USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=29 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= -2.93 K(o=-2.9,f=-1.7) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.135) USER MOD Set 2.1: A 380 LYS NZ :NH3+ -149:sc= 1.7 (180deg=0.44) USER MOD Set 2.2: A 436 GLN : amide:sc= 0.972 K(o=2.7,f=-3.7) USER MOD Set 3.1: A 342 TYR OH : rot 121:sc= -0.893! USER MOD Set 3.2: A 362 LYS NZ :NH3+ 176:sc= -0.411 (180deg=-0.468) USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 333 HIS : no HE2:sc= 1.05 K(o=1,f=-5.2!) USER MOD Single : A 334 MET CE :methyl -112:sc= -0.179 (180deg=-0.947) USER MOD Single : A 340 TYR OH : rot 117:sc= -0.0587 USER MOD Single : A 343 GLN : amide:sc= -0.971! C(o=-0.97!,f=-1.6!) USER MOD Single : A 346 SER OG : rot -36:sc= 0.499 USER MOD Single : A 348 SER OG : rot 180:sc= 0.17 USER MOD Single : A 350 TYR OH : rot 180:sc= 0.492 USER MOD Single : A 352 ASN : amide:sc= -0.0088 X(o=-0.0088,f=-0.0088) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 83:sc= 0.949 USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.286 K(o=-0.29,f=-1.7!) USER MOD Single : A 379 HIS : no HD1:sc= -0.0378 K(o=-0.038,f=-0.85) USER MOD Single : A 381 ASN : amide:sc=-0.00858 X(o=-0.0086,f=0) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= -1.17! K(o=-1.2!,f=-0.032) USER MOD Single : A 385 MET CE :methyl 144:sc= -5.81! (180deg=-6.56!) USER MOD Single : A 386 THR OG1 : rot -138:sc= -1.88! USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 LYS NZ :NH3+ 163:sc= 1.31 (180deg=1.14) USER MOD Single : A 390 MET CE :methyl -168:sc= -0.323 (180deg=-0.662) USER MOD Single : A 391 SER OG : rot 6:sc= -0.511! USER MOD Single : A 397 TYR OH : rot -17:sc= -0.848! USER MOD Single : A 398 TYR OH : rot -16:sc= 0.215 USER MOD Single : A 401 ASN : amide:sc=-0.00278 X(o=-0.0028,f=-0.024) USER MOD Single : A 405 LYS NZ :NH3+ 173:sc= 1.02 (180deg=0.894) USER MOD Single : A 409 GLN : amide:sc= -3.19! K(o=-3.2!,f=-1.5) USER MOD Single : A 416 MET CE :methyl -161:sc= -0.141 (180deg=-0.625) USER MOD Single : A 417 LYS NZ :NH3+ -126:sc= -1.15 (180deg=-2.79!) USER MOD Single : A 418 THR OG1 : rot -73:sc= 1.27 USER MOD Single : A 423 MET CE :methyl -172:sc= 0 (180deg=-0.0992) USER MOD Single : A 424 SER OG : rot -53:sc= 0.181 USER MOD Single : A 427 THR OG1 : rot -33:sc= 0.0909 USER MOD Single : A 432 HIS : no HD1:sc= -6.3! K(o=-6.3!,f=-2.1) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -14.489 -7.436 10.374 1.00 6.78 N ATOM 2 CA GLY A 331 -13.487 -6.397 10.719 1.00 6.11 C ATOM 3 C GLY A 331 -14.127 -5.045 10.930 1.00 5.22 C ATOM 4 O GLY A 331 -15.300 -4.860 10.607 1.00 5.14 O ATOM 0 HA2 GLY A 331 -12.955 -6.692 11.623 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -12.747 -6.328 9.922 1.00 6.11 H new ATOM 10 N SER A 332 -13.366 -4.105 11.477 1.00 4.99 N ATOM 11 CA SER A 332 -13.860 -2.754 11.705 1.00 4.63 C ATOM 12 C SER A 332 -14.127 -2.057 10.373 1.00 3.82 C ATOM 13 O SER A 332 -15.267 -1.722 10.056 1.00 4.13 O ATOM 14 CB SER A 332 -12.852 -1.961 12.536 1.00 5.44 C ATOM 15 OG SER A 332 -12.529 -2.650 13.733 1.00 6.08 O ATOM 0 H SER A 332 -12.401 -4.255 11.772 1.00 4.99 H new ATOM 0 HA SER A 332 -14.798 -2.808 12.257 1.00 4.63 H new ATOM 0 HB2 SER A 332 -11.947 -1.793 11.953 1.00 5.44 H new ATOM 0 HB3 SER A 332 -13.264 -0.981 12.776 1.00 5.44 H new ATOM 0 HG SER A 332 -11.881 -2.125 14.248 1.00 6.08 H new ATOM 21 N HIS A 333 -13.077 -1.850 9.589 1.00 3.28 N ATOM 22 CA HIS A 333 -13.237 -1.284 8.256 1.00 2.94 C ATOM 23 C HIS A 333 -12.340 -2.009 7.258 1.00 2.02 C ATOM 24 O HIS A 333 -12.464 -1.811 6.050 1.00 2.49 O ATOM 25 CB HIS A 333 -12.949 0.232 8.251 1.00 3.89 C ATOM 26 CG HIS A 333 -11.502 0.610 8.059 1.00 4.68 C ATOM 27 ND1 HIS A 333 -11.049 1.275 6.940 1.00 5.34 N ATOM 28 CD2 HIS A 333 -10.414 0.419 8.845 1.00 5.35 C ATOM 29 CE1 HIS A 333 -9.750 1.474 7.042 1.00 6.24 C ATOM 30 NE2 HIS A 333 -9.337 0.967 8.189 1.00 6.26 N ATOM 0 H HIS A 333 -12.114 -2.063 9.850 1.00 3.28 H new ATOM 0 HA HIS A 333 -14.275 -1.423 7.954 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -13.537 0.695 7.458 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -13.296 0.655 9.194 1.00 3.89 H new ATOM 0 HD1 HIS A 333 -11.629 1.568 6.154 1.00 5.34 H new ATOM 0 HD2 HIS A 333 -10.396 -0.072 9.807 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -9.128 1.969 6.310 1.00 6.24 H new ATOM 39 N MET A 334 -11.449 -2.859 7.791 1.00 1.20 N ATOM 40 CA MET A 334 -10.460 -3.590 6.995 1.00 0.62 C ATOM 41 C MET A 334 -9.403 -2.640 6.439 1.00 0.57 C ATOM 42 O MET A 334 -9.703 -1.518 6.038 1.00 0.92 O ATOM 43 CB MET A 334 -11.121 -4.392 5.861 1.00 1.35 C ATOM 44 CG MET A 334 -11.765 -5.698 6.316 1.00 2.01 C ATOM 45 SD MET A 334 -13.202 -5.467 7.386 1.00 3.03 S ATOM 46 CE MET A 334 -14.345 -4.668 6.260 1.00 3.71 C ATOM 0 H MET A 334 -11.397 -3.057 8.790 1.00 1.20 H new ATOM 0 HA MET A 334 -9.970 -4.303 7.658 1.00 0.62 H new ATOM 0 HB2 MET A 334 -11.880 -3.771 5.386 1.00 1.35 H new ATOM 0 HB3 MET A 334 -10.371 -4.614 5.102 1.00 1.35 H new ATOM 0 HG2 MET A 334 -12.065 -6.270 5.438 1.00 2.01 H new ATOM 0 HG3 MET A 334 -11.021 -6.294 6.845 1.00 2.01 H new ATOM 0 HE1 MET A 334 -14.507 -3.637 6.576 1.00 3.71 H new ATOM 0 HE2 MET A 334 -13.930 -4.678 5.252 1.00 3.71 H new ATOM 0 HE3 MET A 334 -15.295 -5.202 6.266 1.00 3.71 H new ATOM 56 N ARG A 335 -8.155 -3.083 6.449 1.00 0.40 N ATOM 57 CA ARG A 335 -7.061 -2.265 5.946 1.00 0.32 C ATOM 58 C ARG A 335 -7.139 -2.131 4.437 1.00 0.28 C ATOM 59 O ARG A 335 -7.318 -3.122 3.729 1.00 0.42 O ATOM 60 CB ARG A 335 -5.706 -2.852 6.332 1.00 0.37 C ATOM 61 CG ARG A 335 -5.531 -3.013 7.823 1.00 0.56 C ATOM 62 CD ARG A 335 -4.076 -3.175 8.187 1.00 0.93 C ATOM 63 NE ARG A 335 -3.878 -3.174 9.634 1.00 1.32 N ATOM 64 CZ ARG A 335 -3.795 -4.277 10.378 1.00 2.05 C ATOM 65 NH1 ARG A 335 -3.899 -5.474 9.815 1.00 2.81 N ATOM 66 NH2 ARG A 335 -3.611 -4.180 11.687 1.00 2.51 N ATOM 0 H ARG A 335 -7.875 -4.000 6.798 1.00 0.40 H new ATOM 0 HA ARG A 335 -7.158 -1.279 6.401 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.588 -3.823 5.852 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.915 -2.208 5.947 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -5.942 -2.144 8.336 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -6.093 -3.881 8.166 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.698 -4.108 7.769 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.497 -2.367 7.740 1.00 0.93 H new ATOM 0 HE ARG A 335 -3.798 -2.273 10.105 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -4.043 -5.553 8.808 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -3.835 -6.315 10.389 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -3.533 -3.262 12.124 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -3.547 -5.024 12.257 1.00 2.51 H new ATOM 80 N LEU A 336 -7.031 -0.896 3.962 1.00 0.23 N ATOM 81 CA LEU A 336 -6.889 -0.623 2.537 1.00 0.28 C ATOM 82 C LEU A 336 -5.571 -1.166 2.052 1.00 0.14 C ATOM 83 O LEU A 336 -4.793 -1.673 2.845 1.00 0.20 O ATOM 84 CB LEU A 336 -6.926 0.880 2.247 1.00 0.48 C ATOM 85 CG LEU A 336 -8.267 1.571 2.446 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.581 2.414 1.235 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.358 0.560 2.683 1.00 0.67 C ATOM 0 H LEU A 336 -7.039 -0.061 4.548 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.722 -1.102 2.022 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -6.190 1.370 2.885 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.609 1.038 1.216 1.00 0.48 H new ATOM 0 HG LEU A 336 -8.209 2.213 3.325 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.541 2.910 1.376 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.801 3.164 1.102 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.627 1.778 0.351 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.308 1.076 2.823 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.430 -0.106 1.823 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -9.127 -0.022 3.575 1.00 0.67 H new ATOM 99 N LEU A 337 -5.292 -1.044 0.775 1.00 0.15 N ATOM 100 CA LEU A 337 -4.029 -1.523 0.263 1.00 0.12 C ATOM 101 C LEU A 337 -2.885 -0.748 0.915 1.00 0.11 C ATOM 102 O LEU A 337 -1.936 -1.346 1.419 1.00 0.12 O ATOM 103 CB LEU A 337 -4.012 -1.419 -1.264 1.00 0.14 C ATOM 104 CG LEU A 337 -2.808 -2.026 -1.971 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.707 -1.006 -2.073 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.316 -3.266 -1.248 1.00 0.15 C ATOM 0 H LEU A 337 -5.911 -0.624 0.081 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.896 -2.575 0.514 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.912 -1.899 -1.649 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -4.072 -0.365 -1.535 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.113 -2.324 -2.974 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.849 -1.447 -2.580 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.060 -0.145 -2.640 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.413 -0.686 -1.073 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.456 -3.678 -1.776 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -2.026 -3.003 -0.231 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -3.113 -4.009 -1.217 1.00 0.15 H new ATOM 118 N TRP A 338 -3.001 0.574 0.971 1.00 0.12 N ATOM 119 CA TRP A 338 -1.997 1.382 1.663 1.00 0.14 C ATOM 120 C TRP A 338 -2.101 1.200 3.179 1.00 0.14 C ATOM 121 O TRP A 338 -1.087 1.207 3.876 1.00 0.17 O ATOM 122 CB TRP A 338 -2.100 2.872 1.295 1.00 0.16 C ATOM 123 CG TRP A 338 -3.375 3.539 1.723 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.472 3.765 0.952 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.680 4.078 3.016 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.441 4.397 1.680 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.981 4.600 2.950 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.981 4.164 4.221 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.598 5.197 4.038 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.595 4.754 5.303 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.895 5.266 5.206 1.00 0.21 C ATOM 0 H TRP A 338 -3.766 1.105 0.554 1.00 0.12 H new ATOM 0 HA TRP A 338 -1.020 1.028 1.332 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.260 3.402 1.745 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.999 2.973 0.214 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.564 3.485 -0.087 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.359 4.672 1.331 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.977 3.775 4.303 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.600 5.594 3.964 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -3.066 4.823 6.242 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.350 5.724 6.072 1.00 0.21 H new ATOM 142 N ASP A 339 -3.325 1.028 3.683 1.00 0.14 N ATOM 143 CA ASP A 339 -3.545 0.823 5.121 1.00 0.17 C ATOM 144 C ASP A 339 -2.880 -0.476 5.543 1.00 0.16 C ATOM 145 O ASP A 339 -2.395 -0.630 6.666 1.00 0.23 O ATOM 146 CB ASP A 339 -5.048 0.765 5.443 1.00 0.23 C ATOM 147 CG ASP A 339 -5.339 0.957 6.923 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.881 1.961 7.504 1.00 0.86 O ATOM 149 OD2 ASP A 339 -6.027 0.103 7.513 1.00 1.15 O ATOM 0 H ASP A 339 -4.177 1.026 3.122 1.00 0.14 H new ATOM 0 HA ASP A 339 -3.112 1.661 5.668 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.568 1.534 4.872 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.448 -0.196 5.120 1.00 0.23 H new ATOM 154 N TYR A 340 -2.868 -1.397 4.601 1.00 0.11 N ATOM 155 CA TYR A 340 -2.277 -2.706 4.763 1.00 0.10 C ATOM 156 C TYR A 340 -0.752 -2.627 4.758 1.00 0.08 C ATOM 157 O TYR A 340 -0.102 -3.183 5.642 1.00 0.09 O ATOM 158 CB TYR A 340 -2.753 -3.593 3.622 1.00 0.11 C ATOM 159 CG TYR A 340 -2.518 -5.046 3.859 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.945 -5.642 5.029 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.879 -5.823 2.913 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.741 -6.977 5.258 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.667 -7.162 3.129 1.00 0.14 C ATOM 164 CZ TYR A 340 -2.102 -7.741 4.307 1.00 0.16 C ATOM 165 OH TYR A 340 -1.891 -9.081 4.536 1.00 0.20 O ATOM 0 H TYR A 340 -3.280 -1.250 3.679 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.584 -3.121 5.723 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.819 -3.427 3.464 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.244 -3.296 2.705 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.448 -5.046 5.776 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.542 -5.372 1.992 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -3.079 -7.428 6.179 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.164 -7.760 2.383 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.379 -9.608 3.869 1.00 0.20 H new ATOM 175 N VAL A 341 -0.180 -1.933 3.765 1.00 0.08 N ATOM 176 CA VAL A 341 1.279 -1.878 3.630 1.00 0.07 C ATOM 177 C VAL A 341 1.911 -1.281 4.876 1.00 0.08 C ATOM 178 O VAL A 341 2.987 -1.689 5.269 1.00 0.08 O ATOM 179 CB VAL A 341 1.772 -1.083 2.384 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.005 -1.457 1.138 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.741 0.422 2.596 1.00 0.09 C ATOM 0 H VAL A 341 -0.695 -1.411 3.056 1.00 0.08 H new ATOM 0 HA VAL A 341 1.593 -2.913 3.496 1.00 0.07 H new ATOM 0 HB VAL A 341 2.814 -1.369 2.243 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.380 -0.880 0.293 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.134 -2.521 0.937 1.00 0.07 H new ATOM 0 HG13 VAL A 341 -0.053 -1.241 1.284 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.095 0.924 1.695 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.720 0.738 2.810 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.386 0.685 3.435 1.00 0.09 H new ATOM 191 N TYR A 342 1.231 -0.323 5.497 1.00 0.08 N ATOM 192 CA TYR A 342 1.717 0.277 6.745 1.00 0.10 C ATOM 193 C TYR A 342 1.932 -0.777 7.826 1.00 0.11 C ATOM 194 O TYR A 342 2.880 -0.688 8.608 1.00 0.14 O ATOM 195 CB TYR A 342 0.747 1.334 7.284 1.00 0.11 C ATOM 196 CG TYR A 342 1.032 2.741 6.823 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.174 3.405 7.251 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.153 3.416 5.994 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.436 4.702 6.855 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.412 4.708 5.591 1.00 0.19 C ATOM 201 CZ TYR A 342 1.555 5.347 6.024 1.00 0.17 C ATOM 202 OH TYR A 342 1.810 6.643 5.636 1.00 0.21 O ATOM 0 H TYR A 342 0.345 0.057 5.163 1.00 0.08 H new ATOM 0 HA TYR A 342 2.668 0.751 6.502 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.266 1.065 6.984 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.773 1.310 8.373 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.869 2.899 7.905 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.748 2.924 5.659 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.328 5.205 7.197 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.279 5.219 4.937 1.00 0.19 H new ATOM 0 HH TYR A 342 1.874 6.685 4.659 1.00 0.21 H new ATOM 212 N GLN A 343 1.061 -1.780 7.861 1.00 0.12 N ATOM 213 CA GLN A 343 1.140 -2.811 8.872 1.00 0.18 C ATOM 214 C GLN A 343 2.274 -3.756 8.512 1.00 0.18 C ATOM 215 O GLN A 343 2.979 -4.278 9.374 1.00 0.25 O ATOM 216 CB GLN A 343 -0.205 -3.556 8.962 1.00 0.28 C ATOM 217 CG GLN A 343 -0.205 -4.930 8.329 1.00 0.55 C ATOM 218 CD GLN A 343 -0.085 -6.041 9.357 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.083 -6.614 9.791 1.00 1.40 O ATOM 220 NE2 GLN A 343 1.129 -6.320 9.790 1.00 1.15 N ATOM 0 H GLN A 343 0.295 -1.895 7.198 1.00 0.12 H new ATOM 0 HA GLN A 343 1.342 -2.373 9.850 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.482 -3.653 10.012 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.974 -2.950 8.484 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.124 -5.064 7.759 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.622 -5.002 7.622 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.934 -5.824 9.407 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.263 -7.032 10.508 1.00 1.15 H new ATOM 229 N LEU A 344 2.444 -3.955 7.214 1.00 0.15 N ATOM 230 CA LEU A 344 3.479 -4.820 6.699 1.00 0.16 C ATOM 231 C LEU A 344 4.837 -4.139 6.846 1.00 0.18 C ATOM 232 O LEU A 344 5.853 -4.773 7.107 1.00 0.27 O ATOM 233 CB LEU A 344 3.182 -5.115 5.230 1.00 0.13 C ATOM 234 CG LEU A 344 1.768 -5.630 4.948 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.517 -5.670 3.460 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.559 -7.006 5.546 1.00 0.18 C ATOM 0 H LEU A 344 1.867 -3.520 6.494 1.00 0.15 H new ATOM 0 HA LEU A 344 3.503 -5.756 7.258 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.343 -4.205 4.652 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.900 -5.852 4.870 1.00 0.13 H new ATOM 0 HG LEU A 344 1.059 -4.945 5.414 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.508 -6.038 3.271 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.621 -4.667 3.046 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.240 -6.334 2.987 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.546 -7.347 5.330 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.276 -7.703 5.113 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.704 -6.959 6.625 1.00 0.18 H new ATOM 248 N LEU A 345 4.802 -2.826 6.695 1.00 0.12 N ATOM 249 CA LEU A 345 5.970 -1.960 6.796 1.00 0.13 C ATOM 250 C LEU A 345 6.504 -1.926 8.224 1.00 0.19 C ATOM 251 O LEU A 345 7.696 -1.726 8.450 1.00 0.29 O ATOM 252 CB LEU A 345 5.575 -0.543 6.352 1.00 0.10 C ATOM 253 CG LEU A 345 6.040 -0.103 4.955 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.351 -1.292 4.071 1.00 0.12 C ATOM 255 CD2 LEU A 345 4.983 0.768 4.291 1.00 0.10 C ATOM 0 H LEU A 345 3.941 -2.318 6.494 1.00 0.12 H new ATOM 0 HA LEU A 345 6.758 -2.350 6.152 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.488 -0.465 6.389 1.00 0.10 H new ATOM 0 HB3 LEU A 345 5.970 0.165 7.081 1.00 0.10 H new ATOM 0 HG LEU A 345 6.955 0.475 5.083 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.677 -0.942 3.091 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.144 -1.886 4.526 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.457 -1.905 3.958 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.329 1.070 3.303 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.055 0.204 4.194 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.806 1.654 4.900 1.00 0.10 H new ATOM 267 N SER A 346 5.614 -2.135 9.182 1.00 0.25 N ATOM 268 CA SER A 346 5.968 -2.031 10.586 1.00 0.33 C ATOM 269 C SER A 346 6.345 -3.392 11.171 1.00 0.30 C ATOM 270 O SER A 346 6.697 -3.493 12.349 1.00 0.53 O ATOM 271 CB SER A 346 4.806 -1.423 11.375 1.00 0.51 C ATOM 272 OG SER A 346 5.157 -1.227 12.735 1.00 1.43 O ATOM 0 H SER A 346 4.638 -2.378 9.010 1.00 0.25 H new ATOM 0 HA SER A 346 6.839 -1.381 10.665 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.520 -0.470 10.930 1.00 0.51 H new ATOM 0 HB3 SER A 346 3.937 -2.078 11.312 1.00 0.51 H new ATOM 0 HG SER A 346 5.741 -1.956 13.030 1.00 1.43 H new ATOM 278 N ASP A 347 6.271 -4.439 10.359 1.00 0.32 N ATOM 279 CA ASP A 347 6.582 -5.778 10.838 1.00 0.32 C ATOM 280 C ASP A 347 7.613 -6.445 9.952 1.00 0.30 C ATOM 281 O ASP A 347 7.529 -6.422 8.726 1.00 0.30 O ATOM 282 CB ASP A 347 5.317 -6.633 10.928 1.00 0.35 C ATOM 283 CG ASP A 347 5.517 -7.870 11.783 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.322 -8.740 11.390 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.861 -7.988 12.837 1.00 0.67 O ATOM 0 H ASP A 347 6.001 -4.388 9.377 1.00 0.32 H new ATOM 0 HA ASP A 347 7.003 -5.685 11.839 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.506 -6.035 11.343 1.00 0.35 H new ATOM 0 HB3 ASP A 347 5.012 -6.933 9.925 1.00 0.35 H new ATOM 290 N SER A 348 8.564 -7.070 10.607 1.00 0.34 N ATOM 291 CA SER A 348 9.740 -7.607 9.971 1.00 0.35 C ATOM 292 C SER A 348 9.441 -8.843 9.134 1.00 0.31 C ATOM 293 O SER A 348 10.148 -9.136 8.170 1.00 0.32 O ATOM 294 CB SER A 348 10.734 -7.943 11.057 1.00 0.46 C ATOM 295 OG SER A 348 10.092 -7.997 12.325 1.00 1.53 O ATOM 0 H SER A 348 8.539 -7.221 11.615 1.00 0.34 H new ATOM 0 HA SER A 348 10.139 -6.862 9.283 1.00 0.35 H new ATOM 0 HB2 SER A 348 11.206 -8.902 10.841 1.00 0.46 H new ATOM 0 HB3 SER A 348 11.526 -7.195 11.076 1.00 0.46 H new ATOM 0 HG SER A 348 10.751 -8.218 13.016 1.00 1.53 H new ATOM 301 N ARG A 349 8.399 -9.567 9.496 1.00 0.33 N ATOM 302 CA ARG A 349 8.045 -10.783 8.774 1.00 0.35 C ATOM 303 C ARG A 349 7.661 -10.481 7.328 1.00 0.29 C ATOM 304 O ARG A 349 7.682 -11.365 6.473 1.00 0.34 O ATOM 305 CB ARG A 349 6.925 -11.533 9.461 1.00 0.42 C ATOM 306 CG ARG A 349 5.577 -10.875 9.374 1.00 0.55 C ATOM 307 CD ARG A 349 4.586 -11.694 10.153 1.00 0.59 C ATOM 308 NE ARG A 349 4.327 -12.993 9.524 1.00 1.23 N ATOM 309 CZ ARG A 349 3.155 -13.369 9.004 1.00 1.67 C ATOM 310 NH1 ARG A 349 2.110 -12.553 9.021 1.00 1.93 N ATOM 311 NH2 ARG A 349 3.030 -14.578 8.469 1.00 2.56 N ATOM 0 H ARG A 349 7.785 -9.340 10.278 1.00 0.33 H new ATOM 0 HA ARG A 349 8.931 -11.417 8.772 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.855 -12.530 9.027 1.00 0.42 H new ATOM 0 HB3 ARG A 349 7.184 -11.661 10.512 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.625 -9.862 9.773 1.00 0.55 H new ATOM 0 HG3 ARG A 349 5.264 -10.793 8.333 1.00 0.55 H new ATOM 0 HD2 ARG A 349 4.961 -11.850 11.164 1.00 0.59 H new ATOM 0 HD3 ARG A 349 3.650 -11.142 10.242 1.00 0.59 H new ATOM 0 HE ARG A 349 5.099 -13.659 9.480 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.195 -11.625 9.435 1.00 1.93 H new ATOM 0 HH12 ARG A 349 1.222 -12.854 8.620 1.00 1.93 H new ATOM 0 HH21 ARG A 349 3.827 -15.215 8.456 1.00 2.56 H new ATOM 0 HH22 ARG A 349 2.137 -14.870 8.071 1.00 2.56 H new ATOM 325 N TYR A 350 7.321 -9.227 7.054 1.00 0.22 N ATOM 326 CA TYR A 350 6.896 -8.835 5.724 1.00 0.17 C ATOM 327 C TYR A 350 7.976 -8.049 5.013 1.00 0.16 C ATOM 328 O TYR A 350 7.819 -7.710 3.845 1.00 0.15 O ATOM 329 CB TYR A 350 5.647 -7.969 5.784 1.00 0.17 C ATOM 330 CG TYR A 350 4.555 -8.499 6.661 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.841 -9.630 6.312 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.215 -7.837 7.825 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.814 -10.090 7.097 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.197 -8.288 8.625 1.00 0.28 C ATOM 335 CZ TYR A 350 2.491 -9.416 8.260 1.00 0.31 C ATOM 336 OH TYR A 350 1.463 -9.871 9.057 1.00 0.39 O ATOM 0 H TYR A 350 7.333 -8.469 7.736 1.00 0.22 H new ATOM 0 HA TYR A 350 6.687 -9.755 5.177 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.927 -6.976 6.137 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.256 -7.850 4.774 1.00 0.17 H new ATOM 0 HD1 TYR A 350 4.096 -10.160 5.406 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.760 -6.949 8.110 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.262 -10.972 6.808 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.949 -7.763 9.536 1.00 0.28 H new ATOM 0 HH TYR A 350 1.368 -9.284 9.836 1.00 0.39 H new ATOM 346 N GLU A 351 9.077 -7.771 5.702 1.00 0.18 N ATOM 347 CA GLU A 351 10.108 -6.898 5.146 1.00 0.21 C ATOM 348 C GLU A 351 10.795 -7.535 3.934 1.00 0.21 C ATOM 349 O GLU A 351 11.581 -6.891 3.244 1.00 0.24 O ATOM 350 CB GLU A 351 11.131 -6.506 6.215 1.00 0.28 C ATOM 351 CG GLU A 351 12.148 -7.580 6.523 1.00 0.48 C ATOM 352 CD GLU A 351 13.219 -7.100 7.478 1.00 0.99 C ATOM 353 OE1 GLU A 351 14.173 -6.430 7.028 1.00 1.05 O ATOM 354 OE2 GLU A 351 13.112 -7.389 8.687 1.00 1.78 O ATOM 0 H GLU A 351 9.279 -8.131 6.635 1.00 0.18 H new ATOM 0 HA GLU A 351 9.615 -5.989 4.801 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.655 -5.608 5.888 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.601 -6.250 7.132 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.642 -8.444 6.953 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.614 -7.913 5.595 1.00 0.48 H new ATOM 361 N ASN A 352 10.484 -8.800 3.674 1.00 0.19 N ATOM 362 CA ASN A 352 10.971 -9.472 2.477 1.00 0.21 C ATOM 363 C ASN A 352 10.005 -9.246 1.317 1.00 0.16 C ATOM 364 O ASN A 352 10.357 -9.444 0.163 1.00 0.18 O ATOM 365 CB ASN A 352 11.148 -10.969 2.730 1.00 0.27 C ATOM 366 CG ASN A 352 11.819 -11.690 1.571 1.00 1.03 C ATOM 367 OD1 ASN A 352 13.045 -11.718 1.470 1.00 1.83 O ATOM 368 ND2 ASN A 352 11.022 -12.301 0.706 1.00 1.62 N ATOM 0 H ASN A 352 9.898 -9.379 4.275 1.00 0.19 H new ATOM 0 HA ASN A 352 11.942 -9.050 2.218 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.742 -11.112 3.633 1.00 0.27 H new ATOM 0 HB3 ASN A 352 10.173 -11.419 2.915 1.00 0.27 H new ATOM 0 HD21 ASN A 352 11.421 -12.818 -0.078 1.00 1.62 H new ATOM 0 HD22 ASN A 352 10.010 -12.254 0.824 1.00 1.62 H new ATOM 375 N PHE A 353 8.784 -8.835 1.638 1.00 0.13 N ATOM 376 CA PHE A 353 7.775 -8.532 0.632 1.00 0.10 C ATOM 377 C PHE A 353 7.664 -7.026 0.417 1.00 0.08 C ATOM 378 O PHE A 353 7.336 -6.565 -0.673 1.00 0.07 O ATOM 379 CB PHE A 353 6.408 -9.064 1.059 1.00 0.09 C ATOM 380 CG PHE A 353 6.386 -10.523 1.397 1.00 0.12 C ATOM 381 CD1 PHE A 353 7.066 -11.442 0.625 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.689 -10.968 2.504 1.00 0.13 C ATOM 383 CE1 PHE A 353 7.055 -12.782 0.944 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.676 -12.307 2.836 1.00 0.17 C ATOM 385 CZ PHE A 353 6.359 -13.216 2.052 1.00 0.18 C ATOM 0 H PHE A 353 8.467 -8.703 2.598 1.00 0.13 H new ATOM 0 HA PHE A 353 8.083 -9.014 -0.296 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.067 -8.498 1.926 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.694 -8.879 0.257 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.615 -11.106 -0.242 1.00 0.17 H new ATOM 0 HD2 PHE A 353 5.149 -10.260 3.116 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.590 -13.490 0.328 1.00 0.19 H new ATOM 0 HE2 PHE A 353 5.133 -12.644 3.707 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.348 -14.265 2.307 1.00 0.18 H new ATOM 395 N ILE A 354 7.953 -6.272 1.462 1.00 0.08 N ATOM 396 CA ILE A 354 7.802 -4.826 1.447 1.00 0.07 C ATOM 397 C ILE A 354 8.507 -4.255 2.670 1.00 0.08 C ATOM 398 O ILE A 354 8.585 -4.918 3.699 1.00 0.10 O ATOM 399 CB ILE A 354 6.308 -4.434 1.464 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.106 -2.966 1.092 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.705 -4.719 2.831 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.655 -2.534 1.130 1.00 0.07 C ATOM 0 H ILE A 354 8.299 -6.644 2.346 1.00 0.08 H new ATOM 0 HA ILE A 354 8.244 -4.422 0.536 1.00 0.07 H new ATOM 0 HB ILE A 354 5.798 -5.039 0.714 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.682 -2.342 1.776 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.503 -2.794 0.092 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.652 -4.438 2.830 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.797 -5.782 3.055 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.233 -4.141 3.589 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.581 -1.482 0.856 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.078 -3.134 0.426 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.260 -2.675 2.136 1.00 0.07 H new ATOM 414 N ARG A 355 9.037 -3.056 2.564 1.00 0.09 N ATOM 415 CA ARG A 355 9.796 -2.489 3.671 1.00 0.11 C ATOM 416 C ARG A 355 9.921 -0.984 3.537 1.00 0.10 C ATOM 417 O ARG A 355 9.942 -0.448 2.430 1.00 0.14 O ATOM 418 CB ARG A 355 11.199 -3.098 3.723 1.00 0.16 C ATOM 419 CG ARG A 355 12.130 -2.544 2.661 1.00 0.22 C ATOM 420 CD ARG A 355 13.518 -3.136 2.769 1.00 0.25 C ATOM 421 NE ARG A 355 14.491 -2.381 1.988 1.00 0.98 N ATOM 422 CZ ARG A 355 15.710 -2.814 1.688 1.00 1.40 C ATOM 423 NH1 ARG A 355 16.126 -3.995 2.127 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.516 -2.047 0.966 1.00 2.08 N ATOM 0 H ARG A 355 8.962 -2.459 1.740 1.00 0.09 H new ATOM 0 HA ARG A 355 9.257 -2.721 4.589 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.631 -2.916 4.707 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.124 -4.179 3.603 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.721 -2.754 1.673 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.188 -1.460 2.758 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.826 -3.153 3.815 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.500 -4.170 2.425 1.00 0.25 H new ATOM 0 HE ARG A 355 14.217 -1.459 1.650 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.509 -4.574 2.697 1.00 1.43 H new ATOM 0 HH12 ARG A 355 17.063 -4.324 1.895 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.198 -1.132 0.646 1.00 2.08 H new ATOM 0 HH22 ARG A 355 17.454 -2.372 0.731 1.00 2.08 H new ATOM 438 N TRP A 356 9.997 -0.313 4.673 1.00 0.10 N ATOM 439 CA TRP A 356 10.319 1.101 4.701 1.00 0.09 C ATOM 440 C TRP A 356 11.743 1.332 4.207 1.00 0.09 C ATOM 441 O TRP A 356 12.694 0.766 4.743 1.00 0.14 O ATOM 442 CB TRP A 356 10.225 1.659 6.118 1.00 0.10 C ATOM 443 CG TRP A 356 8.841 1.851 6.659 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.339 1.326 7.814 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.793 2.649 6.093 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.051 1.759 8.008 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.694 2.566 6.963 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.677 3.425 4.937 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.499 3.232 6.718 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.492 4.085 4.693 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.417 3.988 5.578 1.00 0.13 C ATOM 0 H TRP A 356 9.839 -0.728 5.591 1.00 0.10 H new ATOM 0 HA TRP A 356 9.601 1.606 4.055 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.765 0.989 6.787 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.740 2.619 6.144 1.00 0.10 H new ATOM 0 HD1 TRP A 356 8.877 0.666 8.479 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.457 1.518 8.802 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.503 3.506 4.246 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.666 3.156 7.401 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.394 4.687 3.802 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.502 4.519 5.360 1.00 0.13 H new ATOM 462 N GLU A 357 11.877 2.158 3.188 1.00 0.10 N ATOM 463 CA GLU A 357 13.179 2.639 2.759 1.00 0.12 C ATOM 464 C GLU A 357 13.529 3.858 3.589 1.00 0.14 C ATOM 465 O GLU A 357 14.679 4.079 3.963 1.00 0.21 O ATOM 466 CB GLU A 357 13.157 3.000 1.283 1.00 0.16 C ATOM 467 CG GLU A 357 13.108 1.798 0.362 1.00 0.25 C ATOM 468 CD GLU A 357 14.398 1.012 0.352 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.573 0.148 1.234 1.00 0.61 O ATOM 470 OE2 GLU A 357 15.242 1.261 -0.525 1.00 0.78 O ATOM 0 H GLU A 357 11.095 2.513 2.637 1.00 0.10 H new ATOM 0 HA GLU A 357 13.926 1.858 2.900 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.292 3.633 1.086 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.043 3.590 1.049 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.292 1.144 0.670 1.00 0.25 H new ATOM 0 HG3 GLU A 357 12.884 2.132 -0.651 1.00 0.25 H new ATOM 477 N ASP A 358 12.500 4.638 3.870 1.00 0.14 N ATOM 478 CA ASP A 358 12.592 5.767 4.774 1.00 0.16 C ATOM 479 C ASP A 358 11.278 5.883 5.523 1.00 0.16 C ATOM 480 O ASP A 358 10.337 6.498 5.034 1.00 0.20 O ATOM 481 CB ASP A 358 12.842 7.071 4.020 1.00 0.20 C ATOM 482 CG ASP A 358 13.613 8.069 4.860 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.063 8.557 5.868 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.772 8.377 4.511 1.00 1.33 O ATOM 0 H ASP A 358 11.570 4.503 3.473 1.00 0.14 H new ATOM 0 HA ASP A 358 13.427 5.602 5.454 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.396 6.861 3.105 1.00 0.20 H new ATOM 0 HB3 ASP A 358 11.888 7.507 3.722 1.00 0.20 H new ATOM 489 N LYS A 359 11.213 5.277 6.694 1.00 0.15 N ATOM 490 CA LYS A 359 9.976 5.223 7.459 1.00 0.17 C ATOM 491 C LYS A 359 9.473 6.616 7.795 1.00 0.19 C ATOM 492 O LYS A 359 8.291 6.915 7.647 1.00 0.23 O ATOM 493 CB LYS A 359 10.182 4.433 8.746 1.00 0.23 C ATOM 494 CG LYS A 359 8.926 4.349 9.595 1.00 0.29 C ATOM 495 CD LYS A 359 9.046 3.296 10.683 1.00 0.38 C ATOM 496 CE LYS A 359 7.718 3.084 11.388 1.00 0.91 C ATOM 497 NZ LYS A 359 7.823 2.113 12.510 1.00 1.50 N ATOM 0 H LYS A 359 12.004 4.813 7.140 1.00 0.15 H new ATOM 0 HA LYS A 359 9.229 4.725 6.842 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.515 3.425 8.498 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.978 4.898 9.328 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.730 5.320 10.050 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.072 4.117 8.958 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.384 2.356 10.248 1.00 0.38 H new ATOM 0 HD3 LYS A 359 9.801 3.602 11.407 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.355 4.039 11.769 1.00 0.91 H new ATOM 0 HE3 LYS A 359 6.981 2.727 10.669 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 6.892 2.001 12.960 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.144 1.194 12.145 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 8.507 2.465 13.211 1.00 1.50 H new ATOM 511 N GLU A 360 10.382 7.464 8.226 1.00 0.21 N ATOM 512 CA GLU A 360 10.026 8.798 8.665 1.00 0.27 C ATOM 513 C GLU A 360 9.766 9.730 7.480 1.00 0.24 C ATOM 514 O GLU A 360 9.217 10.821 7.649 1.00 0.37 O ATOM 515 CB GLU A 360 11.113 9.336 9.580 1.00 0.41 C ATOM 516 CG GLU A 360 11.297 8.473 10.822 1.00 0.63 C ATOM 517 CD GLU A 360 12.437 8.926 11.705 1.00 1.75 C ATOM 518 OE1 GLU A 360 12.278 9.934 12.423 1.00 1.97 O ATOM 519 OE2 GLU A 360 13.506 8.285 11.671 1.00 2.67 O ATOM 0 H GLU A 360 11.378 7.253 8.282 1.00 0.21 H new ATOM 0 HA GLU A 360 9.093 8.748 9.226 1.00 0.27 H new ATOM 0 HB2 GLU A 360 12.054 9.388 9.033 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.863 10.354 9.880 1.00 0.41 H new ATOM 0 HG2 GLU A 360 10.374 8.481 11.401 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.472 7.442 10.516 1.00 0.63 H new ATOM 526 N SER A 361 10.145 9.293 6.286 1.00 0.19 N ATOM 527 CA SER A 361 9.818 10.015 5.062 1.00 0.21 C ATOM 528 C SER A 361 8.673 9.320 4.325 1.00 0.19 C ATOM 529 O SER A 361 8.269 9.732 3.234 1.00 0.24 O ATOM 530 CB SER A 361 11.056 10.092 4.171 1.00 0.26 C ATOM 531 OG SER A 361 12.083 10.849 4.792 1.00 0.31 O ATOM 0 H SER A 361 10.682 8.438 6.138 1.00 0.19 H new ATOM 0 HA SER A 361 9.497 11.025 5.316 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.419 9.086 3.958 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.793 10.545 3.215 1.00 0.26 H new ATOM 0 HG SER A 361 12.574 10.280 5.420 1.00 0.31 H new ATOM 537 N LYS A 362 8.149 8.269 4.962 1.00 0.15 N ATOM 538 CA LYS A 362 7.104 7.422 4.397 1.00 0.14 C ATOM 539 C LYS A 362 7.467 6.904 3.010 1.00 0.12 C ATOM 540 O LYS A 362 6.640 6.865 2.106 1.00 0.15 O ATOM 541 CB LYS A 362 5.749 8.136 4.395 1.00 0.20 C ATOM 542 CG LYS A 362 4.913 7.797 5.620 1.00 0.48 C ATOM 543 CD LYS A 362 5.574 8.285 6.894 1.00 0.48 C ATOM 544 CE LYS A 362 5.123 7.488 8.111 1.00 0.51 C ATOM 545 NZ LYS A 362 3.711 7.764 8.479 1.00 1.23 N ATOM 0 H LYS A 362 8.444 7.982 5.895 1.00 0.15 H new ATOM 0 HA LYS A 362 7.018 6.549 5.044 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.909 9.213 4.355 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.198 7.862 3.495 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.926 8.249 5.525 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.766 6.718 5.675 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.657 8.210 6.792 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.340 9.339 7.043 1.00 0.48 H new ATOM 0 HE2 LYS A 362 5.241 6.423 7.909 1.00 0.51 H new ATOM 0 HE3 LYS A 362 5.769 7.725 8.957 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 3.432 7.149 9.270 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 3.615 8.759 8.764 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 3.096 7.577 7.661 1.00 1.23 H new ATOM 559 N ILE A 363 8.710 6.487 2.867 1.00 0.09 N ATOM 560 CA ILE A 363 9.184 5.857 1.649 1.00 0.09 C ATOM 561 C ILE A 363 9.334 4.370 1.896 1.00 0.08 C ATOM 562 O ILE A 363 9.902 3.965 2.908 1.00 0.10 O ATOM 563 CB ILE A 363 10.543 6.438 1.204 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.381 7.871 0.693 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.180 5.560 0.134 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.610 8.723 0.908 1.00 0.46 C ATOM 0 H ILE A 363 9.421 6.575 3.593 1.00 0.09 H new ATOM 0 HA ILE A 363 8.460 6.047 0.857 1.00 0.09 H new ATOM 0 HB ILE A 363 11.202 6.457 2.072 1.00 0.10 H new ATOM 0 HG12 ILE A 363 10.146 7.846 -0.371 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.533 8.335 1.196 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.137 5.988 -0.165 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.339 4.558 0.533 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.520 5.505 -0.732 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.429 9.727 0.524 1.00 0.46 H new ATOM 0 HD12 ILE A 363 11.833 8.777 1.974 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.456 8.280 0.382 1.00 0.46 H new ATOM 578 N PHE A 364 8.838 3.557 0.985 1.00 0.09 N ATOM 579 CA PHE A 364 8.903 2.124 1.152 1.00 0.09 C ATOM 580 C PHE A 364 9.183 1.460 -0.189 1.00 0.10 C ATOM 581 O PHE A 364 8.759 1.940 -1.239 1.00 0.13 O ATOM 582 CB PHE A 364 7.605 1.581 1.768 1.00 0.09 C ATOM 583 CG PHE A 364 6.436 1.549 0.839 1.00 0.08 C ATOM 584 CD1 PHE A 364 5.601 2.633 0.741 1.00 0.13 C ATOM 585 CD2 PHE A 364 6.173 0.426 0.084 1.00 0.12 C ATOM 586 CE1 PHE A 364 4.508 2.608 -0.103 1.00 0.14 C ATOM 587 CE2 PHE A 364 5.085 0.385 -0.762 1.00 0.12 C ATOM 588 CZ PHE A 364 4.250 1.477 -0.857 1.00 0.08 C ATOM 0 H PHE A 364 8.387 3.866 0.124 1.00 0.09 H new ATOM 0 HA PHE A 364 9.717 1.891 1.838 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.788 0.571 2.134 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.347 2.192 2.633 1.00 0.09 H new ATOM 0 HD1 PHE A 364 5.801 3.516 1.330 1.00 0.13 H new ATOM 0 HD2 PHE A 364 6.826 -0.431 0.156 1.00 0.12 H new ATOM 0 HE1 PHE A 364 3.858 3.467 -0.174 1.00 0.14 H new ATOM 0 HE2 PHE A 364 4.888 -0.500 -1.348 1.00 0.12 H new ATOM 0 HZ PHE A 364 3.396 1.450 -1.518 1.00 0.08 H new ATOM 598 N ARG A 365 9.927 0.383 -0.142 1.00 0.10 N ATOM 599 CA ARG A 365 10.183 -0.432 -1.305 1.00 0.12 C ATOM 600 C ARG A 365 9.369 -1.710 -1.198 1.00 0.11 C ATOM 601 O ARG A 365 9.353 -2.341 -0.140 1.00 0.18 O ATOM 602 CB ARG A 365 11.664 -0.788 -1.353 1.00 0.17 C ATOM 603 CG ARG A 365 12.042 -1.685 -2.508 1.00 0.17 C ATOM 604 CD ARG A 365 12.495 -0.882 -3.705 1.00 0.31 C ATOM 605 NE ARG A 365 13.809 -0.269 -3.469 1.00 0.77 N ATOM 606 CZ ARG A 365 14.957 -0.954 -3.380 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.974 -2.268 -3.560 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.093 -0.319 -3.131 1.00 0.99 N ATOM 0 H ARG A 365 10.375 0.044 0.709 1.00 0.10 H new ATOM 0 HA ARG A 365 9.907 0.113 -2.208 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.247 0.131 -1.414 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.940 -1.279 -0.420 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.839 -2.362 -2.199 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.188 -2.303 -2.785 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.545 -1.528 -4.582 1.00 0.31 H new ATOM 0 HD3 ARG A 365 11.762 -0.105 -3.923 1.00 0.31 H new ATOM 0 HE ARG A 365 13.850 0.745 -3.366 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.108 -2.765 -3.768 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.853 -2.781 -3.490 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.095 0.693 -3.007 1.00 0.99 H new ATOM 0 HH22 ARG A 365 16.966 -0.843 -3.064 1.00 0.99 H new ATOM 622 N ILE A 366 8.683 -2.093 -2.259 1.00 0.07 N ATOM 623 CA ILE A 366 8.080 -3.395 -2.291 1.00 0.06 C ATOM 624 C ILE A 366 9.154 -4.401 -2.639 1.00 0.07 C ATOM 625 O ILE A 366 9.658 -4.456 -3.758 1.00 0.10 O ATOM 626 CB ILE A 366 6.893 -3.456 -3.259 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.708 -2.719 -2.625 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.537 -4.904 -3.596 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.601 -2.407 -3.589 1.00 0.09 C ATOM 0 H ILE A 366 8.536 -1.525 -3.093 1.00 0.07 H new ATOM 0 HA ILE A 366 7.664 -3.631 -1.311 1.00 0.06 H new ATOM 0 HB ILE A 366 7.157 -2.970 -4.198 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.309 -3.325 -1.812 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.065 -1.789 -2.183 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.692 -4.920 -4.284 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.394 -5.390 -4.062 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.271 -5.435 -2.682 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.799 -1.886 -3.066 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.983 -1.774 -4.390 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.215 -3.334 -4.012 1.00 0.09 H new ATOM 641 N VAL A 367 9.531 -5.147 -1.637 1.00 0.07 N ATOM 642 CA VAL A 367 10.696 -6.004 -1.711 1.00 0.08 C ATOM 643 C VAL A 367 10.399 -7.263 -2.515 1.00 0.09 C ATOM 644 O VAL A 367 11.182 -7.673 -3.376 1.00 0.12 O ATOM 645 CB VAL A 367 11.171 -6.357 -0.294 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.356 -7.293 -0.335 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.514 -5.088 0.468 1.00 0.10 C ATOM 0 H VAL A 367 9.042 -5.182 -0.742 1.00 0.07 H new ATOM 0 HA VAL A 367 11.493 -5.467 -2.226 1.00 0.08 H new ATOM 0 HB VAL A 367 10.362 -6.871 0.224 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.671 -7.526 0.682 1.00 0.12 H new ATOM 0 HG12 VAL A 367 12.075 -8.213 -0.848 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.178 -6.816 -0.869 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.850 -5.346 1.472 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.308 -4.553 -0.054 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.631 -4.453 0.533 1.00 0.10 H new ATOM 657 N ASP A 368 9.260 -7.860 -2.234 1.00 0.08 N ATOM 658 CA ASP A 368 8.778 -8.998 -2.992 1.00 0.09 C ATOM 659 C ASP A 368 7.282 -8.859 -3.194 1.00 0.08 C ATOM 660 O ASP A 368 6.476 -9.285 -2.370 1.00 0.09 O ATOM 661 CB ASP A 368 9.116 -10.311 -2.298 1.00 0.12 C ATOM 662 CG ASP A 368 8.877 -11.527 -3.174 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.722 -11.770 -3.570 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.853 -12.244 -3.486 1.00 0.78 O ATOM 0 H ASP A 368 8.642 -7.572 -1.475 1.00 0.08 H new ATOM 0 HA ASP A 368 9.274 -9.015 -3.962 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.161 -10.293 -1.989 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.517 -10.400 -1.392 1.00 0.12 H new ATOM 669 N PRO A 369 6.917 -8.222 -4.297 1.00 0.09 N ATOM 670 CA PRO A 369 5.531 -7.928 -4.657 1.00 0.10 C ATOM 671 C PRO A 369 4.682 -9.183 -4.774 1.00 0.12 C ATOM 672 O PRO A 369 3.491 -9.165 -4.486 1.00 0.14 O ATOM 673 CB PRO A 369 5.656 -7.237 -6.016 1.00 0.12 C ATOM 674 CG PRO A 369 7.006 -7.603 -6.511 1.00 0.12 C ATOM 675 CD PRO A 369 7.857 -7.735 -5.296 1.00 0.10 C ATOM 0 HA PRO A 369 5.035 -7.322 -3.899 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.879 -7.574 -6.703 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.550 -6.156 -5.920 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.978 -8.537 -7.073 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.398 -6.839 -7.182 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.680 -8.433 -5.452 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.299 -6.782 -5.006 1.00 0.10 H new ATOM 683 N ASN A 370 5.311 -10.267 -5.187 1.00 0.13 N ATOM 684 CA ASN A 370 4.644 -11.553 -5.299 1.00 0.17 C ATOM 685 C ASN A 370 4.198 -12.013 -3.926 1.00 0.17 C ATOM 686 O ASN A 370 3.058 -12.433 -3.723 1.00 0.21 O ATOM 687 CB ASN A 370 5.610 -12.559 -5.890 1.00 0.21 C ATOM 688 CG ASN A 370 4.906 -13.761 -6.485 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.504 -13.746 -7.649 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.772 -14.814 -5.700 1.00 0.59 N ATOM 0 H ASN A 370 6.295 -10.283 -5.454 1.00 0.13 H new ATOM 0 HA ASN A 370 3.770 -11.463 -5.945 1.00 0.17 H new ATOM 0 HB2 ASN A 370 6.208 -12.074 -6.662 1.00 0.21 H new ATOM 0 HB3 ASN A 370 6.300 -12.893 -5.115 1.00 0.21 H new ATOM 0 HD21 ASN A 370 4.321 -15.658 -6.052 1.00 0.59 H new ATOM 0 HD22 ASN A 370 5.120 -14.783 -4.742 1.00 0.59 H new ATOM 697 N GLY A 371 5.123 -11.907 -2.990 1.00 0.16 N ATOM 698 CA GLY A 371 4.847 -12.241 -1.613 1.00 0.19 C ATOM 699 C GLY A 371 3.880 -11.269 -0.981 1.00 0.13 C ATOM 700 O GLY A 371 3.048 -11.650 -0.159 1.00 0.13 O ATOM 0 H GLY A 371 6.077 -11.590 -3.164 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.436 -13.249 -1.559 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.778 -12.246 -1.047 1.00 0.19 H new ATOM 704 N LEU A 372 3.979 -10.014 -1.391 1.00 0.10 N ATOM 705 CA LEU A 372 3.211 -8.942 -0.775 1.00 0.08 C ATOM 706 C LEU A 372 1.769 -9.024 -1.241 1.00 0.11 C ATOM 707 O LEU A 372 0.830 -8.841 -0.470 1.00 0.13 O ATOM 708 CB LEU A 372 3.820 -7.584 -1.152 1.00 0.08 C ATOM 709 CG LEU A 372 3.554 -6.438 -0.172 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.112 -5.959 -0.241 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.880 -6.882 1.238 1.00 0.09 C ATOM 0 H LEU A 372 4.587 -9.711 -2.152 1.00 0.10 H new ATOM 0 HA LEU A 372 3.240 -9.046 0.310 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.898 -7.707 -1.254 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.438 -7.295 -2.131 1.00 0.08 H new ATOM 0 HG LEU A 372 4.196 -5.603 -0.455 1.00 0.08 H new ATOM 0 HD11 LEU A 372 1.964 -5.146 0.469 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.894 -5.605 -1.249 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.443 -6.783 0.007 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.689 -6.063 1.931 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.256 -7.735 1.504 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.930 -7.168 1.296 1.00 0.09 H new ATOM 723 N ALA A 373 1.613 -9.313 -2.518 1.00 0.12 N ATOM 724 CA ALA A 373 0.310 -9.431 -3.134 1.00 0.15 C ATOM 725 C ALA A 373 -0.477 -10.560 -2.505 1.00 0.14 C ATOM 726 O ALA A 373 -1.684 -10.445 -2.298 1.00 0.16 O ATOM 727 CB ALA A 373 0.474 -9.665 -4.617 1.00 0.20 C ATOM 0 H ALA A 373 2.391 -9.473 -3.158 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.243 -8.505 -2.976 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.508 -9.754 -5.082 1.00 0.20 H new ATOM 0 HB2 ALA A 373 1.011 -8.826 -5.060 1.00 0.20 H new ATOM 0 HB3 ALA A 373 1.037 -10.584 -4.780 1.00 0.20 H new ATOM 733 N ARG A 374 0.213 -11.646 -2.177 1.00 0.14 N ATOM 734 CA ARG A 374 -0.428 -12.783 -1.555 1.00 0.17 C ATOM 735 C ARG A 374 -0.998 -12.376 -0.203 1.00 0.14 C ATOM 736 O ARG A 374 -2.020 -12.897 0.227 1.00 0.16 O ATOM 737 CB ARG A 374 0.556 -13.952 -1.421 1.00 0.24 C ATOM 738 CG ARG A 374 0.757 -14.436 -0.001 1.00 0.28 C ATOM 739 CD ARG A 374 1.211 -15.884 0.030 1.00 0.47 C ATOM 740 NE ARG A 374 0.234 -16.767 -0.610 1.00 1.44 N ATOM 741 CZ ARG A 374 0.518 -17.985 -1.080 1.00 2.04 C ATOM 742 NH1 ARG A 374 1.738 -18.485 -0.961 1.00 2.01 N ATOM 743 NH2 ARG A 374 -0.431 -18.708 -1.662 1.00 3.03 N ATOM 0 H ARG A 374 1.215 -11.757 -2.334 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.250 -13.120 -2.186 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.200 -14.783 -2.029 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.520 -13.649 -1.829 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.497 -13.810 0.497 1.00 0.28 H new ATOM 0 HG3 ARG A 374 -0.174 -14.333 0.556 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.172 -15.976 -0.476 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.363 -16.196 1.063 1.00 0.47 H new ATOM 0 HE ARG A 374 -0.725 -16.431 -0.703 1.00 1.44 H new ATOM 0 HH11 ARG A 374 2.471 -17.939 -0.507 1.00 2.01 H new ATOM 0 HH12 ARG A 374 1.945 -19.416 -1.323 1.00 2.01 H new ATOM 0 HH21 ARG A 374 -1.376 -18.334 -1.750 1.00 3.03 H new ATOM 0 HH22 ARG A 374 -0.216 -19.638 -2.021 1.00 3.03 H new ATOM 757 N LEU A 375 -0.331 -11.429 0.446 1.00 0.13 N ATOM 758 CA LEU A 375 -0.831 -10.834 1.680 1.00 0.15 C ATOM 759 C LEU A 375 -2.127 -10.086 1.389 1.00 0.16 C ATOM 760 O LEU A 375 -3.122 -10.237 2.093 1.00 0.18 O ATOM 761 CB LEU A 375 0.198 -9.845 2.243 1.00 0.17 C ATOM 762 CG LEU A 375 1.279 -10.385 3.185 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.743 -11.767 2.791 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.459 -9.434 3.172 1.00 0.15 C ATOM 0 H LEU A 375 0.565 -11.054 0.135 1.00 0.13 H new ATOM 0 HA LEU A 375 -1.009 -11.625 2.409 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.698 -9.369 1.400 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.346 -9.064 2.773 1.00 0.17 H new ATOM 0 HG LEU A 375 0.849 -10.458 4.184 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.509 -12.106 3.488 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.898 -12.455 2.817 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.157 -11.738 1.783 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.235 -9.808 3.839 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.856 -9.360 2.159 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.136 -8.449 3.508 1.00 0.15 H new ATOM 776 N TRP A 376 -2.097 -9.290 0.327 1.00 0.16 N ATOM 777 CA TRP A 376 -3.239 -8.480 -0.079 1.00 0.18 C ATOM 778 C TRP A 376 -4.456 -9.362 -0.350 1.00 0.20 C ATOM 779 O TRP A 376 -5.549 -9.107 0.157 1.00 0.25 O ATOM 780 CB TRP A 376 -2.868 -7.669 -1.326 1.00 0.19 C ATOM 781 CG TRP A 376 -3.882 -6.637 -1.737 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.255 -6.323 -3.014 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.637 -5.773 -0.877 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.182 -5.308 -3.001 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.439 -4.959 -1.702 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.713 -5.606 0.509 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.304 -3.995 -1.184 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.568 -4.649 1.018 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.352 -3.858 0.172 1.00 0.24 C ATOM 0 H TRP A 376 -1.281 -9.188 -0.277 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.498 -7.795 0.728 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.916 -7.170 -1.146 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.715 -8.358 -2.157 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.876 -6.803 -3.904 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.609 -4.884 -3.825 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -4.114 -6.215 1.170 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.912 -3.381 -1.832 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.633 -4.509 2.087 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -7.012 -3.120 0.603 1.00 0.24 H new ATOM 800 N GLY A 377 -4.259 -10.406 -1.139 1.00 0.21 N ATOM 801 CA GLY A 377 -5.329 -11.336 -1.418 1.00 0.27 C ATOM 802 C GLY A 377 -5.705 -12.164 -0.209 1.00 0.30 C ATOM 803 O GLY A 377 -6.854 -12.559 -0.066 1.00 0.38 O ATOM 0 H GLY A 377 -3.372 -10.626 -1.593 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.204 -10.786 -1.764 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -5.028 -11.999 -2.229 1.00 0.27 H new ATOM 807 N ASN A 378 -4.733 -12.431 0.654 1.00 0.27 N ATOM 808 CA ASN A 378 -4.983 -13.151 1.899 1.00 0.30 C ATOM 809 C ASN A 378 -5.848 -12.324 2.840 1.00 0.30 C ATOM 810 O ASN A 378 -6.684 -12.855 3.578 1.00 0.35 O ATOM 811 CB ASN A 378 -3.668 -13.515 2.569 1.00 0.32 C ATOM 812 CG ASN A 378 -3.289 -14.956 2.309 1.00 0.38 C ATOM 813 OD1 ASN A 378 -4.146 -15.823 2.152 1.00 0.76 O ATOM 814 ND2 ASN A 378 -2.004 -15.217 2.249 1.00 0.42 N ATOM 0 H ASN A 378 -3.760 -12.159 0.515 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.522 -14.068 1.662 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.879 -12.859 2.202 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.748 -13.348 3.643 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.685 -16.168 2.066 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.325 -14.468 2.385 1.00 0.42 H new ATOM 821 N HIS A 379 -5.638 -11.016 2.799 1.00 0.28 N ATOM 822 CA HIS A 379 -6.401 -10.077 3.605 1.00 0.30 C ATOM 823 C HIS A 379 -7.803 -9.890 3.039 1.00 0.32 C ATOM 824 O HIS A 379 -8.785 -9.909 3.778 1.00 0.38 O ATOM 825 CB HIS A 379 -5.661 -8.733 3.668 1.00 0.28 C ATOM 826 CG HIS A 379 -6.439 -7.613 4.294 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.574 -7.500 5.654 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.077 -6.576 3.699 1.00 0.31 C ATOM 829 CE1 HIS A 379 -7.284 -6.403 5.856 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.612 -5.809 4.699 1.00 0.38 N ATOM 0 H HIS A 379 -4.934 -10.577 2.206 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.500 -10.478 4.614 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.735 -8.870 4.227 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.382 -8.441 2.656 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.150 -6.390 2.638 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -7.565 -6.032 6.831 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -8.154 -4.953 4.586 1.00 0.38 H new ATOM 838 N LYS A 380 -7.905 -9.720 1.724 1.00 0.32 N ATOM 839 CA LYS A 380 -9.202 -9.467 1.112 1.00 0.36 C ATOM 840 C LYS A 380 -9.910 -10.766 0.743 1.00 0.41 C ATOM 841 O LYS A 380 -11.037 -10.748 0.252 1.00 0.45 O ATOM 842 CB LYS A 380 -9.063 -8.606 -0.140 1.00 0.36 C ATOM 843 CG LYS A 380 -8.179 -7.387 0.038 1.00 0.38 C ATOM 844 CD LYS A 380 -8.542 -6.285 -0.947 1.00 0.63 C ATOM 845 CE LYS A 380 -8.606 -6.782 -2.384 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.931 -5.677 -3.328 1.00 0.77 N ATOM 0 H LYS A 380 -7.120 -9.752 1.073 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.799 -8.935 1.853 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.659 -9.219 -0.946 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -10.054 -8.279 -0.454 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -8.276 -7.012 1.057 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.135 -7.670 -0.100 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -9.506 -5.859 -0.671 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -7.807 -5.483 -0.876 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.650 -7.228 -2.659 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.359 -7.566 -2.466 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.465 -6.056 -4.136 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.505 -4.960 -2.839 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -8.050 -5.242 -3.669 1.00 0.77 H new ATOM 860 N ASN A 381 -9.234 -11.883 1.001 1.00 0.44 N ATOM 861 CA ASN A 381 -9.760 -13.217 0.710 1.00 0.52 C ATOM 862 C ASN A 381 -10.140 -13.357 -0.762 1.00 0.53 C ATOM 863 O ASN A 381 -11.212 -13.860 -1.095 1.00 0.60 O ATOM 864 CB ASN A 381 -10.955 -13.519 1.613 1.00 0.58 C ATOM 865 CG ASN A 381 -10.556 -13.580 3.073 1.00 1.20 C ATOM 866 OD1 ASN A 381 -10.267 -14.647 3.607 1.00 1.87 O ATOM 867 ND2 ASN A 381 -10.526 -12.433 3.731 1.00 2.01 N ATOM 0 H ASN A 381 -8.304 -11.890 1.419 1.00 0.44 H new ATOM 0 HA ASN A 381 -8.975 -13.945 0.914 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -11.717 -12.752 1.476 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.402 -14.468 1.319 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -10.256 -12.416 4.715 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -10.773 -11.565 3.255 1.00 2.01 H new ATOM 874 N ARG A 382 -9.240 -12.938 -1.644 1.00 0.50 N ATOM 875 CA ARG A 382 -9.537 -12.906 -3.069 1.00 0.55 C ATOM 876 C ARG A 382 -8.723 -13.928 -3.833 1.00 0.68 C ATOM 877 O ARG A 382 -7.506 -14.032 -3.673 1.00 0.78 O ATOM 878 CB ARG A 382 -9.284 -11.512 -3.643 1.00 0.49 C ATOM 879 CG ARG A 382 -10.112 -10.443 -2.957 1.00 0.48 C ATOM 880 CD ARG A 382 -11.592 -10.743 -3.093 1.00 0.57 C ATOM 881 NE ARG A 382 -12.390 -10.104 -2.051 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.602 -9.605 -2.259 1.00 1.11 C ATOM 883 NH1 ARG A 382 -14.137 -9.665 -3.467 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.280 -9.056 -1.266 1.00 1.27 N ATOM 0 H ARG A 382 -8.303 -12.617 -1.398 1.00 0.50 H new ATOM 0 HA ARG A 382 -10.592 -13.156 -3.183 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -8.226 -11.268 -3.543 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.511 -11.515 -4.709 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.842 -10.388 -1.902 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.892 -9.469 -3.394 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.939 -10.406 -4.070 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.746 -11.821 -3.054 1.00 0.57 H new ATOM 0 HE ARG A 382 -11.995 -10.037 -1.113 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -13.618 -10.093 -4.234 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -15.068 -9.283 -3.632 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -13.872 -9.014 -0.332 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -15.211 -8.675 -1.434 1.00 1.27 H new ATOM 898 N THR A 383 -9.422 -14.677 -4.667 1.00 0.76 N ATOM 899 CA THR A 383 -8.807 -15.661 -5.530 1.00 0.95 C ATOM 900 C THR A 383 -8.061 -14.981 -6.674 1.00 0.94 C ATOM 901 O THR A 383 -6.959 -15.387 -7.047 1.00 1.22 O ATOM 902 CB THR A 383 -9.883 -16.608 -6.098 1.00 1.17 C ATOM 903 OG1 THR A 383 -10.496 -17.345 -5.028 1.00 1.24 O ATOM 904 CG2 THR A 383 -9.295 -17.561 -7.127 1.00 1.37 C ATOM 0 H THR A 383 -10.436 -14.617 -4.763 1.00 0.76 H new ATOM 0 HA THR A 383 -8.093 -16.238 -4.943 1.00 0.95 H new ATOM 0 HB THR A 383 -10.639 -16.004 -6.600 1.00 1.17 H new ATOM 0 HG1 THR A 383 -11.180 -17.944 -5.393 1.00 1.24 H new ATOM 0 HG21 THR A 383 -10.080 -18.215 -7.508 1.00 1.37 H new ATOM 0 HG22 THR A 383 -8.868 -16.989 -7.951 1.00 1.37 H new ATOM 0 HG23 THR A 383 -8.515 -18.163 -6.661 1.00 1.37 H new ATOM 912 N ASN A 384 -8.655 -13.926 -7.205 1.00 0.84 N ATOM 913 CA ASN A 384 -8.097 -13.214 -8.335 1.00 0.81 C ATOM 914 C ASN A 384 -7.246 -12.052 -7.883 1.00 0.64 C ATOM 915 O ASN A 384 -7.457 -10.912 -8.301 1.00 0.77 O ATOM 916 CB ASN A 384 -9.207 -12.670 -9.197 1.00 0.89 C ATOM 917 CG ASN A 384 -9.952 -13.739 -9.977 1.00 1.40 C ATOM 918 OD1 ASN A 384 -11.156 -13.631 -10.213 1.00 2.21 O ATOM 919 ND2 ASN A 384 -9.240 -14.773 -10.399 1.00 1.70 N ATOM 0 H ASN A 384 -9.536 -13.542 -6.864 1.00 0.84 H new ATOM 0 HA ASN A 384 -7.482 -13.918 -8.895 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -9.915 -12.133 -8.566 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.790 -11.946 -9.897 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -9.687 -15.514 -10.939 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -8.244 -14.828 -10.184 1.00 1.70 H new ATOM 926 N MET A 385 -6.303 -12.322 -7.021 1.00 0.55 N ATOM 927 CA MET A 385 -5.411 -11.288 -6.565 1.00 0.42 C ATOM 928 C MET A 385 -4.025 -11.515 -7.128 1.00 0.53 C ATOM 929 O MET A 385 -3.552 -12.650 -7.217 1.00 0.94 O ATOM 930 CB MET A 385 -5.411 -11.213 -5.032 1.00 0.47 C ATOM 931 CG MET A 385 -4.074 -10.809 -4.414 1.00 0.92 C ATOM 932 SD MET A 385 -2.865 -12.157 -4.382 1.00 2.54 S ATOM 933 CE MET A 385 -3.787 -13.454 -3.561 1.00 3.18 C ATOM 0 H MET A 385 -6.132 -13.245 -6.621 1.00 0.55 H new ATOM 0 HA MET A 385 -5.760 -10.322 -6.930 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.172 -10.500 -4.716 1.00 0.47 H new ATOM 0 HB3 MET A 385 -5.701 -12.185 -4.634 1.00 0.47 H new ATOM 0 HG2 MET A 385 -3.660 -9.972 -4.976 1.00 0.92 H new ATOM 0 HG3 MET A 385 -4.243 -10.457 -3.396 1.00 0.92 H new ATOM 0 HE1 MET A 385 -3.521 -14.419 -3.993 1.00 3.18 H new ATOM 0 HE2 MET A 385 -3.547 -13.454 -2.498 1.00 3.18 H new ATOM 0 HE3 MET A 385 -4.855 -13.280 -3.692 1.00 3.18 H new ATOM 943 N THR A 386 -3.418 -10.431 -7.570 1.00 0.23 N ATOM 944 CA THR A 386 -2.052 -10.441 -8.037 1.00 0.24 C ATOM 945 C THR A 386 -1.390 -9.155 -7.573 1.00 0.16 C ATOM 946 O THR A 386 -2.050 -8.328 -6.936 1.00 0.18 O ATOM 947 CB THR A 386 -1.971 -10.537 -9.580 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.443 -9.326 -10.179 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.805 -11.697 -10.102 1.00 0.44 C ATOM 0 H THR A 386 -3.864 -9.515 -7.614 1.00 0.23 H new ATOM 0 HA THR A 386 -1.545 -11.316 -7.630 1.00 0.24 H new ATOM 0 HB THR A 386 -0.926 -10.700 -9.844 1.00 0.33 H new ATOM 0 HG1 THR A 386 -3.000 -9.541 -10.956 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.729 -11.740 -11.189 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.437 -12.630 -9.676 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.847 -11.553 -9.817 1.00 0.44 H new ATOM 957 N TYR A 387 -0.121 -8.962 -7.879 1.00 0.16 N ATOM 958 CA TYR A 387 0.519 -7.691 -7.554 1.00 0.13 C ATOM 959 C TYR A 387 -0.098 -6.588 -8.398 1.00 0.14 C ATOM 960 O TYR A 387 -0.145 -5.429 -7.993 1.00 0.17 O ATOM 961 CB TYR A 387 2.030 -7.724 -7.768 1.00 0.15 C ATOM 962 CG TYR A 387 2.638 -6.378 -7.485 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.548 -5.827 -6.216 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.238 -5.631 -8.487 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.043 -4.582 -5.952 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.732 -4.370 -8.232 1.00 0.14 C ATOM 967 CZ TYR A 387 3.632 -3.846 -6.961 1.00 0.12 C ATOM 968 OH TYR A 387 4.116 -2.584 -6.704 1.00 0.13 O ATOM 0 H TYR A 387 0.479 -9.646 -8.340 1.00 0.16 H new ATOM 0 HA TYR A 387 0.351 -7.499 -6.494 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.478 -8.475 -7.117 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.250 -8.019 -8.794 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.079 -6.391 -5.424 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.319 -6.043 -9.482 1.00 0.14 H new ATOM 0 HE1 TYR A 387 2.974 -4.173 -4.955 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.194 -3.797 -9.022 1.00 0.14 H new ATOM 0 HH TYR A 387 4.499 -2.207 -7.524 1.00 0.13 H new ATOM 978 N GLU A 388 -0.595 -6.967 -9.565 1.00 0.17 N ATOM 979 CA GLU A 388 -1.298 -6.035 -10.428 1.00 0.24 C ATOM 980 C GLU A 388 -2.513 -5.464 -9.702 1.00 0.25 C ATOM 981 O GLU A 388 -2.776 -4.271 -9.763 1.00 0.31 O ATOM 982 CB GLU A 388 -1.738 -6.722 -11.712 1.00 0.30 C ATOM 983 CG GLU A 388 -2.561 -5.841 -12.617 1.00 0.44 C ATOM 984 CD GLU A 388 -3.736 -6.579 -13.208 1.00 1.53 C ATOM 985 OE1 GLU A 388 -3.538 -7.335 -14.183 1.00 1.96 O ATOM 986 OE2 GLU A 388 -4.864 -6.410 -12.704 1.00 2.21 O ATOM 0 H GLU A 388 -0.524 -7.915 -9.935 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.619 -5.222 -10.684 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.855 -7.061 -12.254 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.317 -7.610 -11.459 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.920 -4.979 -12.055 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -1.932 -5.458 -13.421 1.00 0.44 H new ATOM 993 N LYS A 389 -3.243 -6.326 -8.997 1.00 0.23 N ATOM 994 CA LYS A 389 -4.406 -5.884 -8.231 1.00 0.28 C ATOM 995 C LYS A 389 -3.993 -4.899 -7.143 1.00 0.28 C ATOM 996 O LYS A 389 -4.780 -4.046 -6.728 1.00 0.40 O ATOM 997 CB LYS A 389 -5.150 -7.073 -7.620 1.00 0.32 C ATOM 998 CG LYS A 389 -6.063 -7.795 -8.603 1.00 0.45 C ATOM 999 CD LYS A 389 -5.285 -8.472 -9.718 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.208 -9.037 -10.783 1.00 0.46 C ATOM 1001 NZ LYS A 389 -6.817 -7.968 -11.618 1.00 1.39 N ATOM 0 H LYS A 389 -3.052 -7.326 -8.940 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.084 -5.378 -8.918 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.422 -7.782 -7.226 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.744 -6.724 -6.776 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.652 -8.541 -8.069 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.766 -7.082 -9.034 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.601 -7.755 -10.172 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.676 -9.274 -9.302 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -5.649 -9.721 -11.421 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -6.997 -9.619 -10.307 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.198 -8.384 -12.491 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -7.586 -7.510 -11.089 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -6.093 -7.261 -11.859 1.00 1.39 H new ATOM 1015 N MET A 390 -2.756 -5.029 -6.686 1.00 0.19 N ATOM 1016 CA MET A 390 -2.183 -4.088 -5.736 1.00 0.17 C ATOM 1017 C MET A 390 -1.801 -2.790 -6.440 1.00 0.16 C ATOM 1018 O MET A 390 -2.114 -1.701 -5.963 1.00 0.17 O ATOM 1019 CB MET A 390 -0.948 -4.682 -5.061 1.00 0.15 C ATOM 1020 CG MET A 390 -0.339 -3.750 -4.030 1.00 0.14 C ATOM 1021 SD MET A 390 1.110 -4.438 -3.217 1.00 0.18 S ATOM 1022 CE MET A 390 1.528 -3.089 -2.116 1.00 1.57 C ATOM 0 H MET A 390 -2.126 -5.783 -6.961 1.00 0.19 H new ATOM 0 HA MET A 390 -2.935 -3.879 -4.975 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.219 -5.622 -4.580 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.201 -4.916 -5.820 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.065 -2.813 -4.515 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.090 -3.511 -3.277 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.518 -3.258 -1.693 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.526 -2.151 -2.672 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.795 -3.035 -1.311 1.00 1.57 H new ATOM 1032 N SER A 391 -1.128 -2.909 -7.582 1.00 0.15 N ATOM 1033 CA SER A 391 -0.663 -1.741 -8.314 1.00 0.17 C ATOM 1034 C SER A 391 -1.836 -0.897 -8.817 1.00 0.19 C ATOM 1035 O SER A 391 -1.719 0.322 -8.906 1.00 0.21 O ATOM 1036 CB SER A 391 0.259 -2.151 -9.469 1.00 0.23 C ATOM 1037 OG SER A 391 -0.340 -3.133 -10.288 1.00 1.02 O ATOM 0 H SER A 391 -0.895 -3.802 -8.017 1.00 0.15 H new ATOM 0 HA SER A 391 -0.086 -1.124 -7.625 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.503 -1.275 -10.070 1.00 0.23 H new ATOM 0 HB3 SER A 391 1.198 -2.534 -9.068 1.00 0.23 H new ATOM 0 HG SER A 391 -1.266 -3.279 -10.001 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.962 -1.543 -9.128 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.198 -0.822 -9.460 1.00 0.26 C ATOM 1045 C ARG A 392 -4.500 0.194 -8.376 1.00 0.22 C ATOM 1046 O ARG A 392 -4.698 1.383 -8.642 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.388 -1.770 -9.541 1.00 0.38 C ATOM 1048 CG ARG A 392 -5.207 -2.929 -10.489 1.00 1.12 C ATOM 1049 CD ARG A 392 -5.338 -2.511 -11.944 1.00 2.05 C ATOM 1050 NE ARG A 392 -5.434 -3.666 -12.831 1.00 2.61 N ATOM 1051 CZ ARG A 392 -6.075 -3.663 -14.000 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -6.687 -2.565 -14.429 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -6.113 -4.768 -14.733 1.00 4.06 N ATOM 0 H ARG A 392 -3.046 -2.559 -9.158 1.00 0.21 H new ATOM 0 HA ARG A 392 -4.047 -0.340 -10.426 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.592 -2.162 -8.544 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -6.267 -1.203 -9.846 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -4.226 -3.376 -10.329 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.948 -3.697 -10.266 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -6.222 -1.885 -12.065 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.477 -1.905 -12.227 1.00 2.05 H new ATOM 0 HE ARG A 392 -4.981 -4.532 -12.538 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -6.669 -1.717 -13.863 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -7.175 -2.570 -15.324 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -5.653 -5.616 -14.402 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -6.602 -4.770 -15.628 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.536 -0.310 -7.150 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.766 0.511 -5.975 1.00 0.17 C ATOM 1069 C ALA A 393 -3.704 1.596 -5.855 1.00 0.12 C ATOM 1070 O ALA A 393 -4.021 2.748 -5.579 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.786 -0.360 -4.728 1.00 0.20 C ATOM 0 H ALA A 393 -4.406 -1.301 -6.945 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.735 1.000 -6.078 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.959 0.264 -3.851 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.584 -1.097 -4.812 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.829 -0.872 -4.626 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.449 1.234 -6.111 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.340 2.172 -5.962 1.00 0.10 C ATOM 1079 C LEU A 394 -1.483 3.321 -6.940 1.00 0.11 C ATOM 1080 O LEU A 394 -1.346 4.486 -6.577 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.009 1.456 -6.190 1.00 0.11 C ATOM 1082 CG LEU A 394 0.325 0.390 -5.158 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.509 -0.441 -5.612 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.609 1.044 -3.823 1.00 0.13 C ATOM 0 H LEU A 394 -2.176 0.302 -6.421 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.359 2.571 -4.948 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.025 0.994 -7.177 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.790 2.197 -6.198 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.530 -0.278 -5.049 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.732 -1.198 -4.860 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.270 -0.928 -6.557 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.377 0.205 -5.745 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.848 0.277 -3.086 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.453 1.726 -3.924 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.269 1.600 -3.496 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.786 2.975 -8.178 1.00 0.12 N ATOM 1097 CA ARG A 395 -1.969 3.954 -9.234 1.00 0.14 C ATOM 1098 C ARG A 395 -3.066 4.942 -8.872 1.00 0.14 C ATOM 1099 O ARG A 395 -2.950 6.133 -9.146 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.305 3.239 -10.537 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.196 2.317 -11.007 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.164 3.059 -11.838 1.00 0.52 C ATOM 1103 NE ARG A 395 -0.735 3.579 -13.081 1.00 1.30 N ATOM 1104 CZ ARG A 395 -0.109 4.429 -13.894 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.111 4.861 -13.605 1.00 1.66 N ATOM 1106 NH2 ARG A 395 -0.708 4.849 -15.001 1.00 2.64 N ATOM 0 H ARG A 395 -1.912 2.009 -8.479 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.043 4.514 -9.359 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.219 2.661 -10.403 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.507 3.980 -11.311 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.710 1.863 -10.144 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.623 1.505 -11.596 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.247 3.883 -11.255 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.664 2.389 -12.071 1.00 0.52 H new ATOM 0 HE ARG A 395 -1.672 3.271 -13.342 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.577 4.543 -12.755 1.00 1.66 H new ATOM 0 HH12 ARG A 395 1.584 5.512 -14.232 1.00 1.66 H new ATOM 0 HH21 ARG A 395 -1.647 4.521 -15.229 1.00 2.64 H new ATOM 0 HH22 ARG A 395 -0.230 5.500 -15.624 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.117 4.445 -8.231 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.225 5.292 -7.817 1.00 0.13 C ATOM 1122 C HIS A 396 -4.812 6.159 -6.632 1.00 0.11 C ATOM 1123 O HIS A 396 -5.224 7.316 -6.520 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.451 4.443 -7.479 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.744 5.190 -7.598 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -7.941 6.125 -8.587 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.864 5.105 -6.844 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.169 6.584 -8.413 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.766 5.995 -7.369 1.00 0.26 N ATOM 0 H HIS A 396 -4.224 3.460 -7.987 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.492 5.951 -8.643 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.478 3.577 -8.141 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.352 4.063 -6.462 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.018 4.460 -5.992 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.631 7.337 -9.033 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.711 6.174 -7.029 1.00 0.26 H new ATOM 1137 N TYR A 397 -3.952 5.609 -5.784 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.454 6.317 -4.611 1.00 0.10 C ATOM 1139 C TYR A 397 -2.695 7.577 -4.994 1.00 0.09 C ATOM 1140 O TYR A 397 -2.707 8.562 -4.257 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.534 5.416 -3.788 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.256 4.303 -3.095 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.633 4.323 -2.992 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.566 3.241 -2.540 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.310 3.318 -2.357 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.235 2.229 -1.892 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.607 2.268 -1.806 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.264 1.278 -1.126 1.00 0.30 O ATOM 0 H TYR A 397 -3.582 4.664 -5.889 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.324 6.599 -4.018 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.772 4.993 -4.442 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.015 6.021 -3.044 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.185 5.146 -3.420 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.489 3.206 -2.616 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.387 3.347 -2.288 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.686 1.409 -1.453 1.00 0.24 H new ATOM 0 HH TYR A 397 -6.162 1.587 -0.886 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.037 7.546 -6.143 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.205 8.662 -6.562 1.00 0.12 C ATOM 1160 C TYR A 398 -2.052 9.913 -6.767 1.00 0.14 C ATOM 1161 O TYR A 398 -1.716 10.992 -6.271 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.457 8.346 -7.860 1.00 0.14 C ATOM 1163 CG TYR A 398 0.331 7.045 -7.864 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.876 6.498 -6.699 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.528 6.359 -9.057 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.589 5.311 -6.734 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.238 5.182 -9.098 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.763 4.660 -7.940 1.00 0.14 C ATOM 1169 OH TYR A 398 2.471 3.484 -7.995 1.00 0.18 O ATOM 0 H TYR A 398 -2.063 6.765 -6.798 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.476 8.837 -5.771 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.179 8.315 -8.676 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.229 9.166 -8.072 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.739 7.009 -5.757 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.115 6.759 -9.971 1.00 0.15 H new ATOM 0 HE1 TYR A 398 2.005 4.898 -5.827 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.383 4.669 -10.037 1.00 0.16 H new ATOM 0 HH TYR A 398 2.992 3.377 -7.172 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.155 9.755 -7.492 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.058 10.869 -7.762 1.00 0.19 C ATOM 1181 C LYS A 399 -4.679 11.380 -6.478 1.00 0.19 C ATOM 1182 O LYS A 399 -4.794 12.585 -6.262 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.185 10.468 -8.710 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.770 10.326 -10.166 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.142 8.976 -10.443 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.126 7.851 -10.184 1.00 0.32 C ATOM 1187 NZ LYS A 399 -6.276 7.882 -11.125 1.00 0.71 N ATOM 0 H LYS A 399 -3.445 8.868 -7.903 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.458 11.650 -8.228 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.606 9.521 -8.372 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -5.979 11.212 -8.644 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.641 10.460 -10.807 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -4.063 11.115 -10.421 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -3.803 8.935 -11.478 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.262 8.845 -9.814 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -4.612 6.894 -10.273 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -5.494 7.921 -9.161 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.811 6.993 -11.049 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -6.897 8.681 -10.887 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -5.926 7.993 -12.098 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.064 10.452 -5.620 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.791 10.785 -4.409 1.00 0.18 C ATOM 1203 C LEU A 400 -4.845 11.260 -3.312 1.00 0.18 C ATOM 1204 O LEU A 400 -5.199 11.268 -2.135 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.602 9.572 -3.967 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.369 8.898 -5.105 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.021 7.625 -4.624 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.404 9.840 -5.699 1.00 0.21 C ATOM 0 H LEU A 400 -4.883 9.455 -5.741 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.473 11.611 -4.612 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -5.931 8.844 -3.512 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.309 9.880 -3.196 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.656 8.645 -5.890 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.562 7.160 -5.448 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.256 6.940 -4.259 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.717 7.855 -3.817 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -8.935 9.335 -6.506 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.114 10.134 -4.926 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -7.906 10.727 -6.091 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.641 11.658 -3.723 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.651 12.257 -2.827 1.00 0.20 C ATOM 1222 C ASN A 401 -2.275 11.327 -1.682 1.00 0.17 C ATOM 1223 O ASN A 401 -2.062 11.766 -0.552 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.173 13.580 -2.274 1.00 0.27 C ATOM 1225 CG ASN A 401 -2.771 14.768 -3.118 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -1.714 15.363 -2.901 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.606 15.130 -4.069 1.00 1.21 N ATOM 0 H ASN A 401 -3.324 11.574 -4.689 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.750 12.436 -3.414 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.260 13.538 -2.209 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.798 13.717 -1.260 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -3.388 15.932 -4.661 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.471 14.609 -4.214 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.188 10.047 -1.987 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.899 9.035 -0.993 1.00 0.10 C ATOM 1236 C ILE A 402 -0.456 8.569 -1.089 1.00 0.09 C ATOM 1237 O ILE A 402 0.355 8.843 -0.208 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.859 7.861 -1.208 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.283 8.362 -1.047 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.591 6.721 -0.243 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.302 7.416 -1.590 1.00 0.13 C ATOM 0 H ILE A 402 -2.316 9.681 -2.930 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.037 9.454 0.004 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.706 7.468 -2.213 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.484 8.535 0.010 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.383 9.323 -1.552 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.295 5.911 -0.432 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.573 6.357 -0.383 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.712 7.075 0.781 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.299 7.832 -1.444 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.125 7.262 -2.654 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.227 6.462 -1.068 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.140 7.872 -2.164 1.00 0.07 N ATOM 1254 CA ILE A 403 1.213 7.424 -2.408 1.00 0.07 C ATOM 1255 C ILE A 403 1.700 8.030 -3.716 1.00 0.08 C ATOM 1256 O ILE A 403 0.904 8.533 -4.500 1.00 0.10 O ATOM 1257 CB ILE A 403 1.304 5.881 -2.482 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.601 5.229 -1.294 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.754 5.428 -2.530 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.712 3.722 -1.306 1.00 0.11 C ATOM 0 H ILE A 403 -0.809 7.604 -2.885 1.00 0.07 H new ATOM 0 HA ILE A 403 1.839 7.749 -1.577 1.00 0.07 H new ATOM 0 HB ILE A 403 0.803 5.567 -3.398 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.029 5.613 -0.368 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.452 5.512 -1.300 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.794 4.340 -2.582 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.238 5.851 -3.410 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.271 5.768 -1.633 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.194 3.312 -0.439 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.259 3.331 -2.217 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.763 3.434 -1.271 1.00 0.11 H new ATOM 1272 N ARG A 404 3.000 8.025 -3.925 1.00 0.10 N ATOM 1273 CA ARG A 404 3.580 8.492 -5.168 1.00 0.13 C ATOM 1274 C ARG A 404 4.575 7.475 -5.678 1.00 0.14 C ATOM 1275 O ARG A 404 4.963 6.547 -4.965 1.00 0.16 O ATOM 1276 CB ARG A 404 4.278 9.832 -4.965 1.00 0.17 C ATOM 1277 CG ARG A 404 5.674 9.690 -4.425 1.00 0.25 C ATOM 1278 CD ARG A 404 6.325 11.035 -4.203 1.00 0.36 C ATOM 1279 NE ARG A 404 6.760 11.663 -5.447 1.00 1.14 N ATOM 1280 CZ ARG A 404 7.134 12.938 -5.538 1.00 1.56 C ATOM 1281 NH1 ARG A 404 7.073 13.736 -4.480 1.00 1.63 N ATOM 1282 NH2 ARG A 404 7.564 13.419 -6.693 1.00 2.39 N ATOM 0 H ARG A 404 3.683 7.698 -3.241 1.00 0.10 H new ATOM 0 HA ARG A 404 2.781 8.622 -5.898 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.314 10.364 -5.915 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.689 10.442 -4.280 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.647 9.139 -3.485 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.276 9.104 -5.120 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.622 11.695 -3.694 1.00 0.36 H new ATOM 0 HD3 ARG A 404 7.184 10.914 -3.542 1.00 0.36 H new ATOM 0 HE ARG A 404 6.779 11.094 -6.293 1.00 1.14 H new ATOM 0 HH11 ARG A 404 6.738 13.374 -3.587 1.00 1.63 H new ATOM 0 HH12 ARG A 404 7.362 14.711 -4.559 1.00 1.63 H new ATOM 0 HH21 ARG A 404 7.609 12.814 -7.513 1.00 2.39 H new ATOM 0 HH22 ARG A 404 7.851 14.395 -6.764 1.00 2.39 H new ATOM 1296 N LYS A 405 5.002 7.680 -6.900 1.00 0.17 N ATOM 1297 CA LYS A 405 5.945 6.799 -7.537 1.00 0.19 C ATOM 1298 C LYS A 405 7.218 7.567 -7.836 1.00 0.22 C ATOM 1299 O LYS A 405 7.173 8.679 -8.365 1.00 0.27 O ATOM 1300 CB LYS A 405 5.351 6.245 -8.823 1.00 0.22 C ATOM 1301 CG LYS A 405 6.138 5.073 -9.371 1.00 0.34 C ATOM 1302 CD LYS A 405 6.416 4.069 -8.297 1.00 0.29 C ATOM 1303 CE LYS A 405 6.994 2.809 -8.881 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.209 3.056 -9.700 1.00 1.08 N ATOM 0 H LYS A 405 4.704 8.464 -7.480 1.00 0.17 H new ATOM 0 HA LYS A 405 6.173 5.965 -6.874 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.323 5.933 -8.639 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.315 7.036 -9.572 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.580 4.601 -10.180 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.077 5.427 -9.796 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.110 4.490 -7.570 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.495 3.838 -7.762 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.240 2.120 -8.073 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.239 2.321 -9.498 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 8.631 2.147 -9.978 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 7.950 3.592 -10.552 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 8.898 3.602 -9.144 1.00 1.08 H new ATOM 1318 N GLU A 406 8.345 6.983 -7.491 1.00 0.23 N ATOM 1319 CA GLU A 406 9.624 7.627 -7.690 1.00 0.28 C ATOM 1320 C GLU A 406 10.070 7.507 -9.140 1.00 0.34 C ATOM 1321 O GLU A 406 9.541 6.706 -9.910 1.00 0.43 O ATOM 1322 CB GLU A 406 10.668 7.017 -6.752 1.00 0.29 C ATOM 1323 CG GLU A 406 10.435 5.557 -6.488 1.00 0.63 C ATOM 1324 CD GLU A 406 10.550 4.714 -7.740 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.333 5.083 -8.629 1.00 2.32 O ATOM 1326 OE2 GLU A 406 9.874 3.673 -7.832 1.00 2.42 O ATOM 0 H GLU A 406 8.401 6.056 -7.068 1.00 0.23 H new ATOM 0 HA GLU A 406 9.520 8.687 -7.458 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.659 7.149 -7.185 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.659 7.558 -5.806 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.156 5.205 -5.750 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.444 5.424 -6.054 1.00 0.63 H new ATOM 1333 N PRO A 407 10.970 8.389 -9.536 1.00 0.41 N ATOM 1334 CA PRO A 407 11.665 8.316 -10.807 1.00 0.51 C ATOM 1335 C PRO A 407 12.753 7.235 -10.833 1.00 0.52 C ATOM 1336 O PRO A 407 13.763 7.361 -10.136 1.00 0.54 O ATOM 1337 CB PRO A 407 12.276 9.704 -10.973 1.00 0.61 C ATOM 1338 CG PRO A 407 12.240 10.356 -9.631 1.00 0.58 C ATOM 1339 CD PRO A 407 11.422 9.497 -8.712 1.00 0.45 C ATOM 0 HA PRO A 407 10.986 8.041 -11.615 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.300 9.634 -11.341 1.00 0.61 H new ATOM 0 HB3 PRO A 407 11.714 10.289 -11.702 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.250 10.476 -9.240 1.00 0.58 H new ATOM 0 HG3 PRO A 407 11.806 11.353 -9.705 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.016 9.145 -7.868 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.579 10.052 -8.299 1.00 0.45 H new ATOM 1347 N GLY A 408 12.563 6.184 -11.619 1.00 0.54 N ATOM 1348 CA GLY A 408 13.669 5.280 -11.908 1.00 0.58 C ATOM 1349 C GLY A 408 13.579 3.914 -11.245 1.00 0.58 C ATOM 1350 O GLY A 408 13.921 2.906 -11.868 1.00 0.86 O ATOM 0 H GLY A 408 11.676 5.939 -12.059 1.00 0.54 H new ATOM 0 HA2 GLY A 408 13.730 5.139 -12.987 1.00 0.58 H new ATOM 0 HA3 GLY A 408 14.598 5.757 -11.596 1.00 0.58 H new ATOM 1354 N GLN A 409 13.136 3.856 -9.996 1.00 0.47 N ATOM 1355 CA GLN A 409 13.083 2.588 -9.276 1.00 0.51 C ATOM 1356 C GLN A 409 11.841 1.808 -9.706 1.00 0.48 C ATOM 1357 O GLN A 409 10.956 2.347 -10.370 1.00 0.61 O ATOM 1358 CB GLN A 409 13.079 2.790 -7.757 1.00 0.63 C ATOM 1359 CG GLN A 409 13.925 3.960 -7.275 1.00 0.45 C ATOM 1360 CD GLN A 409 14.434 3.773 -5.858 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.633 4.743 -5.130 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.658 2.525 -5.459 1.00 0.45 N ATOM 0 H GLN A 409 12.811 4.663 -9.464 1.00 0.47 H new ATOM 0 HA GLN A 409 13.981 2.023 -9.526 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.051 2.940 -7.426 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.438 1.878 -7.281 1.00 0.63 H new ATOM 0 HG2 GLN A 409 14.773 4.090 -7.947 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.335 4.875 -7.326 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.480 1.747 -6.094 1.00 0.45 H new ATOM 0 HE22 GLN A 409 15.008 2.346 -4.518 1.00 0.45 H new ATOM 1371 N ARG A 410 11.776 0.547 -9.328 1.00 0.41 N ATOM 1372 CA ARG A 410 10.688 -0.316 -9.751 1.00 0.39 C ATOM 1373 C ARG A 410 9.565 -0.344 -8.731 1.00 0.31 C ATOM 1374 O ARG A 410 8.434 0.032 -9.027 1.00 0.42 O ATOM 1375 CB ARG A 410 11.201 -1.734 -10.031 1.00 0.47 C ATOM 1376 CG ARG A 410 12.063 -2.329 -8.922 1.00 0.86 C ATOM 1377 CD ARG A 410 13.514 -1.923 -9.076 1.00 1.11 C ATOM 1378 NE ARG A 410 14.149 -1.621 -7.790 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.261 -0.899 -7.668 1.00 2.04 C ATOM 1380 NH1 ARG A 410 15.808 -0.332 -8.734 1.00 2.65 N ATOM 1381 NH2 ARG A 410 15.811 -0.734 -6.474 1.00 2.43 N ATOM 0 H ARG A 410 12.465 0.095 -8.727 1.00 0.41 H new ATOM 0 HA ARG A 410 10.281 0.096 -10.675 1.00 0.39 H new ATOM 0 HB2 ARG A 410 10.346 -2.389 -10.199 1.00 0.47 H new ATOM 0 HB3 ARG A 410 11.779 -1.721 -10.955 1.00 0.47 H new ATOM 0 HG2 ARG A 410 11.691 -1.998 -7.952 1.00 0.86 H new ATOM 0 HG3 ARG A 410 11.983 -3.416 -8.940 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.063 -2.725 -9.569 1.00 1.11 H new ATOM 0 HD3 ARG A 410 13.577 -1.048 -9.724 1.00 1.11 H new ATOM 0 HE ARG A 410 13.715 -1.984 -6.941 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.377 -0.448 -9.651 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.660 0.221 -8.637 1.00 2.65 H new ATOM 0 HH21 ARG A 410 15.383 -1.159 -5.652 1.00 2.43 H new ATOM 0 HH22 ARG A 410 16.663 -0.182 -6.377 1.00 2.43 H new ATOM 1395 N LEU A 411 9.886 -0.767 -7.529 1.00 0.21 N ATOM 1396 CA LEU A 411 8.885 -0.985 -6.510 1.00 0.14 C ATOM 1397 C LEU A 411 9.065 -0.024 -5.361 1.00 0.11 C ATOM 1398 O LEU A 411 8.768 -0.342 -4.218 1.00 0.12 O ATOM 1399 CB LEU A 411 8.962 -2.427 -6.045 1.00 0.11 C ATOM 1400 CG LEU A 411 8.592 -3.426 -7.132 1.00 0.11 C ATOM 1401 CD1 LEU A 411 8.947 -4.835 -6.721 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.116 -3.309 -7.442 1.00 0.16 C ATOM 0 H LEU A 411 10.841 -0.968 -7.232 1.00 0.21 H new ATOM 0 HA LEU A 411 7.895 -0.798 -6.926 1.00 0.14 H new ATOM 0 HB2 LEU A 411 9.973 -2.636 -5.696 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.296 -2.564 -5.193 1.00 0.11 H new ATOM 0 HG LEU A 411 9.164 -3.197 -8.031 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.671 -5.527 -7.517 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.019 -4.901 -6.538 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.407 -5.096 -5.811 1.00 0.15 H new ATOM 0 HD21 LEU A 411 6.850 -4.024 -8.220 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.537 -3.520 -6.543 1.00 0.16 H new ATOM 0 HD23 LEU A 411 6.896 -2.299 -7.787 1.00 0.16 H new ATOM 1414 N LEU A 412 9.575 1.144 -5.669 1.00 0.13 N ATOM 1415 CA LEU A 412 9.768 2.162 -4.659 1.00 0.11 C ATOM 1416 C LEU A 412 8.560 3.084 -4.661 1.00 0.10 C ATOM 1417 O LEU A 412 8.113 3.533 -5.713 1.00 0.11 O ATOM 1418 CB LEU A 412 11.039 2.947 -4.961 1.00 0.13 C ATOM 1419 CG LEU A 412 11.723 3.658 -3.789 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.763 4.508 -2.979 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.396 2.643 -2.906 1.00 0.16 C ATOM 0 H LEU A 412 9.864 1.415 -6.609 1.00 0.13 H new ATOM 0 HA LEU A 412 9.871 1.704 -3.675 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.760 2.262 -5.407 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.801 3.696 -5.717 1.00 0.13 H new ATOM 0 HG LEU A 412 12.466 4.338 -4.207 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.302 4.988 -2.162 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.322 5.271 -3.621 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.973 3.877 -2.571 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.882 3.151 -2.073 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.652 1.945 -2.522 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.142 2.097 -3.483 1.00 0.16 H new ATOM 1433 N PHE A 413 8.015 3.352 -3.495 1.00 0.10 N ATOM 1434 CA PHE A 413 6.877 4.232 -3.395 1.00 0.11 C ATOM 1435 C PHE A 413 7.035 5.113 -2.178 1.00 0.12 C ATOM 1436 O PHE A 413 7.538 4.673 -1.146 1.00 0.19 O ATOM 1437 CB PHE A 413 5.577 3.436 -3.286 1.00 0.12 C ATOM 1438 CG PHE A 413 5.372 2.449 -4.392 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.893 1.174 -4.292 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.667 2.791 -5.528 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.717 0.255 -5.306 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.487 1.877 -6.545 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.012 0.606 -6.435 1.00 0.11 C ATOM 0 H PHE A 413 8.342 2.973 -2.606 1.00 0.10 H new ATOM 0 HA PHE A 413 6.829 4.843 -4.296 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.567 2.906 -2.334 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.738 4.131 -3.273 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.446 0.892 -3.408 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.252 3.784 -5.622 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.132 -0.738 -5.214 1.00 0.11 H new ATOM 0 HE2 PHE A 413 3.934 2.157 -7.429 1.00 0.11 H new ATOM 0 HZ PHE A 413 4.871 -0.110 -7.231 1.00 0.11 H new ATOM 1453 N ARG A 414 6.637 6.359 -2.299 1.00 0.10 N ATOM 1454 CA ARG A 414 6.659 7.257 -1.185 1.00 0.12 C ATOM 1455 C ARG A 414 5.266 7.775 -0.906 1.00 0.11 C ATOM 1456 O ARG A 414 4.571 8.232 -1.807 1.00 0.15 O ATOM 1457 CB ARG A 414 7.626 8.398 -1.455 1.00 0.20 C ATOM 1458 CG ARG A 414 7.295 9.659 -0.695 1.00 0.35 C ATOM 1459 CD ARG A 414 8.499 10.571 -0.585 1.00 0.37 C ATOM 1460 NE ARG A 414 9.185 10.711 -1.868 1.00 1.21 N ATOM 1461 CZ ARG A 414 9.955 11.748 -2.196 1.00 1.46 C ATOM 1462 NH1 ARG A 414 10.204 12.700 -1.312 1.00 1.06 N ATOM 1463 NH2 ARG A 414 10.495 11.820 -3.408 1.00 2.58 N ATOM 0 H ARG A 414 6.293 6.768 -3.168 1.00 0.10 H new ATOM 0 HA ARG A 414 7.004 6.723 -0.300 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.635 8.079 -1.192 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.629 8.617 -2.523 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.483 10.185 -1.197 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.940 9.401 0.303 1.00 0.35 H new ATOM 0 HD2 ARG A 414 8.182 11.552 -0.232 1.00 0.37 H new ATOM 0 HD3 ARG A 414 9.191 10.173 0.157 1.00 0.37 H new ATOM 0 HE ARG A 414 9.067 9.968 -2.556 1.00 1.21 H new ATOM 0 HH11 ARG A 414 9.806 12.642 -0.375 1.00 1.06 H new ATOM 0 HH12 ARG A 414 10.794 13.492 -1.568 1.00 1.06 H new ATOM 0 HH21 ARG A 414 10.320 11.081 -4.089 1.00 2.58 H new ATOM 0 HH22 ARG A 414 11.084 12.614 -3.657 1.00 2.58 H new ATOM 1477 N PHE A 415 4.863 7.676 0.335 1.00 0.10 N ATOM 1478 CA PHE A 415 3.567 8.162 0.757 1.00 0.09 C ATOM 1479 C PHE A 415 3.520 9.683 0.658 1.00 0.11 C ATOM 1480 O PHE A 415 4.195 10.388 1.408 1.00 0.14 O ATOM 1481 CB PHE A 415 3.275 7.719 2.192 1.00 0.10 C ATOM 1482 CG PHE A 415 2.541 6.418 2.312 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.154 6.390 2.309 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.233 5.231 2.452 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.474 5.196 2.436 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.566 4.039 2.579 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.184 4.017 2.570 1.00 0.12 C ATOM 0 H PHE A 415 5.419 7.259 1.081 1.00 0.10 H new ATOM 0 HA PHE A 415 2.805 7.742 0.100 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.219 7.638 2.731 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.691 8.496 2.685 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.601 7.312 2.206 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.313 5.241 2.462 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.606 5.182 2.431 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.120 3.118 2.686 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.658 3.079 2.668 1.00 0.12 H new ATOM 1497 N MET A 416 2.736 10.166 -0.301 1.00 0.11 N ATOM 1498 CA MET A 416 2.492 11.595 -0.481 1.00 0.15 C ATOM 1499 C MET A 416 1.994 12.213 0.810 1.00 0.17 C ATOM 1500 O MET A 416 2.318 13.356 1.140 1.00 0.23 O ATOM 1501 CB MET A 416 1.442 11.818 -1.568 1.00 0.15 C ATOM 1502 CG MET A 416 1.946 11.577 -2.974 1.00 0.24 C ATOM 1503 SD MET A 416 3.300 12.681 -3.427 1.00 1.41 S ATOM 1504 CE MET A 416 2.505 14.280 -3.281 1.00 1.47 C ATOM 0 H MET A 416 2.250 9.577 -0.977 1.00 0.11 H new ATOM 0 HA MET A 416 3.431 12.065 -0.773 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.594 11.159 -1.380 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.073 12.841 -1.497 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.280 10.543 -3.064 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.124 11.709 -3.678 1.00 0.24 H new ATOM 0 HE1 MET A 416 3.077 15.023 -3.836 1.00 1.47 H new ATOM 0 HE2 MET A 416 1.495 14.223 -3.687 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.458 14.569 -2.231 1.00 1.47 H new ATOM 1514 N LYS A 417 1.198 11.444 1.525 1.00 0.16 N ATOM 1515 CA LYS A 417 0.647 11.869 2.792 1.00 0.21 C ATOM 1516 C LYS A 417 0.675 10.726 3.781 1.00 0.21 C ATOM 1517 O LYS A 417 0.961 9.586 3.426 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.791 12.340 2.618 1.00 0.29 C ATOM 1519 CG LYS A 417 -0.920 13.703 1.986 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.345 14.198 2.068 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.477 15.608 1.521 1.00 0.84 C ATOM 1522 NZ LYS A 417 -1.993 15.711 0.120 1.00 1.36 N ATOM 0 H LYS A 417 0.916 10.506 1.242 1.00 0.16 H new ATOM 0 HA LYS A 417 1.253 12.694 3.167 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.328 11.615 2.006 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.277 12.356 3.593 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.256 14.406 2.489 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.605 13.657 0.943 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -2.997 13.527 1.509 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -2.680 14.176 3.105 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -3.521 15.918 1.567 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -1.912 16.295 2.151 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -1.282 16.467 0.053 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -1.566 14.807 -0.167 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -2.792 15.931 -0.508 1.00 1.36 H new ATOM 1536 N THR A 418 0.385 11.046 5.021 1.00 0.24 N ATOM 1537 CA THR A 418 0.229 10.038 6.039 1.00 0.24 C ATOM 1538 C THR A 418 -1.252 9.779 6.266 1.00 0.26 C ATOM 1539 O THR A 418 -2.074 10.628 5.932 1.00 0.28 O ATOM 1540 CB THR A 418 0.923 10.462 7.338 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.480 11.766 7.740 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.428 10.458 7.137 1.00 0.22 C ATOM 0 H THR A 418 0.252 12.003 5.348 1.00 0.24 H new ATOM 0 HA THR A 418 0.702 9.114 5.706 1.00 0.24 H new ATOM 0 HB THR A 418 0.665 9.754 8.125 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.875 12.442 7.151 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.919 10.760 8.062 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.756 9.455 6.862 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.691 11.156 6.342 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.616 8.612 6.816 1.00 0.25 N ATOM 1551 CA PRO A 419 -3.017 8.177 6.926 1.00 0.28 C ATOM 1552 C PRO A 419 -3.951 9.253 7.470 1.00 0.31 C ATOM 1553 O PRO A 419 -5.068 9.416 6.984 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.925 6.987 7.875 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.585 6.419 7.582 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.695 7.609 7.383 1.00 0.25 C ATOM 0 HA PRO A 419 -3.448 7.939 5.953 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -3.012 7.296 8.917 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.718 6.263 7.690 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.232 5.795 8.403 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.609 5.790 6.692 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.256 7.947 8.321 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.130 7.389 6.706 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.480 10.007 8.449 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.272 11.084 9.038 1.00 0.42 C ATOM 1566 C ASP A 420 -4.652 12.119 7.980 1.00 0.43 C ATOM 1567 O ASP A 420 -5.798 12.565 7.906 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.492 11.761 10.163 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.273 12.887 10.806 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -5.135 12.602 11.661 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -4.029 14.060 10.456 1.00 0.72 O ATOM 0 H ASP A 420 -2.551 9.896 8.856 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.185 10.649 9.445 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.235 11.021 10.921 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.554 12.151 9.768 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.680 12.475 7.152 1.00 0.42 N ATOM 1577 CA GLU A 421 -3.877 13.429 6.076 1.00 0.45 C ATOM 1578 C GLU A 421 -4.714 12.811 4.956 1.00 0.42 C ATOM 1579 O GLU A 421 -5.541 13.474 4.329 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.518 13.827 5.512 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.569 14.458 6.517 1.00 0.81 C ATOM 1582 CD GLU A 421 -0.177 14.636 5.943 1.00 1.60 C ATOM 1583 OE1 GLU A 421 0.593 13.653 5.930 1.00 2.21 O ATOM 1584 OE2 GLU A 421 0.149 15.753 5.486 1.00 2.17 O ATOM 0 H GLU A 421 -2.730 12.108 7.210 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.400 14.301 6.470 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.042 12.941 5.091 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -2.672 14.527 4.691 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -1.960 15.427 6.828 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.517 13.834 7.409 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.484 11.528 4.719 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.109 10.812 3.618 1.00 0.33 C ATOM 1593 C ILE A 422 -6.592 10.549 3.881 1.00 0.36 C ATOM 1594 O ILE A 422 -7.417 10.556 2.964 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.391 9.471 3.372 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.910 9.698 3.069 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.050 8.722 2.242 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.152 8.421 2.768 1.00 0.27 C ATOM 0 H ILE A 422 -3.859 10.954 5.285 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.024 11.444 2.734 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.467 8.871 4.279 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.821 10.373 2.218 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.445 10.195 3.920 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.531 7.777 2.081 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.092 8.525 2.495 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -5.004 9.321 1.333 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.108 8.657 2.562 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.210 7.752 3.627 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.592 7.933 1.898 1.00 0.27 H new ATOM 1610 N MET A 423 -6.933 10.329 5.138 1.00 0.42 N ATOM 1611 CA MET A 423 -8.300 10.015 5.522 1.00 0.51 C ATOM 1612 C MET A 423 -9.185 11.250 5.522 1.00 0.58 C ATOM 1613 O MET A 423 -10.341 11.210 5.931 1.00 0.71 O ATOM 1614 CB MET A 423 -8.309 9.340 6.881 1.00 0.58 C ATOM 1615 CG MET A 423 -7.694 7.967 6.824 1.00 0.58 C ATOM 1616 SD MET A 423 -7.984 6.999 8.318 1.00 0.90 S ATOM 1617 CE MET A 423 -7.049 7.947 9.515 1.00 2.01 C ATOM 0 H MET A 423 -6.276 10.362 5.918 1.00 0.42 H new ATOM 0 HA MET A 423 -8.712 9.330 4.781 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.762 9.954 7.596 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.334 9.265 7.243 1.00 0.58 H new ATOM 0 HG2 MET A 423 -8.098 7.430 5.966 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.620 8.063 6.663 1.00 0.58 H new ATOM 0 HE1 MET A 423 -7.010 7.403 10.459 1.00 2.01 H new ATOM 0 HE2 MET A 423 -6.036 8.104 9.144 1.00 2.01 H new ATOM 0 HE3 MET A 423 -7.531 8.912 9.672 1.00 2.01 H new ATOM 1627 N SER A 424 -8.633 12.329 5.022 1.00 0.59 N ATOM 1628 CA SER A 424 -9.347 13.596 4.913 1.00 0.72 C ATOM 1629 C SER A 424 -10.196 13.629 3.633 1.00 0.67 C ATOM 1630 O SER A 424 -10.281 14.649 2.946 1.00 1.09 O ATOM 1631 CB SER A 424 -8.343 14.751 4.930 1.00 0.92 C ATOM 1632 OG SER A 424 -8.982 16.001 5.109 1.00 1.57 O ATOM 0 H SER A 424 -7.674 12.362 4.676 1.00 0.59 H new ATOM 0 HA SER A 424 -10.021 13.701 5.763 1.00 0.72 H new ATOM 0 HB2 SER A 424 -7.622 14.594 5.732 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.783 14.760 3.995 1.00 0.92 H new ATOM 0 HG SER A 424 -9.694 16.103 4.443 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.797 12.491 3.299 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.676 12.421 2.144 1.00 0.42 C ATOM 1640 C GLY A 425 -11.033 11.732 0.956 1.00 0.37 C ATOM 1641 O GLY A 425 -11.726 11.168 0.110 1.00 0.50 O ATOM 0 H GLY A 425 -10.691 11.614 3.809 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.586 11.888 2.418 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.972 13.430 1.857 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.706 11.760 0.908 1.00 0.38 N ATOM 1646 CA ARG A 426 -8.959 11.208 -0.222 1.00 0.36 C ATOM 1647 C ARG A 426 -9.288 9.728 -0.438 1.00 0.33 C ATOM 1648 O ARG A 426 -9.720 9.326 -1.518 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.454 11.368 0.013 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.011 12.771 0.360 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.021 13.671 -0.855 1.00 0.92 C ATOM 1652 NE ARG A 426 -8.358 14.169 -1.177 1.00 1.37 N ATOM 1653 CZ ARG A 426 -8.660 15.463 -1.271 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -7.728 16.379 -1.044 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -9.894 15.840 -1.581 1.00 2.67 N ATOM 0 H ARG A 426 -9.121 12.161 1.641 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.252 11.760 -1.115 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.153 10.698 0.818 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -6.925 11.046 -0.884 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.669 13.183 1.125 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.008 12.742 0.785 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.355 14.516 -0.682 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -6.626 13.124 -1.711 1.00 0.92 H new ATOM 0 HE ARG A 426 -9.100 13.488 -1.338 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -6.781 16.092 -0.798 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -7.959 17.370 -1.116 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -10.615 15.138 -1.748 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -10.122 16.832 -1.652 1.00 2.67 H new ATOM 1669 N THR A 427 -9.097 8.931 0.606 1.00 0.33 N ATOM 1670 CA THR A 427 -9.314 7.488 0.524 1.00 0.37 C ATOM 1671 C THR A 427 -10.622 7.080 1.197 1.00 0.43 C ATOM 1672 O THR A 427 -10.859 5.901 1.457 1.00 0.58 O ATOM 1673 CB THR A 427 -8.123 6.723 1.142 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.339 5.315 1.116 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.864 7.154 2.565 1.00 0.41 C ATOM 0 H THR A 427 -8.792 9.258 1.522 1.00 0.33 H new ATOM 0 HA THR A 427 -9.388 7.224 -0.531 1.00 0.37 H new ATOM 0 HB THR A 427 -7.251 6.964 0.533 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.294 5.128 1.231 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.019 6.594 2.967 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.636 8.220 2.587 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.749 6.960 3.171 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.481 8.056 1.453 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.812 7.771 1.984 1.00 0.62 C ATOM 1685 C ASP A 428 -13.609 7.020 0.931 1.00 0.61 C ATOM 1686 O ASP A 428 -14.231 5.994 1.201 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.524 9.075 2.358 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.981 8.873 2.735 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -15.826 8.776 1.825 1.00 1.75 O ATOM 1690 OD2 ASP A 428 -15.281 8.776 3.945 1.00 1.63 O ATOM 0 H ASP A 428 -11.285 9.046 1.304 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.725 7.160 2.883 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -13.000 9.541 3.193 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.465 9.768 1.518 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.537 7.537 -0.285 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.202 6.941 -1.433 1.00 0.65 C ATOM 1697 C ARG A 429 -13.586 5.598 -1.757 1.00 0.55 C ATOM 1698 O ARG A 429 -14.277 4.637 -2.069 1.00 0.66 O ATOM 1699 CB ARG A 429 -14.055 7.867 -2.631 1.00 0.81 C ATOM 1700 CG ARG A 429 -14.251 9.318 -2.268 1.00 0.98 C ATOM 1701 CD ARG A 429 -14.004 10.243 -3.447 1.00 1.12 C ATOM 1702 NE ARG A 429 -12.582 10.350 -3.765 1.00 1.64 N ATOM 1703 CZ ARG A 429 -11.952 11.510 -3.937 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -12.633 12.649 -3.911 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -10.647 11.531 -4.151 1.00 3.05 N ATOM 0 H ARG A 429 -13.014 8.385 -0.505 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.257 6.798 -1.200 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -13.065 7.736 -3.068 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.780 7.586 -3.394 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -15.266 9.465 -1.900 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.576 9.582 -1.454 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -14.544 9.873 -4.318 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -14.401 11.233 -3.222 1.00 1.12 H new ATOM 0 HE ARG A 429 -12.043 9.489 -3.860 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -13.642 12.637 -3.759 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -12.148 13.536 -4.043 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -10.122 10.657 -4.184 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -10.166 12.421 -4.283 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.277 5.551 -1.616 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.466 4.405 -2.018 1.00 0.36 C ATOM 1721 C LEU A 430 -11.972 3.082 -1.464 1.00 0.39 C ATOM 1722 O LEU A 430 -12.007 2.072 -2.170 1.00 0.45 O ATOM 1723 CB LEU A 430 -10.048 4.623 -1.541 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.088 5.123 -2.593 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.824 5.540 -1.913 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.802 4.043 -3.618 1.00 0.56 C ATOM 0 H LEU A 430 -11.733 6.315 -1.214 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.523 4.338 -3.104 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.064 5.337 -0.717 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.667 3.683 -1.141 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.529 5.969 -3.120 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.115 5.905 -2.656 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.040 6.333 -1.197 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.394 4.686 -1.390 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.108 4.426 -4.366 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.360 3.179 -3.122 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.732 3.747 -4.104 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.360 3.105 -0.208 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.796 1.900 0.501 1.00 0.53 C ATOM 1740 C GLU A 431 -13.858 1.093 -0.259 1.00 0.59 C ATOM 1741 O GLU A 431 -13.964 -0.117 -0.076 1.00 0.72 O ATOM 1742 CB GLU A 431 -13.325 2.248 1.898 1.00 0.61 C ATOM 1743 CG GLU A 431 -12.367 3.067 2.743 1.00 0.73 C ATOM 1744 CD GLU A 431 -12.867 3.262 4.162 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -13.821 4.041 4.357 1.00 1.25 O ATOM 1746 OE2 GLU A 431 -12.315 2.634 5.091 1.00 1.31 O ATOM 0 H GLU A 431 -12.386 3.953 0.359 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.909 1.271 0.583 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -14.260 2.799 1.793 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -13.557 1.323 2.426 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -11.396 2.573 2.768 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -12.217 4.041 2.277 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.642 1.744 -1.111 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.724 1.045 -1.799 1.00 0.66 C ATOM 1755 C HIS A 432 -15.209 0.212 -2.978 1.00 0.60 C ATOM 1756 O HIS A 432 -15.719 -0.870 -3.255 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.818 2.027 -2.260 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.595 2.713 -3.573 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -17.592 2.879 -4.509 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -15.496 3.277 -4.097 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -17.109 3.518 -5.556 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -15.834 3.774 -5.333 1.00 3.38 N ATOM 0 H HIS A 432 -14.554 2.734 -1.340 1.00 0.58 H new ATOM 0 HA HIS A 432 -16.166 0.355 -1.080 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -17.761 1.484 -2.315 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -16.935 2.792 -1.492 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -14.523 3.331 -3.632 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -17.662 3.786 -6.444 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -15.204 4.260 -5.972 1.00 3.38 H new ATOM 1771 N LEU A 433 -14.188 0.713 -3.648 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.684 0.082 -4.867 1.00 0.53 C ATOM 1773 C LEU A 433 -12.677 -1.009 -4.563 1.00 0.54 C ATOM 1774 O LEU A 433 -12.524 -1.948 -5.333 1.00 0.67 O ATOM 1775 CB LEU A 433 -13.053 1.111 -5.800 1.00 0.60 C ATOM 1776 CG LEU A 433 -11.891 1.901 -5.218 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -10.685 1.838 -6.144 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.306 3.342 -4.986 1.00 0.88 C ATOM 0 H LEU A 433 -13.686 1.557 -3.373 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.543 -0.370 -5.362 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -12.707 0.597 -6.697 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -13.826 1.813 -6.113 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.612 1.458 -4.262 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -9.864 2.409 -5.711 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.378 0.800 -6.271 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -10.949 2.260 -7.114 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.467 3.900 -4.569 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -12.606 3.791 -5.933 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.144 3.372 -4.289 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.979 -0.868 -3.454 1.00 0.49 N ATOM 1791 CA GLU A 434 -11.009 -1.878 -3.021 1.00 0.60 C ATOM 1792 C GLU A 434 -11.698 -3.100 -2.415 1.00 0.76 C ATOM 1793 O GLU A 434 -11.036 -4.040 -1.964 1.00 1.02 O ATOM 1794 CB GLU A 434 -10.027 -1.279 -2.017 1.00 0.54 C ATOM 1795 CG GLU A 434 -9.180 -0.183 -2.598 1.00 0.63 C ATOM 1796 CD GLU A 434 -8.056 0.244 -1.689 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -7.431 -0.637 -1.075 1.00 1.36 O ATOM 1798 OE2 GLU A 434 -7.799 1.463 -1.579 1.00 1.90 O ATOM 0 H GLU A 434 -12.059 -0.066 -2.829 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.462 -2.206 -3.905 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -10.583 -0.887 -1.165 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -9.378 -2.069 -1.638 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -8.763 -0.519 -3.547 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -9.811 0.679 -2.815 1.00 0.63 H new ATOM 1805 N SER A 435 -13.021 -3.100 -2.458 1.00 0.72 N ATOM 1806 CA SER A 435 -13.822 -4.156 -1.867 1.00 0.89 C ATOM 1807 C SER A 435 -14.061 -5.239 -2.903 1.00 1.03 C ATOM 1808 O SER A 435 -13.720 -6.403 -2.691 1.00 1.20 O ATOM 1809 CB SER A 435 -15.148 -3.576 -1.373 1.00 0.97 C ATOM 1810 OG SER A 435 -16.022 -4.588 -0.905 1.00 1.47 O ATOM 0 H SER A 435 -13.569 -2.365 -2.905 1.00 0.72 H new ATOM 0 HA SER A 435 -13.298 -4.592 -1.017 1.00 0.89 H new ATOM 0 HB2 SER A 435 -14.957 -2.862 -0.572 1.00 0.97 H new ATOM 0 HB3 SER A 435 -15.628 -3.026 -2.182 1.00 0.97 H new ATOM 0 HG SER A 435 -16.858 -4.181 -0.596 1.00 1.47 H new ATOM 1816 N GLN A 436 -14.616 -4.821 -4.040 1.00 1.04 N ATOM 1817 CA GLN A 436 -14.793 -5.668 -5.194 1.00 1.24 C ATOM 1818 C GLN A 436 -15.603 -6.916 -4.860 1.00 1.47 C ATOM 1819 O GLN A 436 -16.657 -6.780 -4.199 1.00 1.78 O ATOM 1820 CB GLN A 436 -13.416 -6.015 -5.725 1.00 1.17 C ATOM 1821 CG GLN A 436 -12.495 -4.811 -5.771 1.00 1.30 C ATOM 1822 CD GLN A 436 -11.033 -5.155 -5.958 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -10.562 -6.221 -5.557 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -10.299 -4.228 -6.539 1.00 2.60 N ATOM 1825 OXT GLN A 436 -15.212 -8.020 -5.292 1.00 2.10 O ATOM 0 H GLN A 436 -14.956 -3.869 -4.176 1.00 1.04 H new ATOM 0 HA GLN A 436 -15.364 -5.142 -5.959 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -12.971 -6.786 -5.096 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -13.511 -6.435 -6.726 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -12.810 -4.158 -6.585 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -12.608 -4.245 -4.846 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -10.731 -3.360 -6.856 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -9.299 -4.378 -6.672 1.00 2.60 H new TER 1834 GLN A 436