEU A 345 6.122 -2.077 6.761 1.00 0.13 C ATOM 250 C LEU A 345 6.692 -2.081 8.172 1.00 0.19 C ATOM 251 O LEU A 345 7.899 -1.930 8.372 1.00 0.29 O ATOM 252 CB LEU A 345 5.754 -0.641 6.358 1.00 0.10 C ATOM 253 CG LEU A 345 6.226 -0.178 4.972 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.530 -1.357 4.076 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.184 0.723 4.315 1.00 0.10 C ATOM 0 H LEU A 345 4.076 -2.385 6.502 1.00 0.12 H new ATOM 0 HA LEU A 345 6.881 -2.475 6.088 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.669 -0.542 6.400 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.166 0.039 7.104 1.00 0.10 H new ATOM 0 HG LEU A 345 7.144 0.393 5.112 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.862 -0.998 3.102 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.316 -1.963 4.526 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.631 -1.962 3.953 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.541 1.038 3.335 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.249 0.175 4.201 1.00 0.10 H new ATOM 0 HD23 LEU A 345 5.017 1.601 4.939 1.00 0.10 H new ATOM 267 N SER A 346 5.816 -2.253 9.148 1.00 0.25 N ATOM 268 CA SER A 346 6.206 -2.179 10.543 1.00 0.33 C ATOM 269 C SER A 346 6.678 -3.542 11.059 1.00 0.30 C ATOM 270 O SER A 346 7.392 -3.620 12.060 1.00 0.53 O ATOM 271 CB SER A 346 5.025 -1.666 11.376 1.00 0.51 C ATOM 272 OG SER A 346 5.420 -1.337 12.697 1.00 1.43 O ATOM 0 H SER A 346 4.826 -2.446 8.997 1.00 0.25 H new ATOM 0 HA SER A 346 7.042 -1.486 10.637 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.595 -0.787 10.895 1.00 0.51 H new ATOM 0 HB3 SER A 346 4.245 -2.426 11.408 1.00 0.51 H new ATOM 0 HG SER A 346 4.644 -1.012 13.199 1.00 1.43 H new ATOM 278 N ASP A 347 6.306 -4.609 10.360 1.00 0.32 N ATOM 279 CA ASP A 347 6.593 -5.960 10.836 1.00 0.32 C ATOM 280 C ASP A 347 7.597 -6.667 9.933 1.00 0.30 C ATOM 281 O ASP A 347 7.498 -6.636 8.708 1.00 0.30 O ATOM 282 CB ASP A 347 5.302 -6.777 10.922 1.00 0.35 C ATOM 283 CG ASP A 347 5.458 -8.032 11.761 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.460 -8.752 11.573 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.591 -8.311 12.612 1.00 0.67 O ATOM 0 H ASP A 347 5.810 -4.568 9.470 1.00 0.32 H new ATOM 0 HA ASP A 347 7.033 -5.876 11.830 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.512 -6.157 11.346 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.985 -7.054 9.917 1.00 0.35 H new ATOM 290 N SER A 348 8.542 -7.328 10.576 1.00 0.34 N ATOM 291 CA SER A 348 9.654 -7.979 9.916 1.00 0.35 C ATOM 292 C SER A 348 9.235 -9.165 9.052 1.00 0.31 C ATOM 293 O SER A 348 9.868 -9.459 8.043 1.00 0.32 O ATOM 294 CB SER A 348 10.617 -8.446 10.985 1.00 0.46 C ATOM 295 OG SER A 348 9.924 -8.804 12.173 1.00 1.53 O ATOM 0 H SER A 348 8.557 -7.428 11.591 1.00 0.34 H new ATOM 0 HA SER A 348 10.114 -7.258 9.240 1.00 0.35 H new ATOM 0 HB2 SER A 348 11.185 -9.301 10.619 1.00 0.46 H new ATOM 0 HB3 SER A 348 11.335 -7.656 11.203 1.00 0.46 H new ATOM 0 HG SER A 348 10.567 -9.104 12.849 1.00 1.53 H new ATOM 301 N ARG A 349 8.189 -9.865 9.460 1.00 0.33 N ATOM 302 CA ARG A 349 7.708 -11.031 8.708 1.00 0.35 C ATOM 303 C ARG A 349 7.322 -10.677 7.278 1.00 0.29 C ATOM 304 O ARG A 349 7.202 -11.558 6.428 1.00 0.34 O ATOM 305 CB ARG A 349 6.560 -11.734 9.413 1.00 0.42 C ATOM 306 CG ARG A 349 5.396 -10.849 9.760 1.00 0.55 C ATOM 307 CD ARG A 349 4.462 -11.589 10.685 1.00 0.59 C ATOM 308 NE ARG A 349 3.713 -10.690 11.559 1.00 1.23 N ATOM 309 CZ ARG A 349 2.495 -10.945 12.030 1.00 1.67 C ATOM 310 NH1 ARG A 349 1.867 -12.069 11.710 1.00 1.93 N ATOM 311 NH2 ARG A 349 1.898 -10.068 12.821 1.00 2.56 N ATOM 0 H ARG A 349 7.654 -9.654 10.302 1.00 0.33 H new ATOM 0 HA ARG A 349 8.547 -11.725 8.662 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.205 -12.545 8.778 1.00 0.42 H new ATOM 0 HB3 ARG A 349 6.938 -12.188 10.329 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.750 -9.935 10.237 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.868 -10.552 8.854 1.00 0.55 H new ATOM 0 HD2 ARG A 349 3.764 -12.181 10.094 1.00 0.59 H new ATOM 0 HD3 ARG A 349 5.036 -12.287 11.294 1.00 0.59 H new ATOM 0 HE ARG A 349 4.152 -9.809 11.826 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.318 -12.748 11.097 1.00 1.93 H new ATOM 0 HH12 ARG A 349 0.933 -12.254 12.077 1.00 1.93 H new ATOM 0 HH21 ARG A 349 2.372 -9.199 13.068 1.00 2.56 H new ATOM 0 HH22 ARG A 349 0.964 -10.261 13.183 1.00 2.56 H new ATOM 325 N TYR A 350 7.134 -9.393 7.005 1.00 0.22 N ATOM 326 CA TYR A 350 6.748 -8.962 5.676 1.00 0.17 C ATOM 327 C TYR A 350 7.852 -8.171 5.002 1.00 0.16 C ATOM 328 O TYR A 350 7.709 -7.776 3.850 1.00 0.15 O ATOM 329 CB TYR A 350 5.504 -8.105 5.752 1.00 0.17 C ATOM 330 CG TYR A 350 4.455 -8.684 6.642 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.817 -9.864 6.311 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.098 -8.045 7.811 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.845 -10.391 7.114 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.131 -8.563 8.629 1.00 0.28 C ATOM 335 CZ TYR A 350 2.497 -9.739 8.281 1.00 0.31 C ATOM 336 OH TYR A 350 1.513 -10.253 9.093 1.00 0.39 O ATOM 0 H TYR A 350 7.243 -8.639 7.683 1.00 0.22 H new ATOM 0 HA TYR A 350 6.553 -9.857 5.085 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.774 -7.113 6.114 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.094 -7.978 4.750 1.00 0.17 H new ATOM 0 HD1 TYR A 350 4.091 -10.379 5.402 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.589 -7.123 8.085 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.352 -11.311 6.838 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.865 -8.054 9.543 1.00 0.28 H new ATOM 0 HH TYR A 350 1.395 -9.671 9.872 1.00 0.39 H new ATOM 346 N GLU A 351 8.956 -7.961 5.707 1.00 0.18 N ATOM 347 CA GLU A 351 10.044 -7.129 5.187 1.00 0.21 C ATOM 348 C GLU A 351 10.691 -7.770 3.956 1.00 0.21 C ATOM 349 O GLU A 351 11.471 -7.137 3.245 1.00 0.24 O ATOM 350 CB GLU A 351 11.090 -6.849 6.268 1.00 0.28 C ATOM 351 CG GLU A 351 12.008 -8.016 6.548 1.00 0.48 C ATOM 352 CD GLU A 351 12.993 -7.727 7.658 1.00 0.99 C ATOM 353 OE1 GLU A 351 13.797 -6.784 7.514 1.00 1.05 O ATOM 354 OE2 GLU A 351 12.980 -8.447 8.676 1.00 1.78 O ATOM 0 H GLU A 351 9.126 -8.350 6.634 1.00 0.18 H new ATOM 0 HA GLU A 351 9.613 -6.176 4.881 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.691 -5.991 5.965 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.580 -6.571 7.190 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.411 -8.888 6.815 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.554 -8.270 5.640 1.00 0.48 H new ATOM 361 N ASN A 352 10.351 -9.029 3.706 1.00 0.19 N ATOM 362 CA ASN A 352 10.823 -9.731 2.520 1.00 0.21 C ATOM 363 C ASN A 352 9.897 -9.448 1.338 1.00 0.16 C ATOM 364 O ASN A 352 10.261 -9.645 0.185 1.00 0.18 O ATOM 365 CB ASN A 352 10.893 -11.233 2.791 1.00 0.27 C ATOM 366 CG ASN A 352 11.588 -12.001 1.689 1.00 1.03 C ATOM 367 OD1 ASN A 352 10.957 -12.462 0.736 1.00 1.83 O ATOM 368 ND2 ASN A 352 12.891 -12.151 1.810 1.00 1.62 N ATOM 0 H ASN A 352 9.748 -9.586 4.312 1.00 0.19 H new ATOM 0 HA ASN A 352 11.823 -9.374 2.274 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.418 -11.403 3.731 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.882 -11.622 2.915 1.00 0.27 H new ATOM 0 HD21 ASN A 352 13.413 -12.664 1.100 1.00 1.62 H new ATOM 0 HD22 ASN A 352 13.378 -11.754 2.614 1.00 1.62 H new ATOM 375 N PHE A 353 8.692 -8.984 1.641 1.00 0.13 N ATOM 376 CA PHE A 353 7.721 -8.624 0.619 1.00 0.10 C ATOM 377 C PHE A 353 7.670 -7.111 0.427 1.00 0.08 C ATOM 378 O PHE A 353 7.353 -6.621 -0.655 1.00 0.07 O ATOM 379 CB PHE A 353 6.330 -9.123 1.009 1.00 0.09 C ATOM 380 CG PHE A 353 6.256 -10.599 1.269 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.923 -11.500 0.460 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.525 -11.081 2.335 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.860 -12.856 0.707 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.460 -12.434 2.594 1.00 0.17 C ATOM 385 CZ PHE A 353 6.129 -13.325 1.776 1.00 0.18 C ATOM 0 H PHE A 353 8.362 -8.847 2.597 1.00 0.13 H new ATOM 0 HA PHE A 353 8.031 -9.093 -0.315 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.003 -8.591 1.903 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.629 -8.870 0.213 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.501 -11.137 -0.377 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.997 -10.390 2.975 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.383 -13.548 0.064 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.887 -12.797 3.435 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.079 -14.385 1.974 1.00 0.18 H new ATOM 395 N ILE A 354 7.993 -6.381 1.479 1.00 0.08 N ATOM 396 CA ILE A 354 7.903 -4.927 1.479 1.00 0.07 C ATOM 397 C ILE A 354 8.629 -4.388 2.705 1.00 0.08 C ATOM 398 O ILE A 354 8.703 -5.064 3.724 1.00 0.10 O ATOM 399 CB ILE A 354 6.424 -4.481 1.495 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.271 -3.013 1.103 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.807 -4.733 2.864 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.830 -2.544 1.095 1.00 0.07 C ATOM 0 H ILE A 354 8.325 -6.776 2.359 1.00 0.08 H new ATOM 0 HA ILE A 354 8.368 -4.533 0.575 1.00 0.07 H new ATOM 0 HB ILE A 354 5.893 -5.077 0.752 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.843 -2.397 1.797 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.701 -2.861 0.113 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.765 -4.413 2.858 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.859 -5.797 3.096 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.355 -4.170 3.619 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.791 -1.493 0.808 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.259 -3.136 0.380 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.403 -2.665 2.090 1.00 0.07 H new ATOM 414 N ARG A 355 9.176 -3.192 2.614 1.00 0.09 N ATOM 415 CA ARG A 355 9.951 -2.646 3.723 1.00 0.11 C ATOM 416 C ARG A 355 10.062 -1.131 3.625 1.00 0.10 C ATOM 417 O ARG A 355 10.048 -0.572 2.532 1.00 0.14 O ATOM 418 CB ARG A 355 11.357 -3.254 3.727 1.00 0.16 C ATOM 419 CG ARG A 355 12.249 -2.687 2.634 1.00 0.22 C ATOM 420 CD ARG A 355 13.629 -3.311 2.640 1.00 0.25 C ATOM 421 NE ARG A 355 14.571 -2.532 1.838 1.00 0.98 N ATOM 422 CZ ARG A 355 15.676 -3.019 1.279 1.00 1.40 C ATOM 423 NH1 ARG A 355 15.995 -4.305 1.403 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.469 -2.211 0.588 1.00 2.08 N ATOM 0 H ARG A 355 9.103 -2.583 1.799 1.00 0.09 H new ATOM 0 HA ARG A 355 9.433 -2.898 4.649 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.822 -3.076 4.697 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.281 -4.334 3.603 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.781 -2.853 1.663 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.339 -1.609 2.764 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.993 -3.382 3.665 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.572 -4.328 2.251 1.00 0.25 H new ATOM 0 HE ARG A 355 14.366 -1.543 1.697 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.389 -4.932 1.932 1.00 1.43 H new ATOM 0 HH12 ARG A 355 16.845 -4.664 0.969 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.230 -1.224 0.488 1.00 2.08 H new ATOM 0 HH22 ARG A 355 17.318 -2.576 0.156 1.00 2.08 H new ATOM 438 N TRP A 356 10.156 -0.472 4.773 1.00 0.10 N ATOM 439 CA TRP A 356 10.455 0.951 4.810 1.00 0.09 C ATOM 440 C TRP A 356 11.871 1.207 4.318 1.00 0.09 C ATOM 441 O TRP A 356 12.817 0.530 4.725 1.00 0.14 O ATOM 442 CB TRP A 356 10.358 1.511 6.228 1.00 0.10 C ATOM 443 CG TRP A 356 8.977 1.705 6.773 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.482 1.171 7.924 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.925 2.510 6.219 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.196 1.603 8.131 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.832 2.420 7.097 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.799 3.297 5.069 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.637 3.086 6.866 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.609 3.958 4.839 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.541 3.852 5.735 1.00 0.13 C ATOM 0 H TRP A 356 10.029 -0.901 5.690 1.00 0.10 H new ATOM 0 HA TRP A 356 9.722 1.442 4.169 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.899 0.842 6.897 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.873 2.471 6.252 1.00 0.10 H new ATOM 0 HD1 TRP A 356 9.023 0.504 8.579 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.608 1.355 8.927 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.620 3.386 4.372 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.810 3.003 7.555 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.501 4.566 3.953 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.623 4.384 5.531 1.00 0.13 H new ATOM 462 N GLU A 357 12.002 2.181 3.448 1.00 0.10 N ATOM 463 CA GLU A 357 13.299 2.691 3.053 1.00 0.12 C ATOM 464 C GLU A 357 13.622 3.888 3.927 1.00 0.14 C ATOM 465 O GLU A 357 14.740 4.060 4.409 1.00 0.21 O ATOM 466 CB GLU A 357 13.276 3.098 1.592 1.00 0.16 C ATOM 467 CG GLU A 357 13.012 1.939 0.657 1.00 0.25 C ATOM 468 CD GLU A 357 14.192 1.005 0.520 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.301 0.070 1.341 1.00 0.61 O ATOM 470 OE2 GLU A 357 15.023 1.209 -0.385 1.00 0.78 O ATOM 0 H GLU A 357 11.215 2.643 2.993 1.00 0.10 H new ATOM 0 HA GLU A 357 14.060 1.921 3.178 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.508 3.858 1.445 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.231 3.555 1.333 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.152 1.377 1.020 1.00 0.25 H new ATOM 0 HG3 GLU A 357 12.748 2.327 -0.327 1.00 0.25 H new ATOM 477 N ASP A 358 12.595 4.698 4.129 1.00 0.14 N ATOM 478 CA ASP A 358 12.650 5.861 5.000 1.00 0.16 C ATOM 479 C ASP A 358 11.306 6.025 5.678 1.00 0.16 C ATOM 480 O ASP A 358 10.423 6.705 5.159 1.00 0.20 O ATOM 481 CB ASP A 358 12.971 7.131 4.207 1.00 0.20 C ATOM 482 CG ASP A 358 14.416 7.215 3.766 1.00 0.92 C ATOM 483 OD1 ASP A 358 14.740 6.690 2.681 1.00 1.33 O ATOM 484 OD2 ASP A 358 15.239 7.784 4.511 1.00 1.46 O ATOM 0 H ASP A 358 11.686 4.564 3.686 1.00 0.14 H new ATOM 0 HA ASP A 358 13.438 5.709 5.737 1.00 0.16 H new ATOM 0 HB2 ASP A 358 12.328 7.174 3.328 1.00 0.20 H new ATOM 0 HB3 ASP A 358 12.734 8.002 4.818 1.00 0.20 H new ATOM 489 N LYS A 359 11.146 5.384 6.824 1.00 0.15 N ATOM 490 CA LYS A 359 9.875 5.377 7.536 1.00 0.17 C ATOM 491 C LYS A 359 9.379 6.783 7.832 1.00 0.19 C ATOM 492 O LYS A 359 8.199 7.091 7.649 1.00 0.23 O ATOM 493 CB LYS A 359 10.002 4.606 8.844 1.00 0.23 C ATOM 494 CG LYS A 359 8.705 4.559 9.635 1.00 0.29 C ATOM 495 CD LYS A 359 8.758 3.541 10.759 1.00 0.38 C ATOM 496 CE LYS A 359 7.416 3.428 11.460 1.00 0.91 C ATOM 497 NZ LYS A 359 7.498 2.606 12.694 1.00 1.50 N ATOM 0 H LYS A 359 11.887 4.857 7.286 1.00 0.15 H new ATOM 0 HA LYS A 359 9.150 4.889 6.885 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.327 3.588 8.629 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.778 5.066 9.456 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.498 5.546 10.050 1.00 0.29 H new ATOM 0 HG3 LYS A 359 7.881 4.316 8.965 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.046 2.569 10.359 1.00 0.38 H new ATOM 0 HD3 LYS A 359 9.524 3.829 11.479 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.054 4.425 11.712 1.00 0.91 H new ATOM 0 HE3 LYS A 359 6.688 2.987 10.779 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 6.560 2.555 13.140 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 7.818 1.647 12.451 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 8.173 3.039 13.356 1.00 1.50 H new ATOM 511 N GLU A 360 10.278 7.633 8.282 1.00 0.21 N ATOM 512 CA GLU A 360 9.906 8.978 8.682 1.00 0.27 C ATOM 513 C GLU A 360 9.679 9.896 7.488 1.00 0.24 C ATOM 514 O GLU A 360 9.150 10.997 7.634 1.00 0.37 O ATOM 515 CB GLU A 360 10.941 9.546 9.630 1.00 0.41 C ATOM 516 CG GLU A 360 10.945 8.810 10.953 1.00 0.63 C ATOM 517 CD GLU A 360 9.660 9.019 11.726 1.00 1.75 C ATOM 518 OE1 GLU A 360 8.620 8.449 11.333 1.00 2.67 O ATOM 519 OE2 GLU A 360 9.681 9.758 12.731 1.00 1.97 O ATOM 0 H GLU A 360 11.270 7.419 8.381 1.00 0.21 H new ATOM 0 HA GLU A 360 8.952 8.916 9.205 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.929 9.481 9.173 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.738 10.603 9.801 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.090 7.745 10.774 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.788 9.150 11.554 1.00 0.63 H new ATOM 526 N SER A 361 10.073 9.443 6.308 1.00 0.19 N ATOM 527 CA SER A 361 9.759 10.157 5.083 1.00 0.21 C ATOM 528 C SER A 361 8.639 9.423 4.345 1.00 0.19 C ATOM 529 O SER A 361 8.202 9.829 3.267 1.00 0.24 O ATOM 530 CB SER A 361 11.007 10.267 4.206 1.00 0.26 C ATOM 531 OG SER A 361 12.108 10.771 4.950 1.00 0.31 O ATOM 0 H SER A 361 10.610 8.586 6.174 1.00 0.19 H new ATOM 0 HA SER A 361 9.423 11.166 5.321 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.257 9.288 3.798 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.805 10.923 3.359 1.00 0.26 H new ATOM 0 HG SER A 361 12.895 10.831 4.369 1.00 0.31 H new ATOM 537 N LYS A 362 8.183 8.336 4.975 1.00 0.15 N ATOM 538 CA LYS A 362 7.127 7.477 4.448 1.00 0.14 C ATOM 539 C LYS A 362 7.506 6.896 3.092 1.00 0.12 C ATOM 540 O LYS A 362 6.701 6.845 2.169 1.00 0.15 O ATOM 541 CB LYS A 362 5.800 8.224 4.385 1.00 0.20 C ATOM 542 CG LYS A 362 5.280 8.599 5.759 1.00 0.48 C ATOM 543 CD LYS A 362 5.118 7.374 6.646 1.00 0.48 C ATOM 544 CE LYS A 362 4.868 7.764 8.092 1.00 0.51 C ATOM 545 NZ LYS A 362 5.997 8.557 8.653 1.00 1.23 N ATOM 0 H LYS A 362 8.544 8.027 5.877 1.00 0.15 H new ATOM 0 HA LYS A 362 7.005 6.639 5.134 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.923 9.127 3.787 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.061 7.604 3.877 1.00 0.20 H new ATOM 0 HG2 LYS A 362 5.967 9.302 6.230 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.321 9.108 5.660 1.00 0.48 H new ATOM 0 HD2 LYS A 362 4.288 6.768 6.283 1.00 0.48 H new ATOM 0 HD3 LYS A 362 6.015 6.757 6.584 1.00 0.48 H new ATOM 0 HE2 LYS A 362 3.948 8.344 8.158 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.722 6.865 8.691 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.966 8.518 9.692 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 6.899 8.162 8.318 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 5.915 9.546 8.341 1.00 1.23 H new ATOM 559 N ILE A 363 8.745 6.454 2.997 1.00 0.09 N ATOM 560 CA ILE A 363 9.256 5.832 1.797 1.00 0.09 C ATOM 561 C ILE A 363 9.437 4.344 2.030 1.00 0.08 C ATOM 562 O ILE A 363 10.030 3.946 3.031 1.00 0.10 O ATOM 563 CB ILE A 363 10.609 6.443 1.406 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.452 7.936 1.123 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.181 5.719 0.199 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.757 8.695 1.137 1.00 0.46 C ATOM 0 H ILE A 363 9.426 6.518 3.754 1.00 0.09 H new ATOM 0 HA ILE A 363 8.541 6.000 0.991 1.00 0.09 H new ATOM 0 HB ILE A 363 11.305 6.325 2.237 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.977 8.065 0.150 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.781 8.369 1.865 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.141 6.161 -0.069 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.321 4.665 0.440 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.492 5.811 -0.641 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.568 9.748 0.928 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.224 8.597 2.117 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.423 8.288 0.376 1.00 0.46 H new ATOM 578 N PHE A 364 8.942 3.529 1.119 1.00 0.09 N ATOM 579 CA PHE A 364 9.031 2.090 1.275 1.00 0.09 C ATOM 580 C PHE A 364 9.353 1.429 -0.061 1.00 0.10 C ATOM 581 O PHE A 364 9.033 1.956 -1.129 1.00 0.13 O ATOM 582 CB PHE A 364 7.727 1.520 1.850 1.00 0.09 C ATOM 583 CG PHE A 364 6.575 1.535 0.901 1.00 0.08 C ATOM 584 CD1 PHE A 364 5.793 2.656 0.773 1.00 0.13 C ATOM 585 CD2 PHE A 364 6.281 0.422 0.140 1.00 0.12 C ATOM 586 CE1 PHE A 364 4.722 2.674 -0.102 1.00 0.14 C ATOM 587 CE2 PHE A 364 5.218 0.424 -0.736 1.00 0.12 C ATOM 588 CZ PHE A 364 4.435 1.550 -0.859 1.00 0.08 C ATOM 0 H PHE A 364 8.476 3.837 0.266 1.00 0.09 H new ATOM 0 HA PHE A 364 9.837 1.874 1.976 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.904 0.493 2.171 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.457 2.090 2.739 1.00 0.09 H new ATOM 0 HD1 PHE A 364 6.016 3.533 1.362 1.00 0.13 H new ATOM 0 HD2 PHE A 364 6.893 -0.463 0.233 1.00 0.12 H new ATOM 0 HE1 PHE A 364 4.112 3.561 -0.195 1.00 0.14 H new ATOM 0 HE2 PHE A 364 4.999 -0.455 -1.324 1.00 0.12 H new ATOM 0 HZ PHE A 364 3.600 1.557 -1.544 1.00 0.08 H new ATOM 598 N ARG A 365 10.012 0.294 0.019 1.00 0.10 N ATOM 599 CA ARG A 365 10.313 -0.527 -1.129 1.00 0.12 C ATOM 600 C ARG A 365 9.431 -1.763 -1.102 1.00 0.11 C ATOM 601 O ARG A 365 9.275 -2.379 -0.048 1.00 0.18 O ATOM 602 CB ARG A 365 11.768 -0.974 -1.044 1.00 0.17 C ATOM 603 CG ARG A 365 12.249 -1.741 -2.252 1.00 0.17 C ATOM 604 CD ARG A 365 12.854 -0.804 -3.265 1.00 0.31 C ATOM 605 NE ARG A 365 14.060 -0.160 -2.728 1.00 0.77 N ATOM 606 CZ ARG A 365 15.305 -0.351 -3.170 1.00 0.63 C ATOM 607 NH1 ARG A 365 15.559 -1.177 -4.174 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.304 0.283 -2.580 1.00 0.99 N ATOM 0 H ARG A 365 10.359 -0.089 0.899 1.00 0.10 H new ATOM 0 HA ARG A 365 10.139 0.040 -2.044 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.399 -0.096 -0.910 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.895 -1.596 -0.158 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.987 -2.484 -1.949 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.417 -2.283 -2.701 1.00 0.17 H new ATOM 0 HD2 ARG A 365 13.104 -1.355 -4.172 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.125 -0.044 -3.544 1.00 0.31 H new ATOM 0 HE ARG A 365 13.935 0.489 -1.951 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.796 -1.682 -4.625 1.00 1.48 H new ATOM 0 HH12 ARG A 365 16.518 -1.308 -4.496 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.119 0.909 -1.797 1.00 0.99 H new ATOM 0 HH22 ARG A 365 17.260 0.146 -2.908 1.00 0.99 H new ATOM 622 N ILE A 366 8.851 -2.139 -2.228 1.00 0.07 N ATOM 623 CA ILE A 366 8.199 -3.415 -2.301 1.00 0.06 C ATOM 624 C ILE A 366 9.243 -4.448 -2.648 1.00 0.07 C ATOM 625 O ILE A 366 9.775 -4.487 -3.754 1.00 0.10 O ATOM 626 CB ILE A 366 7.027 -3.415 -3.295 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.860 -2.635 -2.679 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.614 -4.843 -3.646 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.774 -2.301 -3.656 1.00 0.09 C ATOM 0 H ILE A 366 8.822 -1.585 -3.084 1.00 0.07 H new ATOM 0 HA ILE A 366 7.751 -3.654 -1.337 1.00 0.06 H new ATOM 0 HB ILE A 366 7.332 -2.932 -4.223 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.435 -3.219 -1.863 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.242 -1.711 -2.244 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.783 -4.819 -4.351 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.458 -5.365 -4.098 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.306 -5.366 -2.740 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.984 -1.750 -3.147 1.00 0.09 H new ATOM 0 HD12 ILE A 366 5.183 -1.689 -4.460 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.364 -3.221 -4.073 1.00 0.09 H new ATOM 641 N VAL A 367 9.564 -5.240 -1.662 1.00 0.07 N ATOM 642 CA VAL A 367 10.695 -6.138 -1.737 1.00 0.08 C ATOM 643 C VAL A 367 10.347 -7.375 -2.549 1.00 0.09 C ATOM 644 O VAL A 367 11.116 -7.814 -3.409 1.00 0.12 O ATOM 645 CB VAL A 367 11.157 -6.512 -0.323 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.290 -7.510 -0.378 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.573 -5.260 0.436 1.00 0.10 C ATOM 0 H VAL A 367 9.052 -5.285 -0.781 1.00 0.07 H new ATOM 0 HA VAL A 367 11.516 -5.633 -2.245 1.00 0.08 H new ATOM 0 HB VAL A 367 10.326 -6.979 0.206 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.603 -7.762 0.635 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.955 -8.413 -0.889 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.131 -7.077 -0.920 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.900 -5.534 1.439 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.392 -4.770 -0.091 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.726 -4.578 0.504 1.00 0.10 H new ATOM 657 N ASP A 368 9.175 -7.917 -2.288 1.00 0.08 N ATOM 658 CA ASP A 368 8.640 -9.004 -3.079 1.00 0.09 C ATOM 659 C ASP A 368 7.150 -8.816 -3.259 1.00 0.08 C ATOM 660 O ASP A 368 6.343 -9.234 -2.432 1.00 0.09 O ATOM 661 CB ASP A 368 8.936 -10.356 -2.455 1.00 0.12 C ATOM 662 CG ASP A 368 8.513 -11.500 -3.353 1.00 0.22 C ATOM 663 OD1 ASP A 368 9.078 -11.646 -4.454 1.00 0.78 O ATOM 664 OD2 ASP A 368 7.622 -12.276 -2.948 1.00 0.45 O ATOM 0 H ASP A 368 8.569 -7.617 -1.524 1.00 0.08 H new ATOM 0 HA ASP A 368 9.128 -8.987 -4.053 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.003 -10.434 -2.247 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.419 -10.435 -1.499 1.00 0.12 H new ATOM 669 N PRO A 369 6.791 -8.153 -4.351 1.00 0.09 N ATOM 670 CA PRO A 369 5.411 -7.789 -4.671 1.00 0.10 C ATOM 671 C PRO A 369 4.502 -8.999 -4.789 1.00 0.12 C ATOM 672 O PRO A 369 3.323 -8.931 -4.457 1.00 0.14 O ATOM 673 CB PRO A 369 5.541 -7.074 -6.018 1.00 0.12 C ATOM 674 CG PRO A 369 6.848 -7.509 -6.561 1.00 0.12 C ATOM 675 CD PRO A 369 7.728 -7.708 -5.379 1.00 0.10 C ATOM 0 HA PRO A 369 4.957 -7.178 -3.891 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.726 -7.345 -6.689 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.506 -5.992 -5.895 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.747 -8.431 -7.134 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.261 -6.759 -7.235 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.501 -8.452 -5.571 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.236 -6.787 -5.093 1.00 0.10 H new ATOM 683 N ASN A 370 5.059 -10.105 -5.256 1.00 0.13 N ATOM 684 CA ASN A 370 4.321 -11.353 -5.349 1.00 0.17 C ATOM 685 C ASN A 370 3.885 -11.782 -3.964 1.00 0.17 C ATOM 686 O ASN A 370 2.720 -12.109 -3.729 1.00 0.21 O ATOM 687 CB ASN A 370 5.213 -12.434 -5.942 1.00 0.21 C ATOM 688 CG ASN A 370 4.438 -13.619 -6.510 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.898 -14.285 -7.439 1.00 0.62 O ATOM 690 ND2 ASN A 370 3.261 -13.897 -5.961 1.00 0.59 N ATOM 0 H ASN A 370 6.025 -10.163 -5.578 1.00 0.13 H new ATOM 0 HA ASN A 370 3.449 -11.207 -5.986 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.824 -11.997 -6.732 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.897 -12.792 -5.172 1.00 0.21 H new ATOM 0 HD21 ASN A 370 2.709 -14.682 -6.307 1.00 0.59 H new ATOM 0 HD22 ASN A 370 2.909 -13.326 -5.193 1.00 0.59 H new ATOM 697 N GLY A 371 4.849 -11.778 -3.059 1.00 0.16 N ATOM 698 CA GLY A 371 4.590 -12.121 -1.682 1.00 0.19 C ATOM 699 C GLY A 371 3.665 -11.129 -1.023 1.00 0.13 C ATOM 700 O GLY A 371 2.843 -11.488 -0.182 1.00 0.13 O ATOM 0 H GLY A 371 5.820 -11.539 -3.260 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.150 -13.117 -1.632 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.531 -12.160 -1.134 1.00 0.19 H new ATOM 704 N LEU A 372 3.785 -9.881 -1.438 1.00 0.10 N ATOM 705 CA LEU A 372 3.076 -8.787 -0.801 1.00 0.08 C ATOM 706 C LEU A 372 1.615 -8.814 -1.218 1.00 0.11 C ATOM 707 O LEU A 372 0.710 -8.610 -0.414 1.00 0.13 O ATOM 708 CB LEU A 372 3.726 -7.456 -1.195 1.00 0.08 C ATOM 709 CG LEU A 372 3.570 -6.317 -0.185 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.148 -5.784 -0.156 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.961 -6.800 1.199 1.00 0.09 C ATOM 0 H LEU A 372 4.373 -9.598 -2.222 1.00 0.10 H new ATOM 0 HA LEU A 372 3.130 -8.895 0.282 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.790 -7.627 -1.361 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.303 -7.134 -2.147 1.00 0.08 H new ATOM 0 HG LEU A 372 4.228 -5.505 -0.495 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.077 -4.977 0.573 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.881 -5.406 -1.143 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.464 -6.586 0.123 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.848 -5.985 1.914 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.317 -7.630 1.490 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.999 -7.132 1.189 1.00 0.09 H new ATOM 723 N ALA A 373 1.403 -9.086 -2.488 1.00 0.12 N ATOM 724 CA ALA A 373 0.073 -9.136 -3.055 1.00 0.15 C ATOM 725 C ALA A 373 -0.705 -10.321 -2.515 1.00 0.14 C ATOM 726 O ALA A 373 -1.925 -10.262 -2.368 1.00 0.16 O ATOM 727 CB ALA A 373 0.181 -9.225 -4.550 1.00 0.20 C ATOM 0 H ALA A 373 2.149 -9.279 -3.157 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.465 -8.230 -2.776 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.818 -9.263 -4.985 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.709 -8.350 -4.929 1.00 0.20 H new ATOM 0 HB3 ALA A 373 0.730 -10.126 -4.822 1.00 0.20 H new ATOM 733 N ARG A 374 0.005 -11.401 -2.225 1.00 0.14 N ATOM 734 CA ARG A 374 -0.610 -12.565 -1.622 1.00 0.17 C ATOM 735 C ARG A 374 -1.093 -12.208 -0.219 1.00 0.14 C ATOM 736 O ARG A 374 -2.113 -12.709 0.240 1.00 0.16 O ATOM 737 CB ARG A 374 0.371 -13.738 -1.608 1.00 0.24 C ATOM 738 CG ARG A 374 0.879 -14.102 -0.240 1.00 0.28 C ATOM 739 CD ARG A 374 1.794 -15.305 -0.295 1.00 0.47 C ATOM 740 NE ARG A 374 2.182 -15.740 1.036 1.00 1.44 N ATOM 741 CZ ARG A 374 3.364 -16.283 1.323 1.00 2.04 C ATOM 742 NH1 ARG A 374 4.278 -16.425 0.371 1.00 2.01 N ATOM 743 NH2 ARG A 374 3.632 -16.669 2.564 1.00 3.03 N ATOM 0 H ARG A 374 1.006 -11.492 -2.399 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.473 -12.876 -2.211 1.00 0.17 H new ATOM 0 HB2 ARG A 374 -0.116 -14.609 -2.046 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.221 -13.494 -2.245 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.414 -13.255 0.189 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.037 -14.313 0.419 1.00 0.28 H new ATOM 0 HD2 ARG A 374 1.292 -16.122 -0.814 1.00 0.47 H new ATOM 0 HD3 ARG A 374 2.685 -15.060 -0.873 1.00 0.47 H new ATOM 0 HE ARG A 374 1.510 -15.623 1.795 1.00 1.44 H new ATOM 0 HH11 ARG A 374 4.075 -16.118 -0.580 1.00 2.01 H new ATOM 0 HH12 ARG A 374 5.183 -16.841 0.591 1.00 2.01 H new ATOM 0 HH21 ARG A 374 2.933 -16.550 3.297 1.00 3.03 H new ATOM 0 HH22 ARG A 374 4.537 -17.085 2.785 1.00 3.03 H new ATOM 757 N LEU A 375 -0.363 -11.313 0.439 1.00 0.13 N ATOM 758 CA LEU A 375 -0.793 -10.754 1.719 1.00 0.15 C ATOM 759 C LEU A 375 -2.062 -9.949 1.507 1.00 0.16 C ATOM 760 O LEU A 375 -3.036 -10.087 2.243 1.00 0.18 O ATOM 761 CB LEU A 375 0.279 -9.819 2.281 1.00 0.17 C ATOM 762 CG LEU A 375 1.354 -10.417 3.183 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.749 -11.811 2.758 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.566 -9.507 3.154 1.00 0.15 C ATOM 0 H LEU A 375 0.533 -10.957 0.106 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.964 -11.573 2.418 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.779 -9.341 1.439 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.226 -9.032 2.841 1.00 0.17 H new ATOM 0 HG LEU A 375 0.951 -10.495 4.193 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.517 -12.193 3.431 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.877 -12.464 2.795 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.139 -11.784 1.741 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.346 -9.919 3.794 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.938 -9.429 2.133 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.286 -8.517 3.514 1.00 0.15 H new ATOM 776 N TRP A 376 -2.022 -9.102 0.484 1.00 0.16 N ATOM 777 CA TRP A 376 -3.151 -8.262 0.118 1.00 0.18 C ATOM 778 C TRP A 376 -4.391 -9.119 -0.107 1.00 0.20 C ATOM 779 O TRP A 376 -5.467 -8.829 0.416 1.00 0.25 O ATOM 780 CB TRP A 376 -2.805 -7.461 -1.142 1.00 0.19 C ATOM 781 CG TRP A 376 -3.831 -6.440 -1.519 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.259 -6.139 -2.780 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.556 -5.582 -0.634 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.209 -5.150 -2.730 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.408 -4.792 -1.426 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.570 -5.404 0.752 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.265 -3.848 -0.881 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.417 -4.460 1.290 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.255 -3.696 0.473 1.00 0.24 C ATOM 0 H TRP A 376 -1.204 -8.980 -0.114 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.364 -7.565 0.929 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.849 -6.960 -0.990 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.674 -8.153 -1.974 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.902 -6.610 -3.684 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.689 -4.747 -3.535 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.929 -5.995 1.389 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.916 -3.255 -1.506 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.434 -4.308 2.359 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.911 -2.967 0.926 1.00 0.24 H new ATOM 800 N GLY A 377 -4.226 -10.186 -0.876 1.00 0.21 N ATOM 801 CA GLY A 377 -5.308 -11.115 -1.086 1.00 0.27 C ATOM 802 C GLY A 377 -5.724 -11.797 0.200 1.00 0.30 C ATOM 803 O GLY A 377 -6.906 -11.930 0.472 1.00 0.38 O ATOM 0 H GLY A 377 -3.358 -10.422 -1.358 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.162 -10.587 -1.510 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -5.005 -11.867 -1.814 1.00 0.27 H new ATOM 807 N ASN A 378 -4.745 -12.212 0.991 1.00 0.27 N ATOM 808 CA ASN A 378 -4.994 -12.846 2.287 1.00 0.30 C ATOM 809 C ASN A 378 -5.856 -11.960 3.188 1.00 0.30 C ATOM 810 O ASN A 378 -6.780 -12.435 3.853 1.00 0.35 O ATOM 811 CB ASN A 378 -3.666 -13.161 2.973 1.00 0.32 C ATOM 812 CG ASN A 378 -3.250 -14.608 2.813 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.636 -15.473 3.595 1.00 0.76 O ATOM 814 ND2 ASN A 378 -2.433 -14.864 1.812 1.00 0.42 N ATOM 0 H ASN A 378 -3.756 -12.121 0.757 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.541 -13.772 2.111 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.889 -12.517 2.562 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.746 -12.926 4.034 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -2.094 -15.814 1.661 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -2.140 -14.112 1.188 1.00 0.42 H new ATOM 821 N HIS A 379 -5.545 -10.670 3.189 1.00 0.28 N ATOM 822 CA HIS A 379 -6.272 -9.681 3.984 1.00 0.30 C ATOM 823 C HIS A 379 -7.720 -9.542 3.510 1.00 0.32 C ATOM 824 O HIS A 379 -8.638 -9.394 4.319 1.00 0.38 O ATOM 825 CB HIS A 379 -5.542 -8.331 3.892 1.00 0.28 C ATOM 826 CG HIS A 379 -6.249 -7.172 4.533 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.065 -6.854 5.855 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.081 -6.264 3.972 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.780 -5.762 6.064 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.414 -5.367 4.952 1.00 0.38 N ATOM 0 H HIS A 379 -4.781 -10.277 2.639 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.301 -10.013 5.022 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.560 -8.436 4.353 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.377 -8.097 2.840 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.418 -6.249 2.946 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -6.845 -5.252 7.014 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -8.025 -4.556 4.854 1.00 0.38 H new ATOM 838 N LYS A 380 -7.918 -9.600 2.202 1.00 0.32 N ATOM 839 CA LYS A 380 -9.244 -9.420 1.622 1.00 0.36 C ATOM 840 C LYS A 380 -9.933 -10.762 1.384 1.00 0.41 C ATOM 841 O LYS A 380 -11.057 -10.815 0.890 1.00 0.45 O ATOM 842 CB LYS A 380 -9.133 -8.646 0.307 1.00 0.36 C ATOM 843 CG LYS A 380 -8.592 -7.236 0.475 1.00 0.38 C ATOM 844 CD LYS A 380 -7.689 -6.856 -0.682 1.00 0.63 C ATOM 845 CE LYS A 380 -8.429 -6.806 -2.003 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.925 -5.436 -2.335 1.00 0.77 N ATOM 0 H LYS A 380 -7.179 -9.770 1.520 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.850 -8.853 2.328 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.485 -9.196 -0.375 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -10.117 -8.596 -0.159 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.421 -6.531 0.540 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -8.038 -7.165 1.411 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -7.240 -5.883 -0.484 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -6.873 -7.575 -0.753 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.768 -7.151 -2.798 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.273 -7.495 -1.968 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.653 -5.500 -3.075 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.334 -4.999 -1.484 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -8.134 -4.854 -2.677 1.00 0.77 H new ATOM 860 N ASN A 381 -9.238 -11.837 1.747 1.00 0.44 N ATOM 861 CA ASN A 381 -9.716 -13.208 1.556 1.00 0.52 C ATOM 862 C ASN A 381 -9.911 -13.524 0.067 1.00 0.53 C ATOM 863 O ASN A 381 -10.877 -14.178 -0.333 1.00 0.60 O ATOM 864 CB ASN A 381 -11.011 -13.449 2.342 1.00 0.58 C ATOM 865 CG ASN A 381 -11.404 -14.915 2.391 1.00 1.20 C ATOM 866 OD1 ASN A 381 -10.550 -15.802 2.379 1.00 1.87 O ATOM 867 ND2 ASN A 381 -12.699 -15.183 2.449 1.00 2.01 N ATOM 0 H ASN A 381 -8.319 -11.783 2.186 1.00 0.44 H new ATOM 0 HA ASN A 381 -8.954 -13.885 1.943 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -10.888 -13.076 3.359 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.819 -12.876 1.887 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -13.018 -16.151 2.486 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -13.378 -14.421 2.457 1.00 2.01 H new ATOM 874 N ARG A 382 -8.982 -13.057 -0.758 1.00 0.50 N ATOM 875 CA ARG A 382 -9.023 -13.331 -2.189 1.00 0.55 C ATOM 876 C ARG A 382 -7.774 -14.089 -2.597 1.00 0.68 C ATOM 877 O ARG A 382 -6.660 -13.719 -2.222 1.00 0.78 O ATOM 878 CB ARG A 382 -9.086 -12.042 -3.008 1.00 0.49 C ATOM 879 CG ARG A 382 -9.967 -10.967 -2.412 1.00 0.48 C ATOM 880 CD ARG A 382 -11.438 -11.329 -2.467 1.00 0.57 C ATOM 881 NE ARG A 382 -12.260 -10.247 -1.931 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.433 -10.416 -1.328 1.00 1.11 C ATOM 883 NH1 ARG A 382 -13.987 -11.622 -1.253 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.066 -9.370 -0.809 1.00 1.27 N ATOM 0 H ARG A 382 -8.191 -12.486 -0.460 1.00 0.50 H new ATOM 0 HA ARG A 382 -9.920 -13.919 -2.385 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -8.076 -11.647 -3.120 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.448 -12.279 -4.008 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.676 -10.796 -1.375 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.806 -10.031 -2.947 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.728 -11.535 -3.497 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.614 -12.242 -1.897 1.00 0.57 H new ATOM 0 HE ARG A 382 -11.909 -9.294 -2.026 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -13.512 -12.428 -1.660 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -14.887 -11.742 -0.788 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -13.652 -8.440 -0.874 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -14.966 -9.497 -0.346 1.00 1.27 H new ATOM 898 N THR A 383 -7.954 -15.137 -3.372 1.00 0.76 N ATOM 899 CA THR A 383 -6.832 -15.917 -3.847 1.00 0.95 C ATOM 900 C THR A 383 -6.219 -15.271 -5.088 1.00 0.94 C ATOM 901 O THR A 383 -4.995 -15.195 -5.228 1.00 1.22 O ATOM 902 CB THR A 383 -7.262 -17.360 -4.166 1.00 1.17 C ATOM 903 OG1 THR A 383 -7.824 -17.976 -2.997 1.00 1.24 O ATOM 904 CG2 THR A 383 -6.085 -18.181 -4.662 1.00 1.37 C ATOM 0 H THR A 383 -8.866 -15.468 -3.686 1.00 0.76 H new ATOM 0 HA THR A 383 -6.083 -15.945 -3.055 1.00 0.95 H new ATOM 0 HB THR A 383 -8.014 -17.324 -4.954 1.00 1.17 H new ATOM 0 HG1 THR A 383 -8.096 -18.893 -3.209 1.00 1.24 H new ATOM 0 HG21 THR A 383 -6.416 -19.196 -4.880 1.00 1.37 H new ATOM 0 HG22 THR A 383 -5.682 -17.728 -5.568 1.00 1.37 H new ATOM 0 HG23 THR A 383 -5.311 -18.209 -3.895 1.00 1.37 H new ATOM 912 N ASN A 384 -7.080 -14.778 -5.968 1.00 0.84 N ATOM 913 CA ASN A 384 -6.644 -14.169 -7.224 1.00 0.81 C ATOM 914 C ASN A 384 -6.304 -12.700 -7.032 1.00 0.64 C ATOM 915 O ASN A 384 -6.762 -11.831 -7.778 1.00 0.77 O ATOM 916 CB ASN A 384 -7.740 -14.286 -8.270 1.00 0.89 C ATOM 917 CG ASN A 384 -7.232 -14.095 -9.690 1.00 1.40 C ATOM 918 OD1 ASN A 384 -7.282 -12.994 -10.246 1.00 2.21 O ATOM 919 ND2 ASN A 384 -6.725 -15.163 -10.283 1.00 1.70 N ATOM 0 H ASN A 384 -8.091 -14.787 -5.837 1.00 0.84 H new ATOM 0 HA ASN A 384 -5.752 -14.699 -7.557 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -8.210 -15.266 -8.187 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.512 -13.544 -8.064 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -6.358 -15.093 -11.232 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -6.701 -16.056 -9.791 1.00 1.70 H new ATOM 926 N MET A 385 -5.522 -12.412 -6.025 1.00 0.55 N ATOM 927 CA MET A 385 -5.075 -11.058 -5.808 1.00 0.42 C ATOM 928 C MET A 385 -3.606 -10.970 -6.149 1.00 0.53 C ATOM 929 O MET A 385 -2.757 -11.518 -5.445 1.00 0.94 O ATOM 930 CB MET A 385 -5.335 -10.618 -4.374 1.00 0.47 C ATOM 931 CG MET A 385 -4.983 -9.164 -4.120 1.00 0.92 C ATOM 932 SD MET A 385 -6.011 -8.035 -5.075 1.00 2.54 S ATOM 933 CE MET A 385 -7.653 -8.652 -4.708 1.00 3.18 C ATOM 0 H MET A 385 -5.182 -13.091 -5.344 1.00 0.55 H new ATOM 0 HA MET A 385 -5.636 -10.383 -6.454 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.387 -10.777 -4.138 1.00 0.47 H new ATOM 0 HB3 MET A 385 -4.758 -11.248 -3.697 1.00 0.47 H new ATOM 0 HG2 MET A 385 -5.096 -8.945 -3.058 1.00 0.92 H new ATOM 0 HG3 MET A 385 -3.935 -8.997 -4.370 1.00 0.92 H new ATOM 0 HE1 MET A 385 -8.368 -7.830 -4.748 1.00 3.18 H new ATOM 0 HE2 MET A 385 -7.930 -9.409 -5.442 1.00 3.18 H new ATOM 0 HE3 MET A 385 -7.662 -9.093 -3.711 1.00 3.18 H new ATOM 943 N THR A 386 -3.313 -10.308 -7.249 1.00 0.23 N ATOM 944 CA THR A 386 -1.966 -10.274 -7.759 1.00 0.24 C ATOM 945 C THR A 386 -1.347 -8.916 -7.508 1.00 0.16 C ATOM 946 O THR A 386 -2.029 -7.998 -7.040 1.00 0.18 O ATOM 947 CB THR A 386 -1.931 -10.605 -9.265 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.540 -9.555 -10.026 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.664 -11.907 -9.540 1.00 0.44 C ATOM 0 H THR A 386 -3.992 -9.788 -7.804 1.00 0.23 H new ATOM 0 HA THR A 386 -1.387 -11.033 -7.233 1.00 0.24 H new ATOM 0 HB THR A 386 -0.887 -10.707 -9.562 1.00 0.33 H new ATOM 0 HG1 THR A 386 -2.754 -9.884 -10.924 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.630 -12.125 -10.607 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.187 -12.717 -8.988 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.702 -11.814 -9.222 1.00 0.44 H new ATOM 957 N TYR A 387 -0.070 -8.768 -7.812 1.00 0.16 N ATOM 958 CA TYR A 387 0.571 -7.478 -7.646 1.00 0.13 C ATOM 959 C TYR A 387 -0.004 -6.505 -8.658 1.00 0.14 C ATOM 960 O TYR A 387 -0.037 -5.299 -8.426 1.00 0.17 O ATOM 961 CB TYR A 387 2.085 -7.550 -7.790 1.00 0.15 C ATOM 962 CG TYR A 387 2.698 -6.195 -7.569 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.607 -5.591 -6.323 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.310 -5.495 -8.600 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.113 -4.337 -6.108 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.817 -4.227 -8.392 1.00 0.14 C ATOM 967 CZ TYR A 387 3.715 -3.652 -7.142 1.00 0.12 C ATOM 968 OH TYR A 387 4.213 -2.387 -6.929 1.00 0.13 O ATOM 0 H TYR A 387 0.533 -9.510 -8.168 1.00 0.16 H new ATOM 0 HA TYR A 387 0.370 -7.136 -6.631 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.492 -8.262 -7.071 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.345 -7.916 -8.783 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.130 -6.118 -5.510 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.391 -5.948 -9.577 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.041 -3.885 -5.130 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.289 -3.690 -9.201 1.00 0.14 H new ATOM 0 HH TYR A 387 4.605 -2.046 -7.760 1.00 0.13 H new ATOM 978 N GLU A 388 -0.477 -7.045 -9.773 1.00 0.17 N ATOM 979 CA GLU A 388 -1.182 -6.250 -10.763 1.00 0.24 C ATOM 980 C GLU A 388 -2.360 -5.550 -10.098 1.00 0.25 C ATOM 981 O GLU A 388 -2.545 -4.345 -10.254 1.00 0.31 O ATOM 982 CB GLU A 388 -1.676 -7.136 -11.902 1.00 0.30 C ATOM 983 CG GLU A 388 -2.392 -6.381 -13.003 1.00 0.44 C ATOM 984 CD GLU A 388 -3.006 -7.309 -14.028 1.00 1.53 C ATOM 985 OE1 GLU A 388 -2.272 -8.138 -14.606 1.00 1.96 O ATOM 986 OE2 GLU A 388 -4.231 -7.230 -14.252 1.00 2.21 O ATOM 0 H GLU A 388 -0.384 -8.032 -10.013 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.501 -5.506 -11.176 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.826 -7.665 -12.332 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.349 -7.891 -11.496 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -3.173 -5.758 -12.566 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -1.689 -5.711 -13.498 1.00 0.44 H new ATOM 993 N LYS A 389 -3.134 -6.318 -9.329 1.00 0.23 N ATOM 994 CA LYS A 389 -4.265 -5.770 -8.590 1.00 0.28 C ATOM 995 C LYS A 389 -3.811 -4.709 -7.588 1.00 0.28 C ATOM 996 O LYS A 389 -4.416 -3.640 -7.486 1.00 0.40 O ATOM 997 CB LYS A 389 -5.027 -6.877 -7.861 1.00 0.32 C ATOM 998 CG LYS A 389 -5.995 -7.663 -8.738 1.00 0.45 C ATOM 999 CD LYS A 389 -5.286 -8.560 -9.738 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.277 -9.277 -10.647 1.00 0.46 C ATOM 1001 NZ LYS A 389 -7.284 -10.064 -9.882 1.00 1.39 N ATOM 0 H LYS A 389 -2.996 -7.321 -9.204 1.00 0.23 H new ATOM 0 HA LYS A 389 -4.930 -5.300 -9.314 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.307 -7.570 -7.426 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.583 -6.434 -7.035 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.640 -8.272 -8.104 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.640 -6.967 -9.274 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.602 -7.964 -10.342 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.682 -9.295 -9.205 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.790 -8.544 -11.270 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -5.734 -9.942 -11.318 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.458 -10.968 -10.365 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -6.926 -10.247 -8.923 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -8.173 -9.527 -9.823 1.00 1.39 H new ATOM 1015 N MET A 390 -2.743 -5.010 -6.856 1.00 0.19 N ATOM 1016 CA MET A 390 -2.177 -4.068 -5.892 1.00 0.17 C ATOM 1017 C MET A 390 -1.719 -2.792 -6.591 1.00 0.16 C ATOM 1018 O MET A 390 -1.941 -1.684 -6.102 1.00 0.17 O ATOM 1019 CB MET A 390 -0.994 -4.700 -5.158 1.00 0.15 C ATOM 1020 CG MET A 390 -0.346 -3.760 -4.159 1.00 0.14 C ATOM 1021 SD MET A 390 1.087 -4.475 -3.337 1.00 0.18 S ATOM 1022 CE MET A 390 1.596 -3.093 -2.318 1.00 1.57 C ATOM 0 H MET A 390 -2.250 -5.901 -6.911 1.00 0.19 H new ATOM 0 HA MET A 390 -2.954 -3.818 -5.170 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.333 -5.596 -4.638 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.248 -5.017 -5.887 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.044 -2.847 -4.672 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.083 -3.475 -3.408 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.632 -3.231 -2.008 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.508 -2.168 -2.889 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.958 -3.037 -1.436 1.00 1.57 H new ATOM 1032 N SER A 391 -1.077 -2.965 -7.737 1.00 0.15 N ATOM 1033 CA SER A 391 -0.586 -1.850 -8.526 1.00 0.17 C ATOM 1034 C SER A 391 -1.735 -0.929 -8.935 1.00 0.19 C ATOM 1035 O SER A 391 -1.588 0.288 -8.913 1.00 0.21 O ATOM 1036 CB SER A 391 0.152 -2.379 -9.762 1.00 0.23 C ATOM 1037 OG SER A 391 0.665 -1.333 -10.570 1.00 1.02 O ATOM 0 H SER A 391 -0.883 -3.880 -8.143 1.00 0.15 H new ATOM 0 HA SER A 391 0.109 -1.267 -7.921 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.971 -3.025 -9.445 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.528 -2.992 -10.354 1.00 0.23 H new ATOM 0 HG SER A 391 1.128 -1.715 -11.345 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.883 -1.511 -9.287 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.064 -0.724 -9.654 1.00 0.26 C ATOM 1045 C ARG A 392 -4.430 0.214 -8.522 1.00 0.22 C ATOM 1046 O ARG A 392 -4.591 1.422 -8.717 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.260 -1.626 -9.930 1.00 0.38 C ATOM 1048 CG ARG A 392 -4.980 -2.733 -10.917 1.00 1.12 C ATOM 1049 CD ARG A 392 -4.656 -2.196 -12.302 1.00 2.05 C ATOM 1050 NE ARG A 392 -5.796 -1.525 -12.923 1.00 2.61 N ATOM 1051 CZ ARG A 392 -5.691 -0.696 -13.961 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -4.493 -0.359 -14.427 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -6.783 -0.180 -14.510 1.00 4.06 N ATOM 0 H ARG A 392 -3.021 -2.521 -9.326 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.820 -0.161 -10.555 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.594 -2.067 -8.991 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -6.082 -1.017 -10.306 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -4.146 -3.336 -10.558 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.846 -3.392 -10.978 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -3.822 -1.498 -12.231 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.331 -3.018 -12.940 1.00 2.05 H new ATOM 0 HE ARG A 392 -6.725 -1.701 -12.540 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -3.652 -0.735 -13.990 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -4.415 0.276 -15.222 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -7.702 -0.418 -14.138 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -6.703 0.455 -15.305 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.574 -0.372 -7.344 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.842 0.383 -6.127 1.00 0.17 C ATOM 1069 C ALA A 393 -3.816 1.497 -5.936 1.00 0.12 C ATOM 1070 O ALA A 393 -4.178 2.652 -5.716 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.846 -0.542 -4.923 1.00 0.20 C ATOM 0 H ALA A 393 -4.509 -1.380 -7.203 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.826 0.842 -6.223 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -5.047 0.036 -4.021 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.619 -1.300 -5.049 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.874 -1.027 -4.834 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.535 1.144 -6.038 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.452 2.122 -5.949 1.00 0.10 C ATOM 1079 C LEU A 394 -1.650 3.246 -6.957 1.00 0.11 C ATOM 1080 O LEU A 394 -1.501 4.418 -6.621 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.099 1.442 -6.189 1.00 0.11 C ATOM 1082 CG LEU A 394 0.310 0.425 -5.129 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.483 -0.410 -5.614 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.671 1.140 -3.844 1.00 0.13 C ATOM 0 H LEU A 394 -2.221 0.184 -6.183 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.465 2.549 -4.946 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.127 0.943 -7.158 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.671 2.211 -6.249 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.531 -0.243 -4.941 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.760 -1.130 -4.844 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.200 -0.942 -6.523 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.331 0.242 -5.824 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.962 0.409 -3.090 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.501 1.822 -4.028 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.190 1.705 -3.488 1.00 0.13 H new ATOM 1096 N ARG A 395 -2.006 2.885 -8.187 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.225 3.871 -9.241 1.00 0.14 C ATOM 1098 C ARG A 395 -3.320 4.850 -8.846 1.00 0.14 C ATOM 1099 O ARG A 395 -3.234 6.041 -9.136 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.588 3.213 -10.562 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.513 2.288 -11.092 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.124 2.669 -10.617 1.00 0.52 C ATOM 1103 NE ARG A 395 0.812 1.549 -10.752 1.00 1.30 N ATOM 1104 CZ ARG A 395 2.119 1.675 -10.968 1.00 1.72 C ATOM 1105 NH1 ARG A 395 2.663 2.874 -11.138 1.00 1.66 N ATOM 1106 NH2 ARG A 395 2.881 0.590 -11.017 1.00 2.64 N ATOM 0 H ARG A 395 -2.149 1.918 -8.478 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.287 4.410 -9.372 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.512 2.649 -10.436 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.787 3.988 -11.302 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -1.732 1.267 -10.779 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.535 2.299 -12.182 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.239 3.520 -11.193 1.00 0.52 H new ATOM 0 HD3 ARG A 395 -0.168 2.985 -9.575 1.00 0.52 H new ATOM 0 HE ARG A 395 0.434 0.605 -10.675 1.00 1.30 H new ATOM 0 HH11 ARG A 395 2.078 3.709 -11.104 1.00 1.66 H new ATOM 0 HH12 ARG A 395 3.666 2.960 -11.303 1.00 1.66 H new ATOM 0 HH21 ARG A 395 2.464 -0.332 -10.890 1.00 2.64 H new ATOM 0 HH22 ARG A 395 3.884 0.678 -11.182 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.349 4.347 -8.172 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.448 5.191 -7.734 1.00 0.13 C ATOM 1122 C HIS A 396 -5.010 6.055 -6.555 1.00 0.11 C ATOM 1123 O HIS A 396 -5.412 7.213 -6.437 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.678 4.353 -7.374 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.968 5.063 -7.656 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.175 5.712 -8.850 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -9.067 5.208 -6.881 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.386 6.235 -8.774 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.967 5.958 -7.598 1.00 0.26 N ATOM 0 H HIS A 396 -4.442 3.363 -7.919 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.728 5.847 -8.558 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.652 3.419 -7.935 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.637 4.091 -6.317 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.210 4.810 -5.887 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.849 6.813 -9.560 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.897 6.248 -7.295 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.145 5.496 -5.712 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.622 6.213 -4.550 1.00 0.10 C ATOM 1139 C TYR A 397 -2.860 7.457 -4.973 1.00 0.09 C ATOM 1140 O TYR A 397 -2.861 8.464 -4.271 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.705 5.316 -3.710 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.428 4.163 -3.081 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.801 4.181 -2.988 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.746 3.065 -2.589 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.493 3.141 -2.422 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.430 2.011 -2.010 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.808 2.055 -1.931 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.493 1.022 -1.337 1.00 0.30 O ATOM 0 H TYR A 397 -3.790 4.545 -5.812 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.478 6.509 -3.944 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.903 4.934 -4.341 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.238 5.915 -2.928 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.345 5.033 -3.369 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.669 3.030 -2.657 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.571 3.175 -2.362 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.890 1.160 -1.622 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.722 0.350 -2.013 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.208 7.381 -6.122 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.427 8.503 -6.618 1.00 0.12 C ATOM 1160 C TYR A 398 -2.323 9.708 -6.869 1.00 0.14 C ATOM 1161 O TYR A 398 -2.012 10.825 -6.456 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.709 8.147 -7.923 1.00 0.14 C ATOM 1163 CG TYR A 398 0.184 6.924 -7.865 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.739 6.479 -6.669 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.478 6.215 -9.023 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.554 5.367 -6.631 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.293 5.108 -8.991 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.826 4.687 -7.797 1.00 0.14 C ATOM 1169 OH TYR A 398 2.635 3.583 -7.776 1.00 0.18 O ATOM 0 H TYR A 398 -2.204 6.559 -6.726 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.686 8.743 -5.855 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.459 7.991 -8.699 1.00 0.14 H new ATOM 0 HB3 TYR A 398 -0.106 9.001 -8.230 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.528 7.014 -5.755 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.059 6.539 -9.964 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.975 5.032 -5.695 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.513 4.571 -9.902 1.00 0.16 H new ATOM 0 HH TYR A 398 3.146 3.568 -6.940 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.443 9.469 -7.542 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.361 10.540 -7.899 1.00 0.19 C ATOM 1181 C LYS A 399 -5.058 11.106 -6.681 1.00 0.19 C ATOM 1182 O LYS A 399 -5.338 12.298 -6.612 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.414 10.064 -8.887 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.883 9.862 -10.296 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.633 8.399 -10.596 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.930 7.616 -10.550 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.735 6.186 -10.897 1.00 0.71 N ATOM 0 H LYS A 399 -3.736 8.542 -7.851 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.757 11.320 -8.362 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.837 9.125 -8.530 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.227 10.789 -8.915 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.597 10.264 -11.015 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.956 10.422 -10.419 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.175 8.297 -11.580 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.928 7.989 -9.872 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.362 7.690 -9.552 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.646 8.061 -11.241 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.418 5.605 -10.371 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.882 6.053 -11.918 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.768 5.896 -10.646 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.346 10.241 -5.727 1.00 0.17 N ATOM 1202 CA LEU A 400 -6.061 10.642 -4.531 1.00 0.18 C ATOM 1203 C LEU A 400 -5.104 11.147 -3.477 1.00 0.18 C ATOM 1204 O LEU A 400 -5.453 11.245 -2.298 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.888 9.470 -4.025 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.722 8.792 -5.110 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.370 7.536 -4.576 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.771 9.748 -5.656 1.00 0.21 C ATOM 0 H LEU A 400 -5.095 9.253 -5.758 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.734 11.465 -4.769 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.221 8.733 -3.578 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.552 9.820 -3.235 1.00 0.18 H new ATOM 0 HG LEU A 400 -7.058 8.512 -5.928 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.960 7.068 -5.364 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.599 6.843 -4.240 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -9.020 7.790 -3.739 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.354 9.246 -6.428 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.432 10.063 -4.848 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.279 10.622 -6.084 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.897 11.473 -3.928 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.943 12.205 -3.108 1.00 0.20 C ATOM 1222 C ASN A 401 -2.505 11.371 -1.909 1.00 0.17 C ATOM 1223 O ASN A 401 -2.415 11.855 -0.782 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.615 13.500 -2.670 1.00 0.27 C ATOM 1225 CG ASN A 401 -2.668 14.536 -2.099 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -2.041 15.296 -2.836 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -2.579 14.600 -0.787 1.00 1.21 N ATOM 0 H ASN A 401 -3.557 11.240 -4.861 1.00 0.18 H new ATOM 0 HA ASN A 401 -2.041 12.428 -3.677 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.134 13.933 -3.525 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -4.373 13.267 -1.922 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -1.975 15.296 -0.350 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -3.114 13.953 -0.207 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.255 10.103 -2.165 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.935 9.158 -1.119 1.00 0.10 C ATOM 1236 C ILE A 402 -0.500 8.679 -1.221 1.00 0.09 C ATOM 1237 O ILE A 402 0.337 9.004 -0.381 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.902 7.979 -1.236 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.316 8.511 -1.107 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.628 6.908 -0.197 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.344 7.543 -1.588 1.00 0.13 C ATOM 0 H ILE A 402 -2.268 9.701 -3.102 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.039 9.643 -0.148 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.765 7.502 -2.207 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.514 8.755 -0.063 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.404 9.438 -1.673 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.340 6.092 -0.320 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.614 6.528 -0.325 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.733 7.334 0.801 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.336 7.978 -1.471 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.168 7.318 -2.640 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.280 6.624 -1.005 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.218 7.911 -2.252 1.00 0.07 N ATOM 1254 CA ILE A 403 1.125 7.438 -2.490 1.00 0.07 C ATOM 1255 C ILE A 403 1.637 8.044 -3.786 1.00 0.08 C ATOM 1256 O ILE A 403 0.855 8.533 -4.596 1.00 0.10 O ATOM 1257 CB ILE A 403 1.188 5.888 -2.556 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.607 5.264 -1.290 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.617 5.405 -2.757 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.710 3.757 -1.286 1.00 0.11 C ATOM 0 H ILE A 403 -0.905 7.601 -2.940 1.00 0.07 H new ATOM 0 HA ILE A 403 1.756 7.748 -1.657 1.00 0.07 H new ATOM 0 HB ILE A 403 0.590 5.574 -3.411 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.129 5.663 -0.420 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.439 5.553 -1.194 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.630 4.316 -2.799 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.010 5.809 -3.690 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.236 5.743 -1.926 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.282 3.366 -0.363 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.165 3.353 -2.139 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.758 3.464 -1.353 1.00 0.11 H new ATOM 1272 N ARG A 404 2.941 8.070 -3.949 1.00 0.10 N ATOM 1273 CA ARG A 404 3.538 8.496 -5.193 1.00 0.13 C ATOM 1274 C ARG A 404 4.627 7.532 -5.598 1.00 0.14 C ATOM 1275 O ARG A 404 5.049 6.673 -4.822 1.00 0.16 O ATOM 1276 CB ARG A 404 4.129 9.897 -5.079 1.00 0.17 C ATOM 1277 CG ARG A 404 5.554 9.910 -4.574 1.00 0.25 C ATOM 1278 CD ARG A 404 6.228 11.233 -4.855 1.00 0.36 C ATOM 1279 NE ARG A 404 6.385 11.447 -6.296 1.00 1.14 N ATOM 1280 CZ ARG A 404 6.984 12.502 -6.852 1.00 1.56 C ATOM 1281 NH1 ARG A 404 7.558 13.430 -6.092 1.00 1.63 N ATOM 1282 NH2 ARG A 404 7.023 12.613 -8.178 1.00 2.39 N ATOM 0 H ARG A 404 3.611 7.799 -3.230 1.00 0.10 H new ATOM 0 HA ARG A 404 2.752 8.513 -5.948 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.094 10.379 -6.056 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.509 10.491 -4.408 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.563 9.716 -3.501 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.117 9.106 -5.048 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.639 12.044 -4.425 1.00 0.36 H new ATOM 0 HD3 ARG A 404 7.205 11.258 -4.372 1.00 0.36 H new ATOM 0 HE ARG A 404 6.008 10.735 -6.922 1.00 1.14 H new ATOM 0 HH11 ARG A 404 7.543 13.338 -5.076 1.00 1.63 H new ATOM 0 HH12 ARG A 404 8.014 14.233 -6.525 1.00 1.63 H new ATOM 0 HH21 ARG A 404 6.597 11.894 -8.763 1.00 2.39 H new ATOM 0 HH22 ARG A 404 7.479 13.417 -8.609 1.00 2.39 H new ATOM 1296 N LYS A 405 5.084 7.708 -6.810 1.00 0.17 N ATOM 1297 CA LYS A 405 6.132 6.896 -7.359 1.00 0.19 C ATOM 1298 C LYS A 405 7.406 7.723 -7.465 1.00 0.22 C ATOM 1299 O LYS A 405 7.376 8.873 -7.913 1.00 0.27 O ATOM 1300 CB LYS A 405 5.716 6.388 -8.728 1.00 0.22 C ATOM 1301 CG LYS A 405 6.553 5.221 -9.197 1.00 0.34 C ATOM 1302 CD LYS A 405 6.229 3.986 -8.402 1.00 0.29 C ATOM 1303 CE LYS A 405 7.277 2.906 -8.582 1.00 0.23 C ATOM 1304 NZ LYS A 405 7.660 2.703 -10.001 1.00 1.08 N ATOM 0 H LYS A 405 4.735 8.425 -7.447 1.00 0.17 H new ATOM 0 HA LYS A 405 6.317 6.041 -6.709 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.668 6.089 -8.697 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.794 7.200 -9.451 1.00 0.22 H new ATOM 0 HG2 LYS A 405 6.370 5.037 -10.256 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.611 5.460 -9.093 1.00 0.34 H new ATOM 0 HD2 LYS A 405 6.152 4.244 -7.346 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.256 3.602 -8.708 1.00 0.29 H new ATOM 0 HE2 LYS A 405 8.164 3.168 -8.006 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.898 1.968 -8.176 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 8.218 1.829 -10.089 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 6.803 2.626 -10.584 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 8.229 3.511 -10.326 1.00 1.08 H new ATOM 1318 N GLU A 406 8.505 7.137 -7.039 1.00 0.23 N ATOM 1319 CA GLU A 406 9.795 7.802 -7.042 1.00 0.28 C ATOM 1320 C GLU A 406 10.376 7.915 -8.448 1.00 0.34 C ATOM 1321 O GLU A 406 9.914 7.269 -9.396 1.00 0.43 O ATOM 1322 CB GLU A 406 10.768 7.037 -6.148 1.00 0.29 C ATOM 1323 CG GLU A 406 10.538 5.548 -6.153 1.00 0.63 C ATOM 1324 CD GLU A 406 10.687 4.919 -7.523 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.525 5.387 -8.317 1.00 2.32 O ATOM 1326 OE2 GLU A 406 9.962 3.959 -7.812 1.00 2.42 O ATOM 0 H GLU A 406 8.531 6.183 -6.679 1.00 0.23 H new ATOM 0 HA GLU A 406 9.647 8.812 -6.661 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.788 7.241 -6.475 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.680 7.408 -5.127 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.242 5.077 -5.467 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.537 5.341 -5.774 1.00 0.63 H new ATOM 1333 N PRO A 407 11.353 8.803 -8.594 1.00 0.41 N ATOM 1334 CA PRO A 407 12.175 8.908 -9.785 1.00 0.51 C ATOM 1335 C PRO A 407 13.224 7.790 -9.902 1.00 0.52 C ATOM 1336 O PRO A 407 14.176 7.748 -9.119 1.00 0.54 O ATOM 1337 CB PRO A 407 12.851 10.273 -9.648 1.00 0.61 C ATOM 1338 CG PRO A 407 12.697 10.694 -8.226 1.00 0.58 C ATOM 1339 CD PRO A 407 11.753 9.740 -7.551 1.00 0.45 C ATOM 0 HA PRO A 407 11.572 8.807 -10.687 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.905 10.211 -9.920 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.391 11.000 -10.318 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.664 10.692 -7.722 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.312 11.712 -8.171 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.239 9.224 -6.722 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.890 10.264 -7.139 1.00 0.45 H new ATOM 1347 N GLY A 408 13.056 6.893 -10.869 1.00 0.54 N ATOM 1348 CA GLY A 408 14.167 6.048 -11.294 1.00 0.58 C ATOM 1349 C GLY A 408 14.270 4.679 -10.633 1.00 0.58 C ATOM 1350 O GLY A 408 15.126 3.880 -11.023 1.00 0.86 O ATOM 0 H GLY A 408 12.179 6.734 -11.365 1.00 0.54 H new ATOM 0 HA2 GLY A 408 14.092 5.902 -12.372 1.00 0.58 H new ATOM 0 HA3 GLY A 408 15.096 6.587 -11.109 1.00 0.58 H new ATOM 1354 N GLN A 409 13.444 4.388 -9.643 1.00 0.47 N ATOM 1355 CA GLN A 409 13.480 3.081 -8.996 1.00 0.51 C ATOM 1356 C GLN A 409 12.409 2.159 -9.582 1.00 0.48 C ATOM 1357 O GLN A 409 11.744 2.499 -10.564 1.00 0.61 O ATOM 1358 CB GLN A 409 13.294 3.188 -7.481 1.00 0.63 C ATOM 1359 CG GLN A 409 14.241 4.161 -6.794 1.00 0.45 C ATOM 1360 CD GLN A 409 15.020 3.510 -5.666 1.00 0.71 C ATOM 1361 OE1 GLN A 409 16.135 3.916 -5.345 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.441 2.484 -5.063 1.00 0.45 N ATOM 0 H GLN A 409 12.745 5.030 -9.270 1.00 0.47 H new ATOM 0 HA GLN A 409 14.466 2.658 -9.187 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.268 3.493 -7.275 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.427 2.200 -7.041 1.00 0.63 H new ATOM 0 HG2 GLN A 409 14.938 4.565 -7.528 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.671 5.002 -6.400 1.00 0.45 H new ATOM 0 HE21 GLN A 409 13.514 2.176 -5.358 1.00 0.45 H new ATOM 0 HE22 GLN A 409 14.921 2.001 -4.304 1.00 0.45 H new ATOM 1371 N ARG A 410 12.246 0.992 -8.977 1.00 0.41 N ATOM 1372 CA ARG A 410 11.287 0.001 -9.456 1.00 0.39 C ATOM 1373 C ARG A 410 10.077 -0.094 -8.541 1.00 0.31 C ATOM 1374 O ARG A 410 9.010 0.432 -8.853 1.00 0.42 O ATOM 1375 CB ARG A 410 11.956 -1.377 -9.611 1.00 0.47 C ATOM 1376 CG ARG A 410 12.996 -1.682 -8.543 1.00 0.86 C ATOM 1377 CD ARG A 410 14.361 -1.161 -8.949 1.00 1.11 C ATOM 1378 NE ARG A 410 15.128 -0.644 -7.812 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.996 0.372 -7.909 1.00 2.04 C ATOM 1380 NH1 ARG A 410 16.173 0.985 -9.073 1.00 2.65 N ATOM 1381 NH2 ARG A 410 16.685 0.773 -6.850 1.00 2.43 N ATOM 0 H ARG A 410 12.767 0.705 -8.149 1.00 0.41 H new ATOM 0 HA ARG A 410 10.938 0.330 -10.435 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.186 -2.148 -9.585 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.430 -1.432 -10.591 1.00 0.47 H new ATOM 0 HG2 ARG A 410 12.696 -1.229 -7.598 1.00 0.86 H new ATOM 0 HG3 ARG A 410 13.048 -2.758 -8.378 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.924 -1.962 -9.428 1.00 1.11 H new ATOM 0 HD3 ARG A 410 14.239 -0.371 -9.689 1.00 1.11 H new ATOM 0 HE ARG A 410 14.994 -1.080 -6.900 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.648 0.683 -9.894 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.834 1.758 -9.147 1.00 2.65 H new ATOM 0 HH21 ARG A 410 16.557 0.307 -5.952 1.00 2.43 H new ATOM 0 HH22 ARG A 410 17.344 1.547 -6.933 1.00 2.43 H new ATOM 1395 N LEU A 411 10.255 -0.755 -7.413 1.00 0.21 N ATOM 1396 CA LEU A 411 9.172 -0.983 -6.473 1.00 0.14 C ATOM 1397 C LEU A 411 9.278 -0.058 -5.279 1.00 0.11 C ATOM 1398 O LEU A 411 8.892 -0.406 -4.173 1.00 0.12 O ATOM 1399 CB LEU A 411 9.177 -2.439 -6.039 1.00 0.11 C ATOM 1400 CG LEU A 411 8.783 -3.408 -7.145 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.001 -4.845 -6.719 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.337 -3.170 -7.518 1.00 0.16 C ATOM 0 H LEU A 411 11.150 -1.148 -7.122 1.00 0.21 H new ATOM 0 HA LEU A 411 8.225 -0.763 -6.966 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.172 -2.698 -5.678 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.492 -2.561 -5.200 1.00 0.11 H new ATOM 0 HG LEU A 411 9.416 -3.231 -8.015 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.711 -5.513 -7.530 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.054 -4.998 -6.482 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.396 -5.059 -5.838 1.00 0.15 H new ATOM 0 HD21 LEU A 411 7.047 -3.861 -8.310 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.705 -3.333 -6.645 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.216 -2.145 -7.868 1.00 0.16 H new ATOM 1414 N LEU A 412 9.831 1.111 -5.507 1.00 0.13 N ATOM 1415 CA LEU A 412 9.938 2.114 -4.467 1.00 0.11 C ATOM 1416 C LEU A 412 8.710 3.018 -4.538 1.00 0.10 C ATOM 1417 O LEU A 412 8.275 3.392 -5.623 1.00 0.11 O ATOM 1418 CB LEU A 412 11.209 2.924 -4.699 1.00 0.13 C ATOM 1419 CG LEU A 412 11.819 3.660 -3.501 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.796 4.461 -2.728 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.516 2.682 -2.595 1.00 0.16 C ATOM 0 H LEU A 412 10.216 1.394 -6.408 1.00 0.13 H new ATOM 0 HA LEU A 412 9.986 1.651 -3.482 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.967 2.250 -5.099 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.999 3.662 -5.473 1.00 0.13 H new ATOM 0 HG LEU A 412 12.544 4.372 -3.895 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.283 4.961 -1.891 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.346 5.206 -3.384 1.00 0.13 H new ATOM 0 HD13 LEU A 412 10.021 3.794 -2.351 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.946 3.215 -1.747 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.798 1.945 -2.235 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.309 2.177 -3.146 1.00 0.16 H new ATOM 1433 N PHE A 413 8.142 3.358 -3.395 1.00 0.10 N ATOM 1434 CA PHE A 413 6.996 4.246 -3.365 1.00 0.11 C ATOM 1435 C PHE A 413 7.097 5.191 -2.178 1.00 0.12 C ATOM 1436 O PHE A 413 7.617 4.828 -1.121 1.00 0.19 O ATOM 1437 CB PHE A 413 5.693 3.452 -3.295 1.00 0.12 C ATOM 1438 CG PHE A 413 5.524 2.468 -4.415 1.00 0.10 C ATOM 1439 CD1 PHE A 413 6.058 1.196 -4.312 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.834 2.806 -5.565 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.909 0.280 -5.331 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.682 1.893 -6.586 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.218 0.628 -6.470 1.00 0.11 C ATOM 0 H PHE A 413 8.454 3.034 -2.480 1.00 0.10 H new ATOM 0 HA PHE A 413 6.992 4.830 -4.286 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.654 2.918 -2.345 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.854 4.147 -3.304 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.599 0.917 -3.420 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.410 3.795 -5.664 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.333 -0.709 -5.236 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.142 2.169 -7.479 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.096 -0.087 -7.270 1.00 0.11 H new ATOM 1453 N ARG A 414 6.618 6.405 -2.364 1.00 0.10 N ATOM 1454 CA ARG A 414 6.627 7.398 -1.309 1.00 0.12 C ATOM 1455 C ARG A 414 5.211 7.775 -0.938 1.00 0.11 C ATOM 1456 O ARG A 414 4.400 8.101 -1.798 1.00 0.15 O ATOM 1457 CB ARG A 414 7.403 8.640 -1.752 1.00 0.20 C ATOM 1458 CG ARG A 414 6.984 9.923 -1.046 1.00 0.35 C ATOM 1459 CD ARG A 414 8.012 10.377 -0.030 1.00 0.37 C ATOM 1460 NE ARG A 414 9.306 10.651 -0.651 1.00 1.21 N ATOM 1461 CZ ARG A 414 10.066 11.708 -0.368 1.00 1.46 C ATOM 1462 NH1 ARG A 414 9.649 12.631 0.489 1.00 1.06 N ATOM 1463 NH2 ARG A 414 11.237 11.847 -0.966 1.00 2.58 N ATOM 0 H ARG A 414 6.215 6.729 -3.243 1.00 0.10 H new ATOM 0 HA ARG A 414 7.120 6.973 -0.435 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.466 8.472 -1.576 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.274 8.771 -2.826 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.833 10.710 -1.785 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.027 9.766 -0.548 1.00 0.35 H new ATOM 0 HD2 ARG A 414 7.653 11.275 0.473 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.131 9.609 0.734 1.00 0.37 H new ATOM 0 HE ARG A 414 9.650 9.989 -1.347 1.00 1.21 H new ATOM 0 HH11 ARG A 414 8.738 12.535 0.938 1.00 1.06 H new ATOM 0 HH12 ARG A 414 10.239 13.436 0.698 1.00 1.06 H new ATOM 0 HH21 ARG A 414 11.552 11.148 -1.638 1.00 2.58 H new ATOM 0 HH22 ARG A 414 11.825 12.653 -0.755 1.00 2.58 H new ATOM 1477 N PHE A 415 4.916 7.720 0.337 1.00 0.10 N ATOM 1478 CA PHE A 415 3.627 8.168 0.821 1.00 0.09 C ATOM 1479 C PHE A 415 3.568 9.688 0.776 1.00 0.11 C ATOM 1480 O PHE A 415 4.237 10.373 1.551 1.00 0.14 O ATOM 1481 CB PHE A 415 3.363 7.672 2.244 1.00 0.10 C ATOM 1482 CG PHE A 415 2.643 6.364 2.334 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.255 6.323 2.303 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.345 5.184 2.479 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.586 5.123 2.409 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.690 3.984 2.582 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.306 3.949 2.546 1.00 0.12 C ATOM 0 H PHE A 415 5.546 7.371 1.059 1.00 0.10 H new ATOM 0 HA PHE A 415 2.853 7.752 0.176 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.317 7.581 2.764 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.782 8.427 2.774 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.695 7.240 2.195 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.424 5.207 2.512 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.493 5.099 2.385 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.252 3.068 2.691 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.788 3.005 2.625 1.00 0.12 H new ATOM 1497 N MET A 416 2.798 10.196 -0.175 1.00 0.11 N ATOM 1498 CA MET A 416 2.558 11.628 -0.312 1.00 0.15 C ATOM 1499 C MET A 416 1.913 12.177 0.947 1.00 0.17 C ATOM 1500 O MET A 416 2.103 13.339 1.311 1.00 0.23 O ATOM 1501 CB MET A 416 1.619 11.886 -1.492 1.00 0.15 C ATOM 1502 CG MET A 416 2.240 11.652 -2.846 1.00 0.24 C ATOM 1503 SD MET A 416 3.585 12.801 -3.202 1.00 1.41 S ATOM 1504 CE MET A 416 2.749 14.375 -3.004 1.00 1.47 C ATOM 0 H MET A 416 2.321 9.628 -0.875 1.00 0.11 H new ATOM 0 HA MET A 416 3.515 12.122 -0.479 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.744 11.244 -1.391 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.266 12.916 -1.441 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.617 10.631 -2.897 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.473 11.747 -3.615 1.00 0.24 H new ATOM 0 HE1 MET A 416 3.321 15.156 -3.504 1.00 1.47 H new ATOM 0 HE2 MET A 416 1.754 14.316 -3.444 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.663 14.610 -1.943 1.00 1.47 H new ATOM 1514 N LYS A 417 1.145 11.323 1.594 1.00 0.16 N ATOM 1515 CA LYS A 417 0.361 11.703 2.744 1.00 0.21 C ATOM 1516 C LYS A 417 0.348 10.580 3.767 1.00 0.21 C ATOM 1517 O LYS A 417 0.537 9.414 3.423 1.00 0.22 O ATOM 1518 CB LYS A 417 -1.064 12.023 2.299 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.324 13.504 2.111 1.00 0.57 C ATOM 1520 CD LYS A 417 -1.543 14.157 3.457 1.00 0.54 C ATOM 1521 CE LYS A 417 -1.393 15.671 3.417 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.490 16.323 2.654 1.00 1.36 N ATOM 0 H LYS A 417 1.049 10.342 1.332 1.00 0.16 H new ATOM 0 HA LYS A 417 0.804 12.585 3.206 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.268 11.505 1.362 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.763 11.631 3.038 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.480 13.970 1.603 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -2.198 13.652 1.477 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -2.540 13.906 3.818 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -0.832 13.746 4.174 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -1.379 16.060 4.435 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -0.435 15.928 2.965 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -2.347 17.353 2.653 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -2.488 15.972 1.675 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -3.403 16.100 3.100 1.00 1.36 H new ATOM 1536 N THR A 418 0.147 10.939 5.022 1.00 0.24 N ATOM 1537 CA THR A 418 0.022 9.960 6.080 1.00 0.24 C ATOM 1538 C THR A 418 -1.446 9.663 6.371 1.00 0.26 C ATOM 1539 O THR A 418 -2.305 10.517 6.158 1.00 0.28 O ATOM 1540 CB THR A 418 0.741 10.439 7.345 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.396 11.802 7.623 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.240 10.317 7.162 1.00 0.22 C ATOM 0 H THR A 418 0.067 11.907 5.332 1.00 0.24 H new ATOM 0 HA THR A 418 0.495 9.036 5.748 1.00 0.24 H new ATOM 0 HB THR A 418 0.430 9.817 8.184 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.859 12.098 8.434 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.746 10.659 8.065 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.500 9.275 6.973 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.554 10.929 6.316 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.739 8.449 6.871 1.00 0.25 N ATOM 1551 CA PRO A 419 -3.108 7.914 7.002 1.00 0.28 C ATOM 1552 C PRO A 419 -4.129 8.887 7.588 1.00 0.31 C ATOM 1553 O PRO A 419 -5.210 9.069 7.026 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.908 6.712 7.920 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.544 6.235 7.576 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.738 7.478 7.354 1.00 0.25 C ATOM 0 HA PRO A 419 -3.533 7.683 6.025 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.982 6.993 8.971 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.659 5.942 7.742 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.123 5.631 8.380 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.559 5.610 6.683 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.259 7.817 8.273 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.054 7.319 6.622 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.786 9.512 8.703 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.694 10.446 9.374 1.00 0.42 C ATOM 1566 C ASP A 420 -5.059 11.604 8.454 1.00 0.43 C ATOM 1567 O ASP A 420 -6.209 12.045 8.406 1.00 0.48 O ATOM 1568 CB ASP A 420 -4.053 10.983 10.651 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.936 11.979 11.378 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -5.861 11.550 12.101 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -4.696 13.197 11.242 1.00 0.72 O ATOM 0 H ASP A 420 -2.886 9.393 9.168 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.605 9.906 9.631 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.828 10.150 11.317 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -3.104 11.459 10.403 1.00 0.49 H new ATOM 1576 N GLU A 421 -4.070 12.075 7.716 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.257 13.158 6.771 1.00 0.45 C ATOM 1578 C GLU A 421 -5.024 12.691 5.533 1.00 0.42 C ATOM 1579 O GLU A 421 -5.804 13.446 4.954 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.897 13.702 6.356 1.00 0.49 C ATOM 1581 CG GLU A 421 -2.163 14.458 7.446 1.00 0.81 C ATOM 1582 CD GLU A 421 -2.840 15.763 7.806 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -3.106 16.573 6.891 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -3.118 15.984 9.002 1.00 2.17 O ATOM 0 H GLU A 421 -3.116 11.717 7.756 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.843 13.940 7.255 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.274 12.872 6.024 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -3.030 14.363 5.499 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.095 13.831 8.335 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.143 14.660 7.119 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.797 11.445 5.132 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.386 10.904 3.908 1.00 0.33 C ATOM 1593 C ILE A 422 -6.883 10.645 4.065 1.00 0.36 C ATOM 1594 O ILE A 422 -7.664 10.816 3.129 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.709 9.580 3.502 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -3.198 9.745 3.396 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.278 9.087 2.191 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.485 8.486 2.941 1.00 0.27 C ATOM 0 H ILE A 422 -4.206 10.786 5.639 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.228 11.656 3.135 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.912 8.842 4.278 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.976 10.552 2.697 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.804 10.046 4.367 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.793 8.151 1.913 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.350 8.922 2.299 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -5.102 9.832 1.415 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.413 8.674 2.887 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.677 7.682 3.652 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.852 8.196 1.957 1.00 0.27 H new ATOM 1610 N MET A 423 -7.272 10.241 5.258 1.00 0.42 N ATOM 1611 CA MET A 423 -8.645 9.845 5.545 1.00 0.51 C ATOM 1612 C MET A 423 -9.615 11.023 5.588 1.00 0.58 C ATOM 1613 O MET A 423 -10.739 10.901 6.067 1.00 0.71 O ATOM 1614 CB MET A 423 -8.691 9.046 6.835 1.00 0.58 C ATOM 1615 CG MET A 423 -8.130 7.659 6.649 1.00 0.58 C ATOM 1616 SD MET A 423 -8.674 6.489 7.913 1.00 0.90 S ATOM 1617 CE MET A 423 -7.884 4.987 7.335 1.00 2.01 C ATOM 0 H MET A 423 -6.646 10.176 6.061 1.00 0.42 H new ATOM 0 HA MET A 423 -8.980 9.218 4.719 1.00 0.51 H new ATOM 0 HB2 MET A 423 -8.125 9.567 7.607 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.721 8.979 7.185 1.00 0.58 H new ATOM 0 HG2 MET A 423 -8.423 7.285 5.668 1.00 0.58 H new ATOM 0 HG3 MET A 423 -7.041 7.711 6.658 1.00 0.58 H new ATOM 0 HE1 MET A 423 -8.123 4.166 8.011 1.00 2.01 H new ATOM 0 HE2 MET A 423 -8.244 4.749 6.334 1.00 2.01 H new ATOM 0 HE3 MET A 423 -6.804 5.131 7.308 1.00 2.01 H new ATOM 1627 N SER A 424 -9.156 12.162 5.119 1.00 0.59 N ATOM 1628 CA SER A 424 -9.974 13.370 5.083 1.00 0.72 C ATOM 1629 C SER A 424 -10.752 13.488 3.763 1.00 0.67 C ATOM 1630 O SER A 424 -10.951 14.589 3.247 1.00 1.09 O ATOM 1631 CB SER A 424 -9.089 14.603 5.286 1.00 0.92 C ATOM 1632 OG SER A 424 -8.037 14.637 4.333 1.00 1.57 O ATOM 0 H SER A 424 -8.212 12.285 4.752 1.00 0.59 H new ATOM 0 HA SER A 424 -10.702 13.308 5.891 1.00 0.72 H new ATOM 0 HB2 SER A 424 -9.693 15.506 5.199 1.00 0.92 H new ATOM 0 HB3 SER A 424 -8.672 14.594 6.293 1.00 0.92 H new ATOM 0 HG SER A 424 -7.199 14.362 4.761 1.00 1.57 H new ATOM 1638 N GLY A 425 -11.184 12.357 3.212 1.00 0.43 N ATOM 1639 CA GLY A 425 -12.000 12.383 2.008 1.00 0.42 C ATOM 1640 C GLY A 425 -11.256 11.923 0.768 1.00 0.37 C ATOM 1641 O GLY A 425 -11.792 11.977 -0.341 1.00 0.50 O ATOM 0 H GLY A 425 -10.985 11.425 3.576 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.873 11.748 2.156 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -12.367 13.397 1.848 1.00 0.42 H new ATOM 1645 N ARG A 426 -10.020 11.480 0.940 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.219 11.015 -0.181 1.00 0.36 C ATOM 1647 C ARG A 426 -9.401 9.513 -0.394 1.00 0.33 C ATOM 1648 O ARG A 426 -9.785 9.068 -1.472 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.751 11.341 0.083 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.523 12.780 0.456 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.497 13.647 -0.776 1.00 0.92 C ATOM 1652 NE ARG A 426 -7.319 15.064 -0.460 1.00 1.37 N ATOM 1653 CZ ARG A 426 -6.797 15.952 -1.302 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -6.378 15.572 -2.505 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -6.696 17.222 -0.941 1.00 2.67 N ATOM 0 H ARG A 426 -9.550 11.433 1.844 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.548 11.522 -1.088 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.382 10.701 0.885 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -7.167 11.106 -0.807 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -8.312 13.117 1.128 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.581 12.877 0.996 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.689 13.320 -1.430 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -8.427 13.515 -1.329 1.00 0.92 H new ATOM 0 HE ARG A 426 -7.613 15.391 0.461 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -6.456 14.595 -2.787 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -5.979 16.258 -3.146 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -7.018 17.517 -0.019 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -6.296 17.905 -1.585 1.00 2.67 H new ATOM 1669 N THR A 427 -9.151 8.741 0.653 1.00 0.33 N ATOM 1670 CA THR A 427 -9.201 7.287 0.566 1.00 0.37 C ATOM 1671 C THR A 427 -10.482 6.732 1.179 1.00 0.43 C ATOM 1672 O THR A 427 -10.654 5.520 1.312 1.00 0.58 O ATOM 1673 CB THR A 427 -7.959 6.663 1.233 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.013 5.244 1.192 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.812 7.109 2.668 1.00 0.41 C ATOM 0 H THR A 427 -8.910 9.098 1.578 1.00 0.33 H new ATOM 0 HA THR A 427 -9.201 7.017 -0.490 1.00 0.37 H new ATOM 0 HB THR A 427 -7.094 7.009 0.667 1.00 0.63 H new ATOM 0 HG1 THR A 427 -8.915 4.944 1.430 1.00 1.24 H new ATOM 0 HG21 THR A 427 -6.925 6.648 3.103 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.711 8.194 2.703 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.693 6.808 3.235 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.387 7.624 1.528 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.708 7.230 1.989 1.00 0.62 C ATOM 1685 C ASP A 428 -13.498 6.677 0.812 1.00 0.61 C ATOM 1686 O ASP A 428 -14.310 5.763 0.954 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.427 8.435 2.599 1.00 0.74 C ATOM 1688 CG ASP A 428 -12.594 9.114 3.666 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -11.522 9.663 3.324 1.00 1.75 O ATOM 1690 OD2 ASP A 428 -13.000 9.090 4.845 1.00 1.63 O ATOM 0 H ASP A 428 -11.233 8.632 1.502 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.619 6.460 2.755 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -13.663 9.152 1.813 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -14.374 8.111 3.030 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.221 7.238 -0.356 1.00 0.54 N ATOM 1696 CA ARG A 429 -13.824 6.788 -1.609 1.00 0.65 C ATOM 1697 C ARG A 429 -13.082 5.580 -2.128 1.00 0.55 C ATOM 1698 O ARG A 429 -13.462 4.976 -3.113 1.00 0.66 O ATOM 1699 CB ARG A 429 -13.743 7.892 -2.649 1.00 0.81 C ATOM 1700 CG ARG A 429 -13.838 9.262 -2.035 1.00 0.98 C ATOM 1701 CD ARG A 429 -13.645 10.357 -3.067 1.00 1.12 C ATOM 1702 NE ARG A 429 -14.657 10.309 -4.121 1.00 1.64 N ATOM 1703 CZ ARG A 429 -15.069 11.377 -4.796 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -14.557 12.574 -4.527 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -15.993 11.246 -5.738 1.00 3.05 N ATOM 0 H ARG A 429 -12.573 8.018 -0.465 1.00 0.54 H new ATOM 0 HA ARG A 429 -14.867 6.532 -1.422 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -12.804 7.805 -3.195 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.547 7.765 -3.374 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -14.811 9.380 -1.558 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.085 9.363 -1.253 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -13.682 11.329 -2.574 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -12.655 10.263 -3.512 1.00 1.12 H new ATOM 0 HE ARG A 429 -15.070 9.405 -4.351 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -13.847 12.674 -3.802 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -14.874 13.393 -5.046 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -16.386 10.327 -5.943 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -16.311 12.064 -6.258 1.00 3.05 H new ATOM 1719 N LEU A 430 -11.951 5.322 -1.529 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.188 4.120 -1.802 1.00 0.36 C ATOM 1721 C LEU A 430 -11.762 2.897 -1.100 1.00 0.39 C ATOM 1722 O LEU A 430 -11.854 1.817 -1.678 1.00 0.45 O ATOM 1723 CB LEU A 430 -9.760 4.353 -1.392 1.00 0.31 C ATOM 1724 CG LEU A 430 -8.909 4.979 -2.464 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.631 5.425 -1.840 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.648 3.993 -3.592 1.00 0.56 C ATOM 0 H LEU A 430 -11.526 5.937 -0.835 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.242 3.910 -2.870 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -9.746 4.994 -0.511 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.317 3.401 -1.100 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.427 5.834 -2.899 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -6.996 5.883 -2.599 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -7.843 6.153 -1.057 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.118 4.566 -1.408 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.031 4.468 -4.355 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.129 3.119 -3.198 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.596 3.685 -4.032 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.145 3.092 0.148 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.602 1.996 1.010 1.00 0.53 C ATOM 1740 C GLU A 431 -13.633 1.083 0.338 1.00 0.59 C ATOM 1741 O GLU A 431 -13.506 -0.140 0.390 1.00 0.72 O ATOM 1742 CB GLU A 431 -13.200 2.534 2.313 1.00 0.61 C ATOM 1743 CG GLU A 431 -12.221 3.271 3.206 1.00 0.73 C ATOM 1744 CD GLU A 431 -12.856 3.704 4.515 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -13.795 4.525 4.478 1.00 1.25 O ATOM 1746 OE2 GLU A 431 -12.442 3.204 5.585 1.00 1.31 O ATOM 0 H GLU A 431 -12.152 4.007 0.600 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.712 1.401 1.217 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -14.023 3.205 2.068 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -13.624 1.700 2.873 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -11.366 2.628 3.414 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -11.841 4.147 2.681 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.640 1.674 -0.295 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.760 0.902 -0.840 1.00 0.66 C ATOM 1755 C HIS A 432 -15.316 -0.093 -1.914 1.00 0.60 C ATOM 1756 O HIS A 432 -15.886 -1.174 -2.031 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.847 1.834 -1.388 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.524 2.482 -2.686 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -17.187 2.222 -3.866 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -15.614 3.412 -2.968 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -16.687 2.979 -4.821 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -15.728 3.716 -4.301 1.00 3.38 N ATOM 0 H HIS A 432 -14.708 2.681 -0.445 1.00 0.58 H new ATOM 0 HA HIS A 432 -16.174 0.321 -0.016 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -17.769 1.264 -1.503 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -17.043 2.612 -0.650 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -14.912 3.849 -2.273 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -17.008 2.993 -5.852 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -15.163 4.400 -4.805 1.00 3.38 H new ATOM 1771 N LEU A 433 -14.314 0.272 -2.701 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.796 -0.634 -3.728 1.00 0.53 C ATOM 1773 C LEU A 433 -12.748 -1.578 -3.145 1.00 0.54 C ATOM 1774 O LEU A 433 -12.679 -2.747 -3.513 1.00 0.67 O ATOM 1775 CB LEU A 433 -13.210 0.126 -4.924 1.00 0.60 C ATOM 1776 CG LEU A 433 -12.037 1.050 -4.622 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -10.943 0.898 -5.672 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.511 2.486 -4.573 1.00 0.88 C ATOM 0 H LEU A 433 -13.845 1.177 -2.653 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.642 -1.221 -4.087 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -12.890 -0.602 -5.670 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -14.005 0.718 -5.377 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.623 0.775 -3.652 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -10.116 1.568 -5.435 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.586 -0.132 -5.679 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -11.344 1.149 -6.654 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.667 3.141 -4.357 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -12.945 2.759 -5.535 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.264 2.594 -3.792 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.959 -1.071 -2.210 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.925 -1.869 -1.553 1.00 0.60 C ATOM 1792 C GLU A 434 -11.510 -2.854 -0.540 1.00 0.76 C ATOM 1793 O GLU A 434 -10.804 -3.366 0.331 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.899 -0.964 -0.883 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.926 -0.349 -1.868 1.00 0.63 C ATOM 1796 CD GLU A 434 -7.945 -1.359 -2.432 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -8.363 -2.496 -2.767 1.00 1.90 O ATOM 1798 OE2 GLU A 434 -6.748 -1.026 -2.510 1.00 1.36 O ATOM 0 H GLU A 434 -12.013 -0.106 -1.885 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.432 -2.457 -2.327 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -10.418 -0.169 -0.347 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -9.344 -1.539 -0.142 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -9.483 0.106 -2.687 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -8.374 0.451 -1.375 1.00 0.63 H new ATOM 1805 N SER A 435 -12.799 -3.126 -0.667 1.00 0.72 N ATOM 1806 CA SER A 435 -13.456 -4.125 0.151 1.00 0.89 C ATOM 1807 C SER A 435 -13.491 -5.427 -0.626 1.00 1.03 C ATOM 1808 O SER A 435 -13.798 -6.498 -0.097 1.00 1.20 O ATOM 1809 CB SER A 435 -14.872 -3.672 0.492 1.00 0.97 C ATOM 1810 OG SER A 435 -15.624 -3.433 -0.683 1.00 1.47 O ATOM 0 H SER A 435 -13.413 -2.662 -1.336 1.00 0.72 H new ATOM 0 HA SER A 435 -12.911 -4.265 1.085 1.00 0.89 H new ATOM 0 HB2 SER A 435 -15.366 -4.433 1.096 1.00 0.97 H new ATOM 0 HB3 SER A 435 -14.832 -2.764 1.094 1.00 0.97 H new ATOM 0 HG SER A 435 -15.358 -2.574 -1.073 1.00 1.47 H new ATOM 1816 N GLN A 436 -13.169 -5.302 -1.902 1.00 1.04 N ATOM 1817 CA GLN A 436 -13.181 -6.411 -2.820 1.00 1.24 C ATOM 1818 C GLN A 436 -11.760 -6.915 -3.034 1.00 1.47 C ATOM 1819 O GLN A 436 -11.338 -7.816 -2.286 1.00 1.78 O ATOM 1820 CB GLN A 436 -13.805 -5.955 -4.136 1.00 1.17 C ATOM 1821 CG GLN A 436 -15.102 -5.187 -3.946 1.00 1.30 C ATOM 1822 CD GLN A 436 -15.789 -4.844 -5.251 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -15.532 -3.801 -5.853 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -16.685 -5.712 -5.682 1.00 2.60 N ATOM 1825 OXT GLN A 436 -11.057 -6.380 -3.918 1.00 2.10 O ATOM 0 H GLN A 436 -12.891 -4.417 -2.327 1.00 1.04 H new ATOM 0 HA GLN A 436 -13.773 -7.231 -2.414 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -13.093 -5.327 -4.671 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -13.994 -6.826 -4.763 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -15.780 -5.778 -3.330 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -14.895 -4.267 -3.399 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -16.866 -6.564 -5.151 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -17.196 -5.531 -6.546 1.00 2.60 H new TER 1834 GLN A 436