USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=27 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 401 ASN : amide:sc= -0.206 K(o=-0.55,f=-1.9) USER MOD Set 1.2: A 417 LYS NZ :NH3+ 158:sc= -0.339 (180deg=-0.498) USER MOD Set 2.1: A 396 HIS : no HD1:sc= -3.52! K(o=-3.7!,f=-2.3) USER MOD Set 2.2: A 399 LYS NZ :NH3+ 166:sc= -0.175 (180deg=-0.781!) USER MOD Set 3.1: A 334 MET CE :methyl -171:sc= -1.5 (180deg=-1.32) USER MOD Set 3.2: A 379 HIS : no HD1:sc= -0.448 K(o=-1.9,f=-3.3) USER MOD Single : A 332 SER OG : rot 180:sc= 0.0187 USER MOD Single : A 333 HIS : no HD1:sc= -0.287 X(o=-0.29,f=-0.041) USER MOD Single : A 340 TYR OH : rot 118:sc= 0.107 USER MOD Single : A 342 TYR OH : rot 117:sc= -0.37! USER MOD Single : A 343 GLN : amide:sc= -2.06 K(o=-2.1,f=-5.2!) USER MOD Single : A 346 SER OG : rot 180:sc= 0.0831 USER MOD Single : A 348 SER OG : rot 61:sc= 0.143 USER MOD Single : A 350 TYR OH : rot 30:sc= -0.0792 USER MOD Single : A 352 ASN : amide:sc= 0.414 K(o=0.41,f=-5.5!) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 101:sc= 1.24 USER MOD Single : A 362 LYS NZ :NH3+ 175:sc= 0.0934 (180deg=0.0923) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.1!) USER MOD Single : A 380 LYS NZ :NH3+ -159:sc= 2.08 (180deg=1.51) USER MOD Single : A 381 ASN : amide:sc= -0.064 X(o=-0.064,f=-0.28) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 385 MET CE :methyl -158:sc= -6.31! (180deg=-7.37!) USER MOD Single : A 386 THR OG1 : rot -160:sc= -1.61 USER MOD Single : A 387 TYR OH : rot 180:sc= -0.0704 USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 MET CE :methyl -165:sc= -5.64! (180deg=-6.01!) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot 86:sc= 0.24 USER MOD Single : A 398 TYR OH : rot -20:sc= 0.503 USER MOD Single : A 405 LYS NZ :NH3+ 171:sc= 0.719 (180deg=0.652) USER MOD Single : A 409 GLN : amide:sc= -4.62! C(o=-4.6!,f=-2.8!) USER MOD Single : A 416 MET CE :methyl -159:sc= -0.125 (180deg=-0.647) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0 USER MOD Single : A 423 MET CE :methyl 156:sc= -0.115 (180deg=-0.638) USER MOD Single : A 424 SER OG : rot -90:sc= 1.15 USER MOD Single : A 427 THR OG1 : rot -48:sc= -1.68 USER MOD Single : A 432 HIS : no HD1:sc= -0.469 K(o=-0.47,f=0.081) USER MOD Single : A 435 SER OG : rot 180:sc= -0.0395 USER MOD Single : A 436 GLN : amide:sc= -0.0126 K(o=-0.013,f=-0.59) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -17.298 -5.880 9.604 1.00 6.78 N ATOM 2 CA GLY A 331 -15.833 -6.109 9.591 1.00 6.11 C ATOM 3 C GLY A 331 -15.070 -4.877 9.159 1.00 5.22 C ATOM 4 O GLY A 331 -14.251 -4.940 8.242 1.00 5.14 O ATOM 0 HA2 GLY A 331 -15.504 -6.408 10.586 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -15.601 -6.934 8.917 1.00 6.11 H new ATOM 10 N SER A 332 -15.313 -3.758 9.831 1.00 4.99 N ATOM 11 CA SER A 332 -14.727 -2.486 9.428 1.00 4.63 C ATOM 12 C SER A 332 -13.290 -2.323 9.933 1.00 3.82 C ATOM 13 O SER A 332 -12.711 -1.242 9.839 1.00 4.13 O ATOM 14 CB SER A 332 -15.608 -1.330 9.906 1.00 5.44 C ATOM 15 OG SER A 332 -15.966 -1.486 11.269 1.00 6.08 O ATOM 0 H SER A 332 -15.911 -3.706 10.656 1.00 4.99 H new ATOM 0 HA SER A 332 -14.680 -2.473 8.339 1.00 4.63 H new ATOM 0 HB2 SER A 332 -15.078 -0.387 9.772 1.00 5.44 H new ATOM 0 HB3 SER A 332 -16.509 -1.279 9.294 1.00 5.44 H new ATOM 0 HG SER A 332 -16.527 -0.733 11.548 1.00 6.08 H new ATOM 21 N HIS A 333 -12.705 -3.397 10.455 1.00 3.28 N ATOM 22 CA HIS A 333 -11.291 -3.380 10.830 1.00 2.94 C ATOM 23 C HIS A 333 -10.440 -3.757 9.616 1.00 2.02 C ATOM 24 O HIS A 333 -9.465 -4.501 9.713 1.00 2.49 O ATOM 25 CB HIS A 333 -11.008 -4.314 12.027 1.00 3.89 C ATOM 26 CG HIS A 333 -11.242 -5.784 11.788 1.00 4.68 C ATOM 27 ND1 HIS A 333 -12.444 -6.409 12.044 1.00 5.34 N ATOM 28 CD2 HIS A 333 -10.407 -6.759 11.353 1.00 5.35 C ATOM 29 CE1 HIS A 333 -12.334 -7.699 11.780 1.00 6.24 C ATOM 30 NE2 HIS A 333 -11.108 -7.941 11.359 1.00 6.26 N ATOM 0 H HIS A 333 -13.181 -4.283 10.627 1.00 3.28 H new ATOM 0 HA HIS A 333 -11.026 -2.373 11.151 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -9.971 -4.176 12.332 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -11.631 -3.999 12.864 1.00 3.89 H new ATOM 0 HD2 HIS A 333 -9.377 -6.630 11.055 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -13.118 -8.433 11.891 1.00 6.24 H new ATOM 0 HE2 HIS A 333 -10.742 -8.852 11.084 1.00 6.26 H new ATOM 39 N MET A 334 -10.820 -3.207 8.476 1.00 1.20 N ATOM 40 CA MET A 334 -10.247 -3.588 7.198 1.00 0.62 C ATOM 41 C MET A 334 -9.336 -2.478 6.681 1.00 0.57 C ATOM 42 O MET A 334 -9.784 -1.356 6.441 1.00 0.92 O ATOM 43 CB MET A 334 -11.394 -3.868 6.218 1.00 1.35 C ATOM 44 CG MET A 334 -11.009 -4.677 4.991 1.00 2.01 C ATOM 45 SD MET A 334 -10.094 -3.722 3.774 1.00 3.03 S ATOM 46 CE MET A 334 -9.924 -4.939 2.476 1.00 3.71 C ATOM 0 H MET A 334 -11.535 -2.483 8.411 1.00 1.20 H new ATOM 0 HA MET A 334 -9.640 -4.487 7.306 1.00 0.62 H new ATOM 0 HB2 MET A 334 -12.185 -4.397 6.750 1.00 1.35 H new ATOM 0 HB3 MET A 334 -11.812 -2.916 5.890 1.00 1.35 H new ATOM 0 HG2 MET A 334 -10.407 -5.531 5.301 1.00 2.01 H new ATOM 0 HG3 MET A 334 -11.912 -5.075 4.528 1.00 2.01 H new ATOM 0 HE1 MET A 334 -9.243 -4.563 1.712 1.00 3.71 H new ATOM 0 HE2 MET A 334 -9.526 -5.864 2.894 1.00 3.71 H new ATOM 0 HE3 MET A 334 -10.899 -5.133 2.029 1.00 3.71 H new ATOM 56 N ARG A 335 -8.051 -2.791 6.543 1.00 0.40 N ATOM 57 CA ARG A 335 -7.070 -1.811 6.086 1.00 0.32 C ATOM 58 C ARG A 335 -7.058 -1.720 4.572 1.00 0.28 C ATOM 59 O ARG A 335 -7.217 -2.723 3.877 1.00 0.42 O ATOM 60 CB ARG A 335 -5.661 -2.163 6.570 1.00 0.37 C ATOM 61 CG ARG A 335 -5.564 -2.351 8.065 1.00 0.56 C ATOM 62 CD ARG A 335 -4.173 -2.033 8.575 1.00 0.93 C ATOM 63 NE ARG A 335 -4.113 -2.049 10.034 1.00 1.32 N ATOM 64 CZ ARG A 335 -3.579 -1.072 10.766 1.00 2.05 C ATOM 65 NH1 ARG A 335 -3.116 0.025 10.181 1.00 2.81 N ATOM 66 NH2 ARG A 335 -3.535 -1.183 12.085 1.00 2.51 N ATOM 0 H ARG A 335 -7.665 -3.714 6.741 1.00 0.40 H new ATOM 0 HA ARG A 335 -7.363 -0.850 6.508 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.334 -3.078 6.075 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.974 -1.373 6.266 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -6.291 -1.708 8.562 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -5.820 -3.379 8.321 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.464 -2.758 8.174 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.867 -1.053 8.209 1.00 0.93 H new ATOM 0 HE ARG A 335 -4.503 -2.856 10.522 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -3.168 0.123 9.167 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -2.708 0.770 10.745 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -3.910 -2.016 12.539 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -3.126 -0.436 12.646 1.00 2.51 H new ATOM 80 N LEU A 336 -6.859 -0.505 4.078 1.00 0.23 N ATOM 81 CA LEU A 336 -6.695 -0.255 2.649 1.00 0.28 C ATOM 82 C LEU A 336 -5.404 -0.886 2.167 1.00 0.14 C ATOM 83 O LEU A 336 -4.653 -1.419 2.970 1.00 0.20 O ATOM 84 CB LEU A 336 -6.642 1.251 2.376 1.00 0.48 C ATOM 85 CG LEU A 336 -7.968 2.002 2.405 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.401 2.318 0.995 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.039 1.200 3.100 1.00 0.67 C ATOM 0 H LEU A 336 -6.807 0.335 4.654 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.544 -0.689 2.120 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -5.978 1.706 3.111 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.187 1.403 1.397 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.823 2.927 2.964 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.349 2.855 1.017 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.645 2.937 0.512 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.522 1.391 0.435 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -9.972 1.764 3.103 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.187 0.257 2.573 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.734 0.998 4.127 1.00 0.67 H new ATOM 99 N LEU A 337 -5.118 -0.806 0.884 1.00 0.15 N ATOM 100 CA LEU A 337 -3.878 -1.367 0.382 1.00 0.12 C ATOM 101 C LEU A 337 -2.703 -0.609 0.988 1.00 0.11 C ATOM 102 O LEU A 337 -1.778 -1.211 1.523 1.00 0.12 O ATOM 103 CB LEU A 337 -3.864 -1.327 -1.152 1.00 0.14 C ATOM 104 CG LEU A 337 -2.658 -1.945 -1.856 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.586 -0.906 -2.038 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.114 -3.134 -1.085 1.00 0.15 C ATOM 0 H LEU A 337 -5.713 -0.368 0.181 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.792 -2.413 0.676 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.760 -1.833 -1.511 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.939 -0.285 -1.463 1.00 0.14 H new ATOM 0 HG LEU A 337 -2.982 -2.305 -2.833 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.728 -1.353 -2.541 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -1.974 -0.085 -2.642 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.278 -0.526 -1.064 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.256 -3.549 -1.614 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.805 -2.812 -0.090 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -2.889 -3.895 -0.996 1.00 0.15 H new ATOM 118 N TRP A 338 -2.783 0.716 0.973 1.00 0.12 N ATOM 119 CA TRP A 338 -1.747 1.539 1.585 1.00 0.14 C ATOM 120 C TRP A 338 -1.744 1.366 3.106 1.00 0.14 C ATOM 121 O TRP A 338 -0.700 1.445 3.747 1.00 0.17 O ATOM 122 CB TRP A 338 -1.921 3.021 1.205 1.00 0.16 C ATOM 123 CG TRP A 338 -3.236 3.619 1.601 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.306 3.834 0.787 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.623 4.088 2.897 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.332 4.394 1.494 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.940 4.558 2.790 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.986 4.151 4.135 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.633 5.081 3.869 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.674 4.664 5.211 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.991 5.125 5.070 1.00 0.21 C ATOM 0 H TRP A 338 -3.548 1.240 0.548 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.783 1.205 1.201 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.121 3.597 1.669 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.802 3.122 0.126 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.339 3.596 -0.266 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.244 4.648 1.114 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.970 3.803 4.248 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.646 5.441 3.762 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -3.193 4.712 6.177 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.507 5.523 5.931 1.00 0.21 H new ATOM 142 N ASP A 339 -2.918 1.112 3.674 1.00 0.14 N ATOM 143 CA ASP A 339 -3.054 0.939 5.121 1.00 0.17 C ATOM 144 C ASP A 339 -2.445 -0.394 5.523 1.00 0.16 C ATOM 145 O ASP A 339 -1.809 -0.534 6.568 1.00 0.23 O ATOM 146 CB ASP A 339 -4.533 0.981 5.518 1.00 0.23 C ATOM 147 CG ASP A 339 -4.753 1.435 6.948 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.033 0.945 7.837 1.00 0.86 O ATOM 149 OD2 ASP A 339 -5.626 2.293 7.187 1.00 1.15 O ATOM 0 H ASP A 339 -3.792 1.021 3.156 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.533 1.747 5.635 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.065 1.653 4.844 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -4.966 -0.011 5.387 1.00 0.23 H new ATOM 154 N TYR A 340 -2.643 -1.364 4.652 1.00 0.11 N ATOM 155 CA TYR A 340 -2.129 -2.703 4.825 1.00 0.10 C ATOM 156 C TYR A 340 -0.605 -2.716 4.756 1.00 0.08 C ATOM 157 O TYR A 340 0.048 -3.378 5.561 1.00 0.09 O ATOM 158 CB TYR A 340 -2.707 -3.592 3.733 1.00 0.11 C ATOM 159 CG TYR A 340 -2.451 -5.043 3.967 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.834 -5.630 5.156 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.825 -5.819 3.012 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.598 -6.958 5.394 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.586 -7.156 3.237 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.973 -7.724 4.435 1.00 0.16 C ATOM 165 OH TYR A 340 -1.732 -9.057 4.673 1.00 0.20 O ATOM 0 H TYR A 340 -3.175 -1.239 3.791 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.422 -3.075 5.807 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.782 -3.424 3.667 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.279 -3.303 2.773 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.327 -5.034 5.910 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.519 -5.372 2.078 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.901 -7.403 6.330 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.100 -7.756 2.482 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.216 -9.599 4.016 1.00 0.20 H new ATOM 175 N VAL A 341 -0.034 -1.977 3.797 1.00 0.08 N ATOM 176 CA VAL A 341 1.420 -1.959 3.636 1.00 0.07 C ATOM 177 C VAL A 341 2.077 -1.399 4.884 1.00 0.08 C ATOM 178 O VAL A 341 3.170 -1.801 5.231 1.00 0.08 O ATOM 179 CB VAL A 341 1.920 -1.157 2.401 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.125 -1.492 1.160 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.935 0.345 2.634 1.00 0.09 C ATOM 0 H VAL A 341 -0.547 -1.395 3.134 1.00 0.08 H new ATOM 0 HA VAL A 341 1.705 -2.998 3.471 1.00 0.07 H new ATOM 0 HB VAL A 341 2.953 -1.466 2.245 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.503 -0.912 0.318 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.223 -2.555 0.941 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.075 -1.250 1.324 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.293 0.849 1.736 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.926 0.688 2.864 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.596 0.577 3.469 1.00 0.09 H new ATOM 191 N TYR A 342 1.399 -0.473 5.553 1.00 0.08 N ATOM 192 CA TYR A 342 1.892 0.071 6.823 1.00 0.10 C ATOM 193 C TYR A 342 2.174 -1.048 7.828 1.00 0.11 C ATOM 194 O TYR A 342 3.187 -1.022 8.528 1.00 0.14 O ATOM 195 CB TYR A 342 0.899 1.066 7.431 1.00 0.11 C ATOM 196 CG TYR A 342 1.048 2.481 6.928 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.219 3.190 7.154 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.015 3.118 6.254 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.359 4.493 6.720 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.152 4.415 5.814 1.00 0.19 C ATOM 201 CZ TYR A 342 1.325 5.100 6.049 1.00 0.17 C ATOM 202 OH TYR A 342 1.455 6.399 5.622 1.00 0.21 O ATOM 0 H TYR A 342 0.510 -0.082 5.243 1.00 0.08 H new ATOM 0 HA TYR A 342 2.822 0.597 6.605 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.114 0.724 7.221 1.00 0.11 H new ATOM 0 HB3 TYR A 342 1.018 1.064 8.514 1.00 0.11 H new ATOM 0 HD1 TYR A 342 3.035 2.715 7.678 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.909 2.589 6.072 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.276 5.032 6.907 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.658 4.895 5.285 1.00 0.19 H new ATOM 0 HH TYR A 342 1.416 6.427 4.643 1.00 0.21 H new ATOM 212 N GLN A 343 1.273 -2.026 7.895 1.00 0.12 N ATOM 213 CA GLN A 343 1.485 -3.216 8.721 1.00 0.18 C ATOM 214 C GLN A 343 2.745 -3.919 8.306 1.00 0.18 C ATOM 215 O GLN A 343 3.650 -4.154 9.094 1.00 0.25 O ATOM 216 CB GLN A 343 0.325 -4.197 8.555 1.00 0.28 C ATOM 217 CG GLN A 343 -0.890 -3.819 9.349 1.00 0.55 C ATOM 218 CD GLN A 343 -0.598 -3.640 10.823 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.263 -2.888 11.524 1.00 1.40 O ATOM 220 NE2 GLN A 343 0.416 -4.319 11.293 1.00 1.15 N ATOM 0 H GLN A 343 0.388 -2.019 7.387 1.00 0.12 H new ATOM 0 HA GLN A 343 1.556 -2.891 9.759 1.00 0.18 H new ATOM 0 HB2 GLN A 343 0.057 -4.257 7.500 1.00 0.28 H new ATOM 0 HB3 GLN A 343 0.653 -5.191 8.857 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.304 -2.893 8.951 1.00 0.55 H new ATOM 0 HG3 GLN A 343 -1.652 -4.588 9.226 1.00 0.55 H new ATOM 0 HE21 GLN A 343 0.946 -4.936 10.677 1.00 1.15 H new ATOM 0 HE22 GLN A 343 0.677 -4.232 12.275 1.00 1.15 H new ATOM 229 N LEU A 344 2.763 -4.229 7.042 1.00 0.15 N ATOM 230 CA LEU A 344 3.824 -4.992 6.420 1.00 0.16 C ATOM 231 C LEU A 344 5.155 -4.239 6.472 1.00 0.18 C ATOM 232 O LEU A 344 6.232 -4.825 6.408 1.00 0.27 O ATOM 233 CB LEU A 344 3.388 -5.250 4.989 1.00 0.13 C ATOM 234 CG LEU A 344 1.932 -5.711 4.855 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.524 -5.784 3.411 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.718 -7.058 5.508 1.00 0.18 C ATOM 0 H LEU A 344 2.025 -3.955 6.393 1.00 0.15 H new ATOM 0 HA LEU A 344 3.990 -5.930 6.949 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.525 -4.338 4.408 1.00 0.13 H new ATOM 0 HB3 LEU A 344 4.040 -6.007 4.552 1.00 0.13 H new ATOM 0 HG LEU A 344 1.312 -4.974 5.365 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.487 -6.113 3.342 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.623 -4.799 2.955 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.165 -6.493 2.887 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.676 -7.356 5.395 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.361 -7.799 5.032 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.964 -6.992 6.568 1.00 0.18 H new ATOM 248 N LEU A 345 5.040 -2.935 6.595 1.00 0.12 N ATOM 249 CA LEU A 345 6.180 -2.030 6.686 1.00 0.13 C ATOM 250 C LEU A 345 6.774 -2.021 8.088 1.00 0.19 C ATOM 251 O LEU A 345 7.978 -2.212 8.270 1.00 0.29 O ATOM 252 CB LEU A 345 5.742 -0.608 6.318 1.00 0.10 C ATOM 253 CG LEU A 345 6.150 -0.113 4.926 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.492 -1.270 4.015 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.049 0.744 4.310 1.00 0.10 C ATOM 0 H LEU A 345 4.139 -2.459 6.636 1.00 0.12 H new ATOM 0 HA LEU A 345 6.942 -2.382 5.991 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.656 -0.553 6.397 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.150 0.079 7.059 1.00 0.10 H new ATOM 0 HG LEU A 345 7.042 0.503 5.041 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.778 -0.889 3.035 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.321 -1.835 4.440 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.624 -1.921 3.912 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.362 1.084 3.323 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.137 0.154 4.219 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.860 1.608 4.948 1.00 0.10 H new ATOM 267 N SER A 346 5.924 -1.784 9.074 1.00 0.25 N ATOM 268 CA SER A 346 6.374 -1.627 10.445 1.00 0.33 C ATOM 269 C SER A 346 6.475 -2.969 11.168 1.00 0.30 C ATOM 270 O SER A 346 6.935 -3.036 12.307 1.00 0.53 O ATOM 271 CB SER A 346 5.454 -0.679 11.182 1.00 0.51 C ATOM 272 OG SER A 346 5.387 0.577 10.520 1.00 1.43 O ATOM 0 H SER A 346 4.916 -1.696 8.948 1.00 0.25 H new ATOM 0 HA SER A 346 7.378 -1.203 10.426 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.456 -1.113 11.250 1.00 0.51 H new ATOM 0 HB3 SER A 346 5.811 -0.539 12.202 1.00 0.51 H new ATOM 0 HG SER A 346 4.786 1.174 11.012 1.00 1.43 H new ATOM 278 N ASP A 347 6.049 -4.036 10.507 1.00 0.32 N ATOM 279 CA ASP A 347 6.201 -5.375 11.056 1.00 0.32 C ATOM 280 C ASP A 347 7.181 -6.167 10.212 1.00 0.30 C ATOM 281 O ASP A 347 7.068 -6.235 8.990 1.00 0.30 O ATOM 282 CB ASP A 347 4.855 -6.095 11.134 1.00 0.35 C ATOM 283 CG ASP A 347 4.748 -6.973 12.363 1.00 0.49 C ATOM 284 OD1 ASP A 347 5.654 -7.802 12.599 1.00 0.58 O ATOM 285 OD2 ASP A 347 3.755 -6.845 13.103 1.00 0.67 O ATOM 0 H ASP A 347 5.597 -4.001 9.593 1.00 0.32 H new ATOM 0 HA ASP A 347 6.590 -5.291 12.071 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.051 -5.359 11.144 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.718 -6.705 10.241 1.00 0.35 H new ATOM 290 N SER A 348 8.126 -6.787 10.887 1.00 0.34 N ATOM 291 CA SER A 348 9.293 -7.363 10.251 1.00 0.35 C ATOM 292 C SER A 348 8.979 -8.649 9.503 1.00 0.31 C ATOM 293 O SER A 348 9.675 -9.023 8.563 1.00 0.32 O ATOM 294 CB SER A 348 10.328 -7.616 11.321 1.00 0.46 C ATOM 295 OG SER A 348 9.726 -7.647 12.607 1.00 1.53 O ATOM 0 H SER A 348 8.106 -6.907 11.900 1.00 0.34 H new ATOM 0 HA SER A 348 9.665 -6.662 9.504 1.00 0.35 H new ATOM 0 HB2 SER A 348 10.833 -8.562 11.128 1.00 0.46 H new ATOM 0 HB3 SER A 348 11.089 -6.836 11.289 1.00 0.46 H new ATOM 0 HG SER A 348 9.068 -8.372 12.643 1.00 1.53 H new ATOM 301 N ARG A 349 7.940 -9.323 9.939 1.00 0.33 N ATOM 302 CA ARG A 349 7.486 -10.557 9.307 1.00 0.35 C ATOM 303 C ARG A 349 7.191 -10.397 7.809 1.00 0.29 C ATOM 304 O ARG A 349 7.117 -11.390 7.083 1.00 0.34 O ATOM 305 CB ARG A 349 6.275 -11.096 10.033 1.00 0.42 C ATOM 306 CG ARG A 349 5.280 -10.036 10.408 1.00 0.55 C ATOM 307 CD ARG A 349 4.141 -10.648 11.177 1.00 0.59 C ATOM 308 NE ARG A 349 3.447 -9.650 11.984 1.00 1.23 N ATOM 309 CZ ARG A 349 2.143 -9.657 12.254 1.00 1.67 C ATOM 310 NH1 ARG A 349 1.365 -10.657 11.861 1.00 1.93 N ATOM 311 NH2 ARG A 349 1.615 -8.654 12.936 1.00 2.56 N ATOM 0 H ARG A 349 7.380 -9.037 10.742 1.00 0.33 H new ATOM 0 HA ARG A 349 8.306 -11.271 9.382 1.00 0.35 H new ATOM 0 HB2 ARG A 349 5.784 -11.837 9.403 1.00 0.42 H new ATOM 0 HB3 ARG A 349 6.602 -11.612 10.936 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.765 -9.267 11.010 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.902 -9.547 9.510 1.00 0.55 H new ATOM 0 HD2 ARG A 349 3.438 -11.110 10.483 1.00 0.59 H new ATOM 0 HD3 ARG A 349 4.520 -11.441 11.822 1.00 0.59 H new ATOM 0 HE ARG A 349 4.004 -8.888 12.371 1.00 1.23 H new ATOM 0 HH11 ARG A 349 1.763 -11.439 11.342 1.00 1.93 H new ATOM 0 HH12 ARG A 349 0.368 -10.643 12.078 1.00 1.93 H new ATOM 0 HH21 ARG A 349 2.206 -7.884 13.250 1.00 2.56 H new ATOM 0 HH22 ARG A 349 0.617 -8.651 13.148 1.00 2.56 H new ATOM 325 N TYR A 350 7.031 -9.160 7.347 1.00 0.22 N ATOM 326 CA TYR A 350 6.681 -8.907 5.956 1.00 0.17 C ATOM 327 C TYR A 350 7.763 -8.132 5.226 1.00 0.16 C ATOM 328 O TYR A 350 7.605 -7.806 4.049 1.00 0.15 O ATOM 329 CB TYR A 350 5.402 -8.103 5.893 1.00 0.17 C ATOM 330 CG TYR A 350 4.305 -8.654 6.746 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.681 -9.837 6.408 1.00 0.24 C ATOM 332 CD2 TYR A 350 3.878 -7.976 7.872 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.658 -10.336 7.162 1.00 0.29 C ATOM 334 CE2 TYR A 350 2.855 -8.468 8.642 1.00 0.28 C ATOM 335 CZ TYR A 350 2.241 -9.654 8.283 1.00 0.31 C ATOM 336 OH TYR A 350 1.211 -10.156 9.044 1.00 0.39 O ATOM 0 H TYR A 350 7.138 -8.320 7.916 1.00 0.22 H new ATOM 0 HA TYR A 350 6.561 -9.877 5.473 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.611 -7.079 6.202 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.060 -8.061 4.859 1.00 0.17 H new ATOM 0 HD1 TYR A 350 4.007 -10.378 5.532 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.355 -7.048 8.149 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.178 -11.262 6.880 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.531 -7.933 9.522 1.00 0.28 H new ATOM 0 HH TYR A 350 1.206 -11.134 8.983 1.00 0.39 H new ATOM 346 N GLU A 351 8.862 -7.846 5.908 1.00 0.18 N ATOM 347 CA GLU A 351 9.902 -6.998 5.330 1.00 0.21 C ATOM 348 C GLU A 351 10.581 -7.669 4.132 1.00 0.21 C ATOM 349 O GLU A 351 11.334 -7.035 3.390 1.00 0.24 O ATOM 350 CB GLU A 351 10.932 -6.598 6.381 1.00 0.28 C ATOM 351 CG GLU A 351 11.788 -7.740 6.869 1.00 0.48 C ATOM 352 CD GLU A 351 12.918 -7.269 7.755 1.00 0.99 C ATOM 353 OE1 GLU A 351 12.642 -6.625 8.789 1.00 1.78 O ATOM 354 OE2 GLU A 351 14.092 -7.515 7.407 1.00 1.05 O ATOM 0 H GLU A 351 9.059 -8.182 6.851 1.00 0.18 H new ATOM 0 HA GLU A 351 9.415 -6.093 4.968 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.578 -5.825 5.965 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.414 -6.156 7.232 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.168 -8.447 7.420 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.199 -8.275 6.013 1.00 0.48 H new ATOM 361 N ASN A 352 10.308 -8.949 3.946 1.00 0.19 N ATOM 362 CA ASN A 352 10.801 -9.685 2.814 1.00 0.21 C ATOM 363 C ASN A 352 9.883 -9.513 1.601 1.00 0.16 C ATOM 364 O ASN A 352 10.236 -9.900 0.489 1.00 0.18 O ATOM 365 CB ASN A 352 10.921 -11.155 3.194 1.00 0.27 C ATOM 366 CG ASN A 352 9.607 -11.796 3.610 1.00 1.03 C ATOM 367 OD1 ASN A 352 8.711 -11.138 4.140 1.00 1.83 O ATOM 368 ND2 ASN A 352 9.489 -13.094 3.379 1.00 1.62 N ATOM 0 H ASN A 352 9.735 -9.502 4.584 1.00 0.19 H new ATOM 0 HA ASN A 352 11.781 -9.298 2.536 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.330 -11.706 2.347 1.00 0.27 H new ATOM 0 HB3 ASN A 352 11.635 -11.251 4.012 1.00 0.27 H new ATOM 0 HD21 ASN A 352 8.634 -13.583 3.642 1.00 1.62 H new ATOM 0 HD22 ASN A 352 10.254 -13.605 2.938 1.00 1.62 H new ATOM 375 N PHE A 353 8.696 -8.958 1.830 1.00 0.13 N ATOM 376 CA PHE A 353 7.768 -8.629 0.758 1.00 0.10 C ATOM 377 C PHE A 353 7.706 -7.118 0.528 1.00 0.08 C ATOM 378 O PHE A 353 7.395 -6.660 -0.568 1.00 0.07 O ATOM 379 CB PHE A 353 6.366 -9.131 1.095 1.00 0.09 C ATOM 380 CG PHE A 353 6.284 -10.601 1.362 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.960 -11.499 0.566 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.533 -11.078 2.416 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.891 -12.852 0.808 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.459 -12.434 2.670 1.00 0.17 C ATOM 385 CZ PHE A 353 6.140 -13.323 1.862 1.00 0.18 C ATOM 0 H PHE A 353 8.353 -8.725 2.762 1.00 0.13 H new ATOM 0 HA PHE A 353 8.129 -9.115 -0.148 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.002 -8.594 1.971 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.697 -8.886 0.270 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.553 -11.136 -0.260 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.998 -10.385 3.049 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.425 -13.543 0.173 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.870 -12.798 3.499 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.084 -14.384 2.056 1.00 0.18 H new ATOM 395 N ILE A 354 8.003 -6.354 1.563 1.00 0.08 N ATOM 396 CA ILE A 354 7.903 -4.898 1.515 1.00 0.07 C ATOM 397 C ILE A 354 8.593 -4.319 2.744 1.00 0.08 C ATOM 398 O ILE A 354 8.642 -4.968 3.781 1.00 0.10 O ATOM 399 CB ILE A 354 6.420 -4.460 1.483 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.258 -2.989 1.096 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.775 -4.719 2.831 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.815 -2.524 1.098 1.00 0.07 C ATOM 0 H ILE A 354 8.320 -6.719 2.461 1.00 0.08 H new ATOM 0 HA ILE A 354 8.386 -4.529 0.610 1.00 0.07 H new ATOM 0 HB ILE A 354 5.921 -5.053 0.717 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.832 -2.373 1.788 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.682 -2.833 0.104 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.731 -4.408 2.800 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.830 -5.783 3.062 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.300 -4.153 3.600 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.771 -1.472 0.815 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.241 -3.116 0.385 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.394 -2.649 2.096 1.00 0.07 H new ATOM 414 N ARG A 355 9.138 -3.124 2.637 1.00 0.09 N ATOM 415 CA ARG A 355 9.865 -2.541 3.760 1.00 0.11 C ATOM 416 C ARG A 355 10.050 -1.045 3.606 1.00 0.10 C ATOM 417 O ARG A 355 10.095 -0.523 2.493 1.00 0.14 O ATOM 418 CB ARG A 355 11.227 -3.204 3.913 1.00 0.16 C ATOM 419 CG ARG A 355 12.110 -3.050 2.695 1.00 0.22 C ATOM 420 CD ARG A 355 13.486 -3.616 2.952 1.00 0.25 C ATOM 421 NE ARG A 355 13.443 -5.025 3.342 1.00 0.98 N ATOM 422 CZ ARG A 355 14.084 -5.524 4.398 1.00 1.40 C ATOM 423 NH1 ARG A 355 14.758 -4.720 5.210 1.00 1.43 N ATOM 424 NH2 ARG A 355 14.025 -6.826 4.653 1.00 2.08 N ATOM 0 H ARG A 355 9.096 -2.541 1.801 1.00 0.09 H new ATOM 0 HA ARG A 355 9.265 -2.717 4.652 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.736 -2.777 4.778 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.085 -4.265 4.118 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.656 -3.559 1.845 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.190 -1.996 2.430 1.00 0.22 H new ATOM 0 HD2 ARG A 355 14.094 -3.508 2.054 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.973 -3.039 3.738 1.00 0.25 H new ATOM 0 HE ARG A 355 12.889 -5.664 2.771 1.00 0.98 H new ATOM 0 HH11 ARG A 355 14.786 -3.717 5.027 1.00 1.43 H new ATOM 0 HH12 ARG A 355 15.248 -5.105 6.018 1.00 1.43 H new ATOM 0 HH21 ARG A 355 13.490 -7.442 4.041 1.00 2.08 H new ATOM 0 HH22 ARG A 355 14.515 -7.210 5.461 1.00 2.08 H new ATOM 438 N TRP A 356 10.150 -0.364 4.739 1.00 0.10 N ATOM 439 CA TRP A 356 10.458 1.053 4.758 1.00 0.09 C ATOM 440 C TRP A 356 11.889 1.290 4.303 1.00 0.09 C ATOM 441 O TRP A 356 12.823 0.649 4.794 1.00 0.14 O ATOM 442 CB TRP A 356 10.341 1.630 6.164 1.00 0.10 C ATOM 443 CG TRP A 356 8.955 1.814 6.697 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.463 1.293 7.857 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.895 2.596 6.127 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.179 1.721 8.063 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.802 2.512 7.010 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.758 3.358 4.964 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.602 3.160 6.773 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.561 4.003 4.726 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.495 3.903 5.626 1.00 0.13 C ATOM 0 H TRP A 356 10.020 -0.777 5.663 1.00 0.10 H new ATOM 0 HA TRP A 356 9.745 1.537 4.091 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.885 0.978 6.847 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.843 2.597 6.179 1.00 0.10 H new ATOM 0 HD1 TRP A 356 9.008 0.636 8.519 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.598 1.489 8.869 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.575 3.441 4.263 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.779 3.083 7.468 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.446 4.595 3.830 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.571 4.420 5.413 1.00 0.13 H new ATOM 462 N GLU A 357 12.049 2.213 3.381 1.00 0.10 N ATOM 463 CA GLU A 357 13.359 2.717 3.022 1.00 0.12 C ATOM 464 C GLU A 357 13.641 3.961 3.848 1.00 0.14 C ATOM 465 O GLU A 357 14.767 4.215 4.273 1.00 0.21 O ATOM 466 CB GLU A 357 13.410 3.049 1.537 1.00 0.16 C ATOM 467 CG GLU A 357 13.373 1.824 0.644 1.00 0.25 C ATOM 468 CD GLU A 357 14.569 0.915 0.844 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.503 0.020 1.716 1.00 0.61 O ATOM 470 OE2 GLU A 357 15.578 1.091 0.136 1.00 0.78 O ATOM 0 H GLU A 357 11.280 2.635 2.860 1.00 0.10 H new ATOM 0 HA GLU A 357 14.114 1.958 3.225 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.569 3.696 1.288 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.319 3.613 1.330 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.459 1.263 0.842 1.00 0.25 H new ATOM 0 HG3 GLU A 357 13.333 2.141 -0.398 1.00 0.25 H new ATOM 477 N ASP A 358 12.583 4.724 4.068 1.00 0.14 N ATOM 478 CA ASP A 358 12.620 5.901 4.920 1.00 0.16 C ATOM 479 C ASP A 358 11.254 6.077 5.561 1.00 0.16 C ATOM 480 O ASP A 358 10.368 6.686 4.970 1.00 0.20 O ATOM 481 CB ASP A 358 12.943 7.148 4.100 1.00 0.20 C ATOM 482 CG ASP A 358 13.865 8.102 4.829 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.385 8.858 5.702 1.00 1.46 O ATOM 484 OD2 ASP A 358 15.073 8.105 4.524 1.00 1.33 O ATOM 0 H ASP A 358 11.667 4.542 3.657 1.00 0.14 H new ATOM 0 HA ASP A 358 13.391 5.768 5.679 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.405 6.850 3.159 1.00 0.20 H new ATOM 0 HB3 ASP A 358 12.016 7.664 3.850 1.00 0.20 H new ATOM 489 N LYS A 359 11.081 5.533 6.760 1.00 0.15 N ATOM 490 CA LYS A 359 9.772 5.486 7.403 1.00 0.17 C ATOM 491 C LYS A 359 9.167 6.867 7.605 1.00 0.19 C ATOM 492 O LYS A 359 7.994 7.076 7.330 1.00 0.23 O ATOM 493 CB LYS A 359 9.856 4.785 8.750 1.00 0.23 C ATOM 494 CG LYS A 359 8.484 4.544 9.364 1.00 0.29 C ATOM 495 CD LYS A 359 8.548 3.754 10.651 1.00 0.38 C ATOM 496 CE LYS A 359 9.542 2.632 10.558 1.00 0.91 C ATOM 497 NZ LYS A 359 9.813 2.003 11.879 1.00 1.50 N ATOM 0 H LYS A 359 11.833 5.117 7.309 1.00 0.15 H new ATOM 0 HA LYS A 359 9.124 4.926 6.728 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.370 3.831 8.629 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.456 5.386 9.433 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.003 5.503 9.556 1.00 0.29 H new ATOM 0 HG3 LYS A 359 7.859 4.012 8.647 1.00 0.29 H new ATOM 0 HD2 LYS A 359 8.821 4.416 11.473 1.00 0.38 H new ATOM 0 HD3 LYS A 359 7.562 3.350 10.881 1.00 0.38 H new ATOM 0 HE2 LYS A 359 9.168 1.875 9.868 1.00 0.91 H new ATOM 0 HE3 LYS A 359 10.475 3.011 10.141 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 10.504 1.235 11.762 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 10.195 2.717 12.532 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 8.929 1.617 12.268 1.00 1.50 H new ATOM 511 N GLU A 360 9.955 7.805 8.085 1.00 0.21 N ATOM 512 CA GLU A 360 9.438 9.126 8.387 1.00 0.27 C ATOM 513 C GLU A 360 9.384 10.016 7.157 1.00 0.24 C ATOM 514 O GLU A 360 8.792 11.097 7.182 1.00 0.37 O ATOM 515 CB GLU A 360 10.226 9.756 9.513 1.00 0.41 C ATOM 516 CG GLU A 360 9.857 9.141 10.845 1.00 0.63 C ATOM 517 CD GLU A 360 8.408 9.411 11.200 1.00 1.75 C ATOM 518 OE1 GLU A 360 7.524 8.653 10.739 1.00 2.67 O ATOM 519 OE2 GLU A 360 8.141 10.397 11.914 1.00 1.97 O ATOM 0 H GLU A 360 10.950 7.681 8.274 1.00 0.21 H new ATOM 0 HA GLU A 360 8.407 9.014 8.721 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.293 9.626 9.332 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.035 10.829 9.539 1.00 0.41 H new ATOM 0 HG2 GLU A 360 10.030 8.065 10.810 1.00 0.63 H new ATOM 0 HG3 GLU A 360 10.504 9.543 11.624 1.00 0.63 H new ATOM 526 N SER A 361 9.982 9.550 6.078 1.00 0.19 N ATOM 527 CA SER A 361 9.767 10.150 4.776 1.00 0.21 C ATOM 528 C SER A 361 8.682 9.361 4.047 1.00 0.19 C ATOM 529 O SER A 361 8.360 9.633 2.890 1.00 0.24 O ATOM 530 CB SER A 361 11.070 10.153 3.978 1.00 0.26 C ATOM 531 OG SER A 361 12.053 10.953 4.610 1.00 0.31 O ATOM 0 H SER A 361 10.622 8.756 6.078 1.00 0.19 H new ATOM 0 HA SER A 361 9.443 11.185 4.889 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.439 9.133 3.874 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.883 10.528 2.972 1.00 0.26 H new ATOM 0 HG SER A 361 12.680 10.378 5.096 1.00 0.31 H new ATOM 537 N LYS A 362 8.121 8.381 4.773 1.00 0.15 N ATOM 538 CA LYS A 362 7.105 7.484 4.276 1.00 0.14 C ATOM 539 C LYS A 362 7.482 6.875 2.932 1.00 0.12 C ATOM 540 O LYS A 362 6.665 6.764 2.024 1.00 0.15 O ATOM 541 CB LYS A 362 5.765 8.199 4.239 1.00 0.20 C ATOM 542 CG LYS A 362 4.763 7.568 5.181 1.00 0.48 C ATOM 543 CD LYS A 362 5.212 7.593 6.632 1.00 0.48 C ATOM 544 CE LYS A 362 5.412 8.999 7.160 1.00 0.51 C ATOM 545 NZ LYS A 362 5.590 9.008 8.638 1.00 1.23 N ATOM 0 H LYS A 362 8.378 8.199 5.743 1.00 0.15 H new ATOM 0 HA LYS A 362 7.020 6.641 4.961 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.905 9.246 4.506 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.371 8.179 3.223 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.811 8.091 5.092 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.589 6.535 4.878 1.00 0.48 H new ATOM 0 HD2 LYS A 362 4.471 7.081 7.246 1.00 0.48 H new ATOM 0 HD3 LYS A 362 6.145 7.037 6.729 1.00 0.48 H new ATOM 0 HE2 LYS A 362 6.285 9.446 6.685 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.553 9.615 6.892 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.808 9.974 8.955 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 4.714 8.683 9.095 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 6.372 8.373 8.897 1.00 1.23 H new ATOM 559 N ILE A 363 8.731 6.456 2.841 1.00 0.09 N ATOM 560 CA ILE A 363 9.259 5.818 1.654 1.00 0.09 C ATOM 561 C ILE A 363 9.438 4.335 1.906 1.00 0.08 C ATOM 562 O ILE A 363 10.051 3.941 2.898 1.00 0.10 O ATOM 563 CB ILE A 363 10.617 6.430 1.271 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.435 7.881 0.829 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.290 5.605 0.183 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.706 8.695 0.889 1.00 0.46 C ATOM 0 H ILE A 363 9.411 6.551 3.596 1.00 0.09 H new ATOM 0 HA ILE A 363 8.554 5.973 0.837 1.00 0.09 H new ATOM 0 HB ILE A 363 11.266 6.419 2.146 1.00 0.10 H new ATOM 0 HG12 ILE A 363 10.052 7.896 -0.191 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.681 8.352 1.460 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.249 6.055 -0.074 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.450 4.589 0.544 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.653 5.580 -0.701 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.501 9.714 0.561 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.080 8.711 1.913 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.456 8.248 0.236 1.00 0.46 H new ATOM 578 N PHE A 364 8.920 3.515 1.017 1.00 0.09 N ATOM 579 CA PHE A 364 9.008 2.082 1.180 1.00 0.09 C ATOM 580 C PHE A 364 9.307 1.421 -0.158 1.00 0.10 C ATOM 581 O PHE A 364 8.994 1.964 -1.217 1.00 0.13 O ATOM 582 CB PHE A 364 7.709 1.526 1.781 1.00 0.09 C ATOM 583 CG PHE A 364 6.532 1.527 0.855 1.00 0.08 C ATOM 584 CD1 PHE A 364 6.272 0.438 0.045 1.00 0.12 C ATOM 585 CD2 PHE A 364 5.685 2.608 0.811 1.00 0.13 C ATOM 586 CE1 PHE A 364 5.179 0.431 -0.798 1.00 0.12 C ATOM 587 CE2 PHE A 364 4.587 2.614 -0.029 1.00 0.14 C ATOM 588 CZ PHE A 364 4.334 1.519 -0.835 1.00 0.08 C ATOM 0 H PHE A 364 8.433 3.818 0.173 1.00 0.09 H new ATOM 0 HA PHE A 364 9.823 1.858 1.869 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.889 0.504 2.114 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.457 2.110 2.666 1.00 0.09 H new ATOM 0 HD1 PHE A 364 6.931 -0.417 0.072 1.00 0.12 H new ATOM 0 HD2 PHE A 364 5.879 3.464 1.441 1.00 0.13 H new ATOM 0 HE1 PHE A 364 4.986 -0.425 -1.427 1.00 0.12 H new ATOM 0 HE2 PHE A 364 3.929 3.470 -0.056 1.00 0.14 H new ATOM 0 HZ PHE A 364 3.477 1.517 -1.492 1.00 0.08 H new ATOM 598 N ARG A 365 9.933 0.267 -0.100 1.00 0.10 N ATOM 599 CA ARG A 365 10.203 -0.529 -1.279 1.00 0.12 C ATOM 600 C ARG A 365 9.408 -1.819 -1.198 1.00 0.11 C ATOM 601 O ARG A 365 9.490 -2.527 -0.193 1.00 0.18 O ATOM 602 CB ARG A 365 11.694 -0.872 -1.344 1.00 0.17 C ATOM 603 CG ARG A 365 12.089 -1.708 -2.550 1.00 0.17 C ATOM 604 CD ARG A 365 12.430 -0.835 -3.746 1.00 0.31 C ATOM 605 NE ARG A 365 13.846 -0.939 -4.129 1.00 0.77 N ATOM 606 CZ ARG A 365 14.866 -0.419 -3.439 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.657 0.219 -2.297 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.101 -0.559 -3.901 1.00 0.99 N ATOM 0 H ARG A 365 10.271 -0.148 0.768 1.00 0.10 H new ATOM 0 HA ARG A 365 9.920 0.035 -2.167 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.268 0.054 -1.354 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.972 -1.409 -0.437 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.947 -2.331 -2.297 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.272 -2.381 -2.811 1.00 0.17 H new ATOM 0 HD2 ARG A 365 11.805 -1.122 -4.592 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.194 0.204 -3.514 1.00 0.31 H new ATOM 0 HE ARG A 365 14.067 -1.446 -4.986 1.00 0.77 H new ATOM 0 HH11 ARG A 365 13.709 0.318 -1.934 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.444 0.611 -1.780 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.265 -1.059 -4.775 1.00 0.99 H new ATOM 0 HH22 ARG A 365 16.887 -0.166 -3.383 1.00 0.99 H new ATOM 622 N ILE A 366 8.623 -2.124 -2.217 1.00 0.07 N ATOM 623 CA ILE A 366 8.020 -3.424 -2.294 1.00 0.06 C ATOM 624 C ILE A 366 9.094 -4.418 -2.676 1.00 0.07 C ATOM 625 O ILE A 366 9.611 -4.422 -3.788 1.00 0.10 O ATOM 626 CB ILE A 366 6.831 -3.450 -3.270 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.664 -2.672 -2.647 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.430 -4.885 -3.596 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.540 -2.371 -3.604 1.00 0.09 C ATOM 0 H ILE A 366 8.397 -1.494 -2.986 1.00 0.07 H new ATOM 0 HA ILE A 366 7.604 -3.694 -1.323 1.00 0.06 H new ATOM 0 HB ILE A 366 7.116 -2.976 -4.209 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.268 -3.244 -1.808 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.043 -1.733 -2.243 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.588 -4.879 -4.288 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.272 -5.403 -4.055 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.143 -5.400 -2.679 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.757 -1.820 -3.084 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.918 -1.771 -4.432 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.131 -3.305 -3.990 1.00 0.09 H new ATOM 641 N VAL A 367 9.458 -5.210 -1.704 1.00 0.07 N ATOM 642 CA VAL A 367 10.590 -6.108 -1.815 1.00 0.08 C ATOM 643 C VAL A 367 10.224 -7.336 -2.629 1.00 0.09 C ATOM 644 O VAL A 367 10.963 -7.764 -3.514 1.00 0.12 O ATOM 645 CB VAL A 367 11.058 -6.517 -0.413 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.150 -7.564 -0.485 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.523 -5.292 0.354 1.00 0.10 C ATOM 0 H VAL A 367 8.979 -5.255 -0.805 1.00 0.07 H new ATOM 0 HA VAL A 367 11.401 -5.592 -2.329 1.00 0.08 H new ATOM 0 HB VAL A 367 10.217 -6.962 0.119 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.462 -7.834 0.524 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.773 -8.449 -0.998 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.003 -7.163 -1.033 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.854 -5.590 1.349 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.350 -4.822 -0.178 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.699 -4.584 0.443 1.00 0.10 H new ATOM 657 N ASP A 368 9.073 -7.887 -2.320 1.00 0.08 N ATOM 658 CA ASP A 368 8.536 -9.019 -3.039 1.00 0.09 C ATOM 659 C ASP A 368 7.047 -8.823 -3.216 1.00 0.08 C ATOM 660 O ASP A 368 6.242 -9.217 -2.379 1.00 0.09 O ATOM 661 CB ASP A 368 8.855 -10.317 -2.306 1.00 0.12 C ATOM 662 CG ASP A 368 8.299 -11.559 -2.989 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.633 -11.415 -4.037 1.00 0.45 O ATOM 664 OD2 ASP A 368 8.512 -12.681 -2.488 1.00 0.78 O ATOM 0 H ASP A 368 8.479 -7.560 -1.558 1.00 0.08 H new ATOM 0 HA ASP A 368 8.997 -9.090 -4.024 1.00 0.09 H new ATOM 0 HB2 ASP A 368 9.937 -10.416 -2.216 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.455 -10.260 -1.294 1.00 0.12 H new ATOM 669 N PRO A 369 6.693 -8.173 -4.322 1.00 0.09 N ATOM 670 CA PRO A 369 5.316 -7.827 -4.668 1.00 0.10 C ATOM 671 C PRO A 369 4.437 -9.051 -4.809 1.00 0.12 C ATOM 672 O PRO A 369 3.246 -9.010 -4.517 1.00 0.14 O ATOM 673 CB PRO A 369 5.457 -7.107 -6.013 1.00 0.12 C ATOM 674 CG PRO A 369 6.782 -7.516 -6.538 1.00 0.12 C ATOM 675 CD PRO A 369 7.642 -7.719 -5.337 1.00 0.10 C ATOM 0 HA PRO A 369 4.839 -7.222 -3.896 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.658 -7.392 -6.697 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.400 -6.026 -5.888 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.706 -8.431 -7.125 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.198 -6.751 -7.193 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.421 -8.459 -5.520 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.141 -6.797 -5.038 1.00 0.10 H new ATOM 683 N ASN A 370 5.040 -10.139 -5.245 1.00 0.13 N ATOM 684 CA ASN A 370 4.347 -11.406 -5.373 1.00 0.17 C ATOM 685 C ASN A 370 3.944 -11.889 -3.995 1.00 0.17 C ATOM 686 O ASN A 370 2.798 -12.271 -3.749 1.00 0.21 O ATOM 687 CB ASN A 370 5.275 -12.414 -6.020 1.00 0.21 C ATOM 688 CG ASN A 370 4.539 -13.633 -6.525 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.044 -13.657 -7.652 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.474 -14.657 -5.696 1.00 0.59 N ATOM 0 H ASN A 370 6.022 -10.170 -5.520 1.00 0.13 H new ATOM 0 HA ASN A 370 3.456 -11.287 -5.990 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.800 -11.940 -6.850 1.00 0.21 H new ATOM 0 HB3 ASN A 370 6.032 -12.723 -5.299 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.999 -15.514 -5.980 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.899 -14.592 -4.771 1.00 0.59 H new ATOM 697 N GLY A 371 4.913 -11.837 -3.101 1.00 0.16 N ATOM 698 CA GLY A 371 4.684 -12.177 -1.716 1.00 0.19 C ATOM 699 C GLY A 371 3.732 -11.209 -1.051 1.00 0.13 C ATOM 700 O GLY A 371 2.926 -11.589 -0.202 1.00 0.13 O ATOM 0 H GLY A 371 5.871 -11.560 -3.315 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.279 -13.187 -1.652 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.633 -12.179 -1.180 1.00 0.19 H new ATOM 704 N LEU A 372 3.807 -9.957 -1.475 1.00 0.10 N ATOM 705 CA LEU A 372 3.077 -8.879 -0.829 1.00 0.08 C ATOM 706 C LEU A 372 1.613 -8.944 -1.240 1.00 0.11 C ATOM 707 O LEU A 372 0.708 -8.721 -0.441 1.00 0.13 O ATOM 708 CB LEU A 372 3.687 -7.527 -1.226 1.00 0.08 C ATOM 709 CG LEU A 372 3.555 -6.394 -0.200 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.137 -5.863 -0.123 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.993 -6.880 1.165 1.00 0.09 C ATOM 0 H LEU A 372 4.372 -9.661 -2.271 1.00 0.10 H new ATOM 0 HA LEU A 372 3.146 -8.986 0.254 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.746 -7.678 -1.435 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.222 -7.202 -2.157 1.00 0.08 H new ATOM 0 HG LEU A 372 4.199 -5.578 -0.527 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.088 -5.062 0.615 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.840 -5.476 -1.098 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.462 -6.668 0.169 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.896 -6.070 1.888 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.366 -7.717 1.472 1.00 0.09 H new ATOM 0 HD23 LEU A 372 5.033 -7.204 1.120 1.00 0.09 H new ATOM 723 N ALA A 373 1.399 -9.256 -2.507 1.00 0.12 N ATOM 724 CA ALA A 373 0.061 -9.367 -3.058 1.00 0.15 C ATOM 725 C ALA A 373 -0.660 -10.572 -2.484 1.00 0.14 C ATOM 726 O ALA A 373 -1.881 -10.564 -2.333 1.00 0.16 O ATOM 727 CB ALA A 373 0.137 -9.468 -4.562 1.00 0.20 C ATOM 0 H ALA A 373 2.144 -9.438 -3.179 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.504 -8.475 -2.787 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.869 -9.551 -4.972 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.620 -8.577 -4.963 1.00 0.20 H new ATOM 0 HB3 ALA A 373 0.716 -10.349 -4.839 1.00 0.20 H new ATOM 733 N ARG A 374 0.103 -11.609 -2.163 1.00 0.14 N ATOM 734 CA ARG A 374 -0.451 -12.782 -1.519 1.00 0.17 C ATOM 735 C ARG A 374 -0.950 -12.407 -0.126 1.00 0.14 C ATOM 736 O ARG A 374 -1.933 -12.951 0.359 1.00 0.16 O ATOM 737 CB ARG A 374 0.595 -13.906 -1.477 1.00 0.24 C ATOM 738 CG ARG A 374 0.942 -14.397 -0.090 1.00 0.28 C ATOM 739 CD ARG A 374 1.609 -15.763 -0.139 1.00 0.47 C ATOM 740 NE ARG A 374 0.805 -16.741 -0.874 1.00 1.44 N ATOM 741 CZ ARG A 374 0.731 -18.039 -0.569 1.00 2.04 C ATOM 742 NH1 ARG A 374 1.400 -18.530 0.468 1.00 2.01 N ATOM 743 NH2 ARG A 374 -0.012 -18.848 -1.311 1.00 3.03 N ATOM 0 H ARG A 374 1.106 -11.657 -2.340 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.301 -13.156 -2.090 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.227 -14.748 -2.064 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.506 -13.554 -1.961 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.607 -13.682 0.395 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.037 -14.453 0.515 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.588 -15.672 -0.610 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.776 -16.121 0.877 1.00 0.47 H new ATOM 0 HE ARG A 374 0.265 -16.409 -1.673 1.00 1.44 H new ATOM 0 HH11 ARG A 374 1.977 -17.914 1.040 1.00 2.01 H new ATOM 0 HH12 ARG A 374 1.336 -19.523 0.692 1.00 2.01 H new ATOM 0 HH21 ARG A 374 -0.525 -18.478 -2.112 1.00 3.03 H new ATOM 0 HH22 ARG A 374 -0.071 -19.840 -1.081 1.00 3.03 H new ATOM 757 N LEU A 375 -0.267 -11.451 0.492 1.00 0.13 N ATOM 758 CA LEU A 375 -0.719 -10.854 1.750 1.00 0.15 C ATOM 759 C LEU A 375 -1.998 -10.072 1.510 1.00 0.16 C ATOM 760 O LEU A 375 -2.988 -10.230 2.220 1.00 0.18 O ATOM 761 CB LEU A 375 0.338 -9.886 2.288 1.00 0.17 C ATOM 762 CG LEU A 375 1.409 -10.443 3.222 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.813 -11.853 2.849 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.617 -9.529 3.168 1.00 0.15 C ATOM 0 H LEU A 375 0.611 -11.067 0.141 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.889 -11.654 2.470 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.842 -9.433 1.434 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.180 -9.084 2.814 1.00 0.17 H new ATOM 0 HG LEU A 375 1.000 -10.484 4.232 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.577 -12.208 3.541 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.943 -12.507 2.903 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.211 -11.861 1.834 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.393 -9.912 3.830 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.998 -9.489 2.147 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.330 -8.527 3.487 1.00 0.15 H new ATOM 776 N TRP A 376 -1.948 -9.222 0.495 1.00 0.16 N ATOM 777 CA TRP A 376 -3.060 -8.358 0.132 1.00 0.18 C ATOM 778 C TRP A 376 -4.326 -9.174 -0.119 1.00 0.20 C ATOM 779 O TRP A 376 -5.391 -8.869 0.419 1.00 0.25 O ATOM 780 CB TRP A 376 -2.677 -7.543 -1.106 1.00 0.19 C ATOM 781 CG TRP A 376 -3.693 -6.519 -1.510 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.105 -6.236 -2.780 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.426 -5.640 -0.649 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.042 -5.239 -2.762 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.259 -4.861 -1.471 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.462 -5.432 0.734 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.120 -3.904 -0.962 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.316 -4.471 1.238 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.137 -3.720 0.389 1.00 0.24 C ATOM 0 H TRP A 376 -1.129 -9.112 -0.103 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.272 -7.678 0.957 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.728 -7.041 -0.917 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.515 -8.226 -1.940 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.744 -6.728 -3.671 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.503 -4.843 -3.581 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.834 -6.012 1.394 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.757 -3.323 -1.613 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.351 -4.296 2.303 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.798 -2.979 0.813 1.00 0.24 H new ATOM 800 N GLY A 377 -4.199 -10.222 -0.919 1.00 0.21 N ATOM 801 CA GLY A 377 -5.322 -11.099 -1.168 1.00 0.27 C ATOM 802 C GLY A 377 -5.734 -11.849 0.080 1.00 0.30 C ATOM 803 O GLY A 377 -6.917 -12.055 0.322 1.00 0.38 O ATOM 0 H GLY A 377 -3.337 -10.480 -1.400 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.165 -10.515 -1.536 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -5.061 -11.811 -1.951 1.00 0.27 H new ATOM 807 N ASN A 378 -4.750 -12.240 0.881 1.00 0.27 N ATOM 808 CA ASN A 378 -4.999 -12.912 2.153 1.00 0.30 C ATOM 809 C ASN A 378 -5.824 -12.035 3.087 1.00 0.30 C ATOM 810 O ASN A 378 -6.705 -12.518 3.797 1.00 0.35 O ATOM 811 CB ASN A 378 -3.679 -13.280 2.812 1.00 0.32 C ATOM 812 CG ASN A 378 -3.336 -14.741 2.629 1.00 0.38 C ATOM 813 OD1 ASN A 378 -4.210 -15.610 2.613 1.00 0.76 O ATOM 814 ND2 ASN A 378 -2.060 -15.012 2.458 1.00 0.42 N ATOM 0 H ASN A 378 -3.762 -12.102 0.670 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.568 -13.820 1.953 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.882 -12.666 2.392 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.730 -13.051 3.877 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.759 -15.974 2.304 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.372 -14.260 2.479 1.00 0.42 H new ATOM 821 N HIS A 379 -5.530 -10.743 3.068 1.00 0.28 N ATOM 822 CA HIS A 379 -6.236 -9.762 3.884 1.00 0.30 C ATOM 823 C HIS A 379 -7.681 -9.597 3.416 1.00 0.32 C ATOM 824 O HIS A 379 -8.599 -9.516 4.230 1.00 0.38 O ATOM 825 CB HIS A 379 -5.485 -8.423 3.823 1.00 0.28 C ATOM 826 CG HIS A 379 -6.194 -7.259 4.449 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.150 -7.028 5.801 1.00 0.43 N ATOM 828 CD2 HIS A 379 -6.915 -6.279 3.857 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.834 -5.914 5.997 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.317 -5.422 4.846 1.00 0.38 N ATOM 0 H HIS A 379 -4.794 -10.343 2.486 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.267 -10.112 4.916 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.519 -8.545 4.313 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.284 -8.185 2.778 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.132 -6.190 2.803 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -6.985 -5.457 6.964 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -7.874 -4.576 4.731 1.00 0.38 H new ATOM 838 N LYS A 380 -7.878 -9.563 2.105 1.00 0.32 N ATOM 839 CA LYS A 380 -9.206 -9.333 1.541 1.00 0.36 C ATOM 840 C LYS A 380 -9.956 -10.641 1.315 1.00 0.41 C ATOM 841 O LYS A 380 -11.094 -10.641 0.842 1.00 0.45 O ATOM 842 CB LYS A 380 -9.096 -8.575 0.221 1.00 0.36 C ATOM 843 CG LYS A 380 -8.493 -7.194 0.362 1.00 0.38 C ATOM 844 CD LYS A 380 -7.629 -6.860 -0.834 1.00 0.63 C ATOM 845 CE LYS A 380 -8.421 -6.813 -2.123 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.994 -5.459 -2.394 1.00 0.77 N ATOM 0 H LYS A 380 -7.140 -9.691 1.413 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.767 -8.738 2.261 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.490 -9.157 -0.473 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -10.089 -8.485 -0.220 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.287 -6.454 0.461 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.896 -7.144 1.273 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -7.146 -5.896 -0.672 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -6.836 -7.603 -0.925 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.776 -7.104 -2.952 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.229 -7.543 -2.076 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.791 -5.546 -3.056 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.328 -5.039 -1.503 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -8.262 -4.849 -2.811 1.00 0.77 H new ATOM 860 N ASN A 381 -9.305 -11.748 1.663 1.00 0.44 N ATOM 861 CA ASN A 381 -9.857 -13.087 1.472 1.00 0.52 C ATOM 862 C ASN A 381 -10.116 -13.346 -0.015 1.00 0.53 C ATOM 863 O ASN A 381 -11.172 -13.835 -0.411 1.00 0.60 O ATOM 864 CB ASN A 381 -11.135 -13.260 2.309 1.00 0.58 C ATOM 865 CG ASN A 381 -11.581 -14.709 2.436 1.00 1.20 C ATOM 866 OD1 ASN A 381 -12.441 -15.183 1.692 1.00 1.87 O ATOM 867 ND2 ASN A 381 -10.992 -15.424 3.379 1.00 2.01 N ATOM 0 H ASN A 381 -8.377 -11.742 2.087 1.00 0.44 H new ATOM 0 HA ASN A 381 -9.133 -13.826 1.816 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -10.967 -12.851 3.305 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.938 -12.678 1.857 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -11.245 -16.403 3.510 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -10.284 -14.996 3.976 1.00 2.01 H new ATOM 874 N ARG A 382 -9.134 -13.004 -0.843 1.00 0.50 N ATOM 875 CA ARG A 382 -9.238 -13.204 -2.281 1.00 0.55 C ATOM 876 C ARG A 382 -8.120 -14.102 -2.775 1.00 0.68 C ATOM 877 O ARG A 382 -6.947 -13.859 -2.501 1.00 0.78 O ATOM 878 CB ARG A 382 -9.163 -11.875 -3.037 1.00 0.49 C ATOM 879 CG ARG A 382 -10.127 -10.822 -2.535 1.00 0.48 C ATOM 880 CD ARG A 382 -11.560 -11.270 -2.708 1.00 0.57 C ATOM 881 NE ARG A 382 -12.501 -10.234 -2.299 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.787 -10.451 -2.052 1.00 1.11 C ATOM 883 NH1 ARG A 382 -14.294 -11.670 -2.186 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.563 -9.448 -1.670 1.00 1.27 N ATOM 0 H ARG A 382 -8.255 -12.586 -0.540 1.00 0.50 H new ATOM 0 HA ARG A 382 -10.205 -13.670 -2.471 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -8.147 -11.486 -2.966 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.360 -12.059 -4.093 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.931 -10.617 -1.482 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.966 -9.890 -3.076 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.736 -11.531 -3.752 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.733 -12.172 -2.120 1.00 0.57 H new ATOM 0 HE ARG A 382 -12.149 -9.282 -2.196 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -13.695 -12.442 -2.479 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -15.282 -11.835 -1.996 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -14.172 -8.512 -1.566 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -15.552 -9.612 -1.480 1.00 1.27 H new ATOM 898 N THR A 383 -8.496 -15.136 -3.500 1.00 0.76 N ATOM 899 CA THR A 383 -7.535 -16.004 -4.151 1.00 0.95 C ATOM 900 C THR A 383 -6.987 -15.342 -5.414 1.00 0.94 C ATOM 901 O THR A 383 -5.813 -15.483 -5.752 1.00 1.22 O ATOM 902 CB THR A 383 -8.192 -17.349 -4.513 1.00 1.17 C ATOM 903 OG1 THR A 383 -8.528 -18.066 -3.318 1.00 1.24 O ATOM 904 CG2 THR A 383 -7.283 -18.190 -5.390 1.00 1.37 C ATOM 0 H THR A 383 -9.470 -15.397 -3.654 1.00 0.76 H new ATOM 0 HA THR A 383 -6.711 -16.183 -3.460 1.00 0.95 H new ATOM 0 HB THR A 383 -9.101 -17.141 -5.077 1.00 1.17 H new ATOM 0 HG1 THR A 383 -8.947 -18.920 -3.555 1.00 1.24 H new ATOM 0 HG21 THR A 383 -7.777 -19.132 -5.627 1.00 1.37 H new ATOM 0 HG22 THR A 383 -7.067 -17.651 -6.313 1.00 1.37 H new ATOM 0 HG23 THR A 383 -6.352 -18.391 -4.861 1.00 1.37 H new ATOM 912 N ASN A 384 -7.848 -14.598 -6.087 1.00 0.84 N ATOM 913 CA ASN A 384 -7.498 -13.973 -7.358 1.00 0.81 C ATOM 914 C ASN A 384 -6.911 -12.582 -7.168 1.00 0.64 C ATOM 915 O ASN A 384 -7.258 -11.647 -7.894 1.00 0.77 O ATOM 916 CB ASN A 384 -8.731 -13.865 -8.236 1.00 0.89 C ATOM 917 CG ASN A 384 -9.113 -15.178 -8.888 1.00 1.40 C ATOM 918 OD1 ASN A 384 -8.655 -15.494 -9.985 1.00 2.21 O ATOM 919 ND2 ASN A 384 -9.965 -15.948 -8.229 1.00 1.70 N ATOM 0 H ASN A 384 -8.801 -14.409 -5.775 1.00 0.84 H new ATOM 0 HA ASN A 384 -6.744 -14.603 -7.830 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -9.567 -13.508 -7.635 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.554 -13.119 -9.011 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -10.263 -16.838 -8.629 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -10.323 -15.652 -7.321 1.00 1.70 H new ATOM 926 N MET A 385 -6.030 -12.433 -6.203 1.00 0.55 N ATOM 927 CA MET A 385 -5.404 -11.148 -5.977 1.00 0.42 C ATOM 928 C MET A 385 -3.961 -11.179 -6.435 1.00 0.53 C ATOM 929 O MET A 385 -3.185 -12.031 -6.010 1.00 0.94 O ATOM 930 CB MET A 385 -5.479 -10.746 -4.507 1.00 0.47 C ATOM 931 CG MET A 385 -4.935 -9.355 -4.246 1.00 0.92 C ATOM 932 SD MET A 385 -6.246 -8.118 -4.102 1.00 2.54 S ATOM 933 CE MET A 385 -7.312 -8.520 -5.484 1.00 3.18 C ATOM 0 H MET A 385 -5.733 -13.175 -5.569 1.00 0.55 H new ATOM 0 HA MET A 385 -5.948 -10.404 -6.559 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.516 -10.793 -4.175 1.00 0.47 H new ATOM 0 HB3 MET A 385 -4.921 -11.467 -3.910 1.00 0.47 H new ATOM 0 HG2 MET A 385 -4.346 -9.364 -3.329 1.00 0.92 H new ATOM 0 HG3 MET A 385 -4.261 -9.074 -5.055 1.00 0.92 H new ATOM 0 HE1 MET A 385 -7.909 -7.647 -5.749 1.00 3.18 H new ATOM 0 HE2 MET A 385 -6.704 -8.816 -6.339 1.00 3.18 H new ATOM 0 HE3 MET A 385 -7.973 -9.341 -5.207 1.00 3.18 H new ATOM 943 N THR A 386 -3.608 -10.253 -7.309 1.00 0.23 N ATOM 944 CA THR A 386 -2.269 -10.211 -7.845 1.00 0.24 C ATOM 945 C THR A 386 -1.593 -8.903 -7.484 1.00 0.16 C ATOM 946 O THR A 386 -2.225 -8.013 -6.903 1.00 0.18 O ATOM 947 CB THR A 386 -2.267 -10.388 -9.373 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.911 -9.274 -9.998 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.984 -11.669 -9.761 1.00 0.44 C ATOM 0 H THR A 386 -4.231 -9.525 -7.658 1.00 0.23 H new ATOM 0 HA THR A 386 -1.715 -11.039 -7.403 1.00 0.24 H new ATOM 0 HB THR A 386 -1.232 -10.444 -9.710 1.00 0.33 H new ATOM 0 HG1 THR A 386 -3.190 -9.523 -10.904 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.973 -11.778 -10.845 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.479 -12.521 -9.306 1.00 0.44 H new ATOM 0 HG23 THR A 386 -4.015 -11.629 -9.411 1.00 0.44 H new ATOM 957 N TYR A 387 -0.321 -8.772 -7.816 1.00 0.16 N ATOM 958 CA TYR A 387 0.365 -7.514 -7.597 1.00 0.13 C ATOM 959 C TYR A 387 -0.160 -6.477 -8.578 1.00 0.14 C ATOM 960 O TYR A 387 -0.153 -5.282 -8.294 1.00 0.17 O ATOM 961 CB TYR A 387 1.880 -7.641 -7.725 1.00 0.15 C ATOM 962 CG TYR A 387 2.540 -6.313 -7.473 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.439 -5.718 -6.225 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.196 -5.622 -8.484 1.00 0.14 C ATOM 965 CE1 TYR A 387 2.978 -4.484 -5.986 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.732 -4.372 -8.253 1.00 0.14 C ATOM 967 CZ TYR A 387 3.621 -3.806 -7.001 1.00 0.12 C ATOM 968 OH TYR A 387 4.144 -2.556 -6.768 1.00 0.13 O ATOM 0 H TYR A 387 0.249 -9.509 -8.231 1.00 0.16 H new ATOM 0 HA TYR A 387 0.162 -7.201 -6.573 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.251 -8.379 -7.014 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.139 -8.000 -8.721 1.00 0.15 H new ATOM 0 HD1 TYR A 387 1.926 -6.237 -5.429 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.288 -6.069 -9.463 1.00 0.14 H new ATOM 0 HE1 TYR A 387 2.900 -4.041 -5.004 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.235 -3.841 -9.047 1.00 0.14 H new ATOM 0 HH TYR A 387 4.564 -2.219 -7.587 1.00 0.13 H new ATOM 978 N GLU A 388 -0.633 -6.943 -9.726 1.00 0.17 N ATOM 979 CA GLU A 388 -1.270 -6.066 -10.696 1.00 0.24 C ATOM 980 C GLU A 388 -2.447 -5.355 -10.039 1.00 0.25 C ATOM 981 O GLU A 388 -2.603 -4.144 -10.179 1.00 0.31 O ATOM 982 CB GLU A 388 -1.735 -6.849 -11.918 1.00 0.30 C ATOM 983 CG GLU A 388 -2.354 -5.970 -12.988 1.00 0.44 C ATOM 984 CD GLU A 388 -1.348 -5.072 -13.683 1.00 1.53 C ATOM 985 OE1 GLU A 388 -0.540 -5.581 -14.485 1.00 1.96 O ATOM 986 OE2 GLU A 388 -1.379 -3.844 -13.453 1.00 2.21 O ATOM 0 H GLU A 388 -0.587 -7.922 -10.007 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.543 -5.327 -11.033 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.886 -7.385 -12.343 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.462 -7.599 -11.607 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.841 -6.602 -13.731 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -3.131 -5.353 -12.537 1.00 0.44 H new ATOM 993 N LYS A 389 -3.252 -6.114 -9.297 1.00 0.23 N ATOM 994 CA LYS A 389 -4.352 -5.543 -8.525 1.00 0.28 C ATOM 995 C LYS A 389 -3.845 -4.448 -7.589 1.00 0.28 C ATOM 996 O LYS A 389 -4.412 -3.357 -7.523 1.00 0.40 O ATOM 997 CB LYS A 389 -5.055 -6.627 -7.707 1.00 0.32 C ATOM 998 CG LYS A 389 -6.153 -7.365 -8.455 1.00 0.45 C ATOM 999 CD LYS A 389 -5.634 -8.159 -9.639 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.787 -8.775 -10.414 1.00 0.46 C ATOM 1001 NZ LYS A 389 -6.358 -9.349 -11.714 1.00 1.39 N ATOM 0 H LYS A 389 -3.162 -7.127 -9.215 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.062 -5.108 -9.228 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.312 -7.350 -7.370 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.483 -6.171 -6.814 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.663 -8.040 -7.768 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.894 -6.646 -8.804 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -5.054 -7.509 -10.294 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.962 -8.943 -9.292 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -7.249 -9.556 -9.811 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -7.549 -8.015 -10.590 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.181 -9.756 -12.202 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -5.941 -8.600 -12.303 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -5.651 -10.093 -11.548 1.00 1.39 H new ATOM 1015 N MET A 390 -2.770 -4.754 -6.880 1.00 0.19 N ATOM 1016 CA MET A 390 -2.155 -3.812 -5.953 1.00 0.17 C ATOM 1017 C MET A 390 -1.624 -2.587 -6.689 1.00 0.16 C ATOM 1018 O MET A 390 -1.784 -1.459 -6.230 1.00 0.17 O ATOM 1019 CB MET A 390 -1.014 -4.497 -5.208 1.00 0.15 C ATOM 1020 CG MET A 390 -0.341 -3.612 -4.177 1.00 0.14 C ATOM 1021 SD MET A 390 0.936 -4.486 -3.260 1.00 0.18 S ATOM 1022 CE MET A 390 -0.008 -5.883 -2.664 1.00 1.57 C ATOM 0 H MET A 390 -2.300 -5.658 -6.929 1.00 0.19 H new ATOM 0 HA MET A 390 -2.914 -3.483 -5.243 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.399 -5.389 -4.713 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.269 -4.830 -5.930 1.00 0.15 H new ATOM 0 HG2 MET A 390 0.099 -2.748 -4.674 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.090 -3.233 -3.482 1.00 0.14 H new ATOM 0 HE1 MET A 390 0.545 -6.383 -1.868 1.00 1.57 H new ATOM 0 HE2 MET A 390 -0.966 -5.536 -2.278 1.00 1.57 H new ATOM 0 HE3 MET A 390 -0.178 -6.583 -3.482 1.00 1.57 H new ATOM 1032 N SER A 391 -0.993 -2.824 -7.830 1.00 0.15 N ATOM 1033 CA SER A 391 -0.438 -1.756 -8.644 1.00 0.17 C ATOM 1034 C SER A 391 -1.540 -0.792 -9.081 1.00 0.19 C ATOM 1035 O SER A 391 -1.345 0.420 -9.086 1.00 0.21 O ATOM 1036 CB SER A 391 0.276 -2.350 -9.866 1.00 0.23 C ATOM 1037 OG SER A 391 0.900 -1.345 -10.650 1.00 1.02 O ATOM 0 H SER A 391 -0.852 -3.758 -8.215 1.00 0.15 H new ATOM 0 HA SER A 391 0.287 -1.198 -8.051 1.00 0.17 H new ATOM 0 HB2 SER A 391 1.024 -3.070 -9.536 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.443 -2.895 -10.478 1.00 0.23 H new ATOM 0 HG SER A 391 1.346 -1.759 -11.418 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.700 -1.341 -9.430 1.00 0.21 N ATOM 1044 CA ARG A 392 -3.865 -0.537 -9.796 1.00 0.26 C ATOM 1045 C ARG A 392 -4.273 0.355 -8.637 1.00 0.22 C ATOM 1046 O ARG A 392 -4.448 1.563 -8.793 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.027 -1.446 -10.160 1.00 0.38 C ATOM 1048 CG ARG A 392 -4.713 -2.401 -11.289 1.00 1.12 C ATOM 1049 CD ARG A 392 -5.056 -1.805 -12.642 1.00 2.05 C ATOM 1050 NE ARG A 392 -6.499 -1.690 -12.820 1.00 2.61 N ATOM 1051 CZ ARG A 392 -7.210 -2.484 -13.615 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -6.600 -3.366 -14.396 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -8.532 -2.379 -13.652 1.00 4.06 N ATOM 0 H ARG A 392 -2.860 -2.348 -9.467 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.603 0.084 -10.653 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.319 -2.019 -9.280 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -5.884 -0.833 -10.440 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -3.654 -2.659 -11.263 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.270 -3.327 -11.148 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -4.596 -0.821 -12.735 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.638 -2.428 -13.433 1.00 2.05 H new ATOM 0 HE ARG A 392 -6.991 -0.959 -12.306 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -5.582 -3.437 -14.388 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -7.149 -3.974 -15.005 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -9.005 -1.688 -13.070 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -9.075 -2.989 -14.263 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.426 -0.264 -7.475 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.727 0.461 -6.248 1.00 0.17 C ATOM 1069 C ALA A 393 -3.701 1.567 -6.008 1.00 0.12 C ATOM 1070 O ALA A 393 -4.062 2.718 -5.770 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.768 -0.494 -5.068 1.00 0.20 C ATOM 0 H ALA A 393 -4.346 -1.274 -7.356 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.708 0.925 -6.354 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.994 0.062 -4.158 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.539 -1.246 -5.235 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.800 -0.984 -4.963 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.420 1.214 -6.097 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.333 2.176 -5.960 1.00 0.10 C ATOM 1079 C LEU A 394 -1.489 3.311 -6.960 1.00 0.11 C ATOM 1080 O LEU A 394 -1.369 4.479 -6.604 1.00 0.12 O ATOM 1081 CB LEU A 394 0.010 1.479 -6.178 1.00 0.11 C ATOM 1082 CG LEU A 394 0.396 0.470 -5.104 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.586 -0.358 -5.554 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.711 1.194 -3.811 1.00 0.13 C ATOM 0 H LEU A 394 -2.109 0.257 -6.265 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.367 2.592 -4.953 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.015 0.969 -7.141 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.790 2.238 -6.239 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.443 -0.206 -4.936 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.847 -1.073 -4.774 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.331 -0.895 -6.468 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.435 0.299 -5.744 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.987 0.469 -3.046 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.540 1.883 -3.973 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.166 1.752 -3.483 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.768 2.956 -8.210 1.00 0.12 N ATOM 1097 CA ARG A 395 -1.992 3.940 -9.259 1.00 0.14 C ATOM 1098 C ARG A 395 -3.087 4.920 -8.870 1.00 0.14 C ATOM 1099 O ARG A 395 -2.963 6.127 -9.087 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.355 3.267 -10.562 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.167 2.616 -11.224 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.015 3.590 -11.371 1.00 0.52 C ATOM 1103 NE ARG A 395 1.037 3.072 -12.238 1.00 1.30 N ATOM 1104 CZ ARG A 395 1.258 3.520 -13.473 1.00 1.72 C ATOM 1105 NH1 ARG A 395 0.532 4.519 -13.959 1.00 1.66 N ATOM 1106 NH2 ARG A 395 2.220 2.986 -14.208 1.00 2.64 N ATOM 0 H ARG A 395 -1.844 1.988 -8.521 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.061 4.491 -9.391 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.122 2.515 -10.378 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.787 4.003 -11.240 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.846 1.756 -10.636 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.456 2.240 -12.206 1.00 0.33 H new ATOM 0 HD2 ARG A 395 -0.387 4.531 -11.776 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.402 3.808 -10.388 1.00 0.52 H new ATOM 0 HE ARG A 395 1.635 2.327 -11.880 1.00 1.30 H new ATOM 0 HH11 ARG A 395 -0.197 4.945 -13.387 1.00 1.66 H new ATOM 0 HH12 ARG A 395 0.703 4.861 -14.905 1.00 1.66 H new ATOM 0 HH21 ARG A 395 2.792 2.231 -13.829 1.00 2.64 H new ATOM 0 HH22 ARG A 395 2.389 3.329 -15.154 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.164 4.398 -8.299 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.285 5.229 -7.893 1.00 0.13 C ATOM 1122 C HIS A 396 -4.896 6.099 -6.702 1.00 0.11 C ATOM 1123 O HIS A 396 -5.310 7.254 -6.603 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.504 4.368 -7.561 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.803 5.056 -7.849 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -7.955 5.854 -8.960 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.966 5.039 -7.158 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.195 6.300 -8.919 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.848 5.832 -7.846 1.00 0.26 N ATOM 0 H HIS A 396 -4.283 3.403 -8.107 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.550 5.882 -8.724 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.455 3.442 -8.134 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.471 4.093 -6.507 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.162 4.504 -6.241 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.629 6.959 -9.656 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.816 6.028 -7.590 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.058 5.549 -5.831 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.600 6.258 -4.640 1.00 0.10 C ATOM 1139 C TYR A 397 -2.838 7.525 -5.002 1.00 0.09 C ATOM 1140 O TYR A 397 -2.876 8.505 -4.264 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.714 5.354 -3.776 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.468 4.226 -3.133 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.849 4.230 -3.114 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.805 3.165 -2.543 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.560 3.212 -2.531 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.507 2.134 -1.947 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.887 2.162 -1.945 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.586 1.146 -1.333 1.00 0.30 O ATOM 0 H TYR A 397 -3.679 4.607 -5.928 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.487 6.540 -4.072 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.915 4.943 -4.393 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.241 5.955 -3.000 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.381 5.053 -3.568 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.725 3.142 -2.548 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.640 3.233 -2.531 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.979 1.312 -1.486 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.831 0.470 -1.999 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.149 7.507 -6.134 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.354 8.657 -6.546 1.00 0.12 C ATOM 1160 C TYR A 398 -2.240 9.879 -6.765 1.00 0.14 C ATOM 1161 O TYR A 398 -1.993 10.945 -6.203 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.583 8.368 -7.836 1.00 0.14 C ATOM 1163 CG TYR A 398 0.293 7.131 -7.807 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.803 6.612 -6.617 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.615 6.482 -8.989 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.601 5.483 -6.617 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.408 5.361 -8.994 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.897 4.863 -7.810 1.00 0.14 C ATOM 1169 OH TYR A 398 2.686 3.741 -7.825 1.00 0.18 O ATOM 0 H TYR A 398 -2.123 6.717 -6.779 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.644 8.858 -5.744 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.299 8.267 -8.652 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.043 9.230 -8.066 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.571 7.099 -5.682 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.235 6.866 -9.924 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.989 5.091 -5.689 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.647 4.872 -9.927 1.00 0.16 H new ATOM 0 HH TYR A 398 3.206 3.695 -6.995 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.284 9.711 -7.573 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.195 10.809 -7.883 1.00 0.19 C ATOM 1181 C LYS A 399 -4.908 11.293 -6.640 1.00 0.19 C ATOM 1182 O LYS A 399 -5.152 12.489 -6.474 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.242 10.396 -8.908 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.715 10.287 -10.332 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.211 8.890 -10.643 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.342 7.879 -10.591 1.00 0.32 C ATOM 1187 NZ LYS A 399 -4.896 6.523 -11.004 1.00 0.71 N ATOM 0 H LYS A 399 -3.520 8.827 -8.024 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.584 11.612 -8.295 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.662 9.434 -8.614 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.057 11.119 -8.889 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.506 10.552 -11.033 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.908 11.005 -10.476 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -3.752 8.877 -11.632 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.437 8.612 -9.928 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -5.743 7.836 -9.579 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.152 8.208 -11.241 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -5.616 5.823 -10.733 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -4.762 6.501 -12.035 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -3.997 6.295 -10.533 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.237 10.356 -5.770 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.996 10.659 -4.574 1.00 0.18 C ATOM 1203 C LEU A 400 -5.087 11.137 -3.453 1.00 0.18 C ATOM 1204 O LEU A 400 -5.476 11.162 -2.285 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.799 9.430 -4.179 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.622 8.854 -5.330 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.289 7.565 -4.920 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.651 9.866 -5.813 1.00 0.21 C ATOM 0 H LEU A 400 -4.988 9.372 -5.872 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.687 11.478 -4.774 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.119 8.663 -3.808 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.467 9.689 -3.357 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.945 8.635 -6.156 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.869 7.174 -5.756 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.530 6.838 -4.633 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.951 7.751 -4.074 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.227 9.436 -6.633 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.322 10.122 -4.993 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.142 10.765 -6.159 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.869 11.515 -3.836 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.937 12.211 -2.943 1.00 0.20 C ATOM 1222 C ASN A 401 -2.488 11.322 -1.788 1.00 0.17 C ATOM 1223 O ASN A 401 -2.287 11.792 -0.667 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.607 13.471 -2.394 1.00 0.27 C ATOM 1225 CG ASN A 401 -2.742 14.704 -2.522 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -1.522 14.645 -2.375 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.375 15.828 -2.808 1.00 1.21 N ATOM 0 H ASN A 401 -3.498 11.349 -4.772 1.00 0.18 H new ATOM 0 HA ASN A 401 -2.051 12.476 -3.520 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.546 13.636 -2.923 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -3.855 13.316 -1.344 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -2.850 16.696 -2.916 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.389 15.828 -2.921 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.334 10.043 -2.073 1.00 0.11 N ATOM 1235 CA ILE A 402 -2.026 9.057 -1.060 1.00 0.10 C ATOM 1236 C ILE A 402 -0.580 8.597 -1.139 1.00 0.09 C ATOM 1237 O ILE A 402 0.214 8.856 -0.235 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.974 7.867 -1.241 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.401 8.364 -1.109 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.699 6.763 -0.239 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.405 7.389 -1.620 1.00 0.13 C ATOM 0 H ILE A 402 -2.419 9.660 -3.015 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.162 9.507 -0.076 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.813 7.438 -2.230 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.610 8.577 -0.061 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.505 9.303 -1.652 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.394 5.940 -0.404 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.677 6.405 -0.363 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.828 7.149 0.772 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.407 7.801 -1.499 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.218 7.194 -2.676 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.325 6.457 -1.060 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.242 7.916 -2.218 1.00 0.07 N ATOM 1254 CA ILE A 403 1.109 7.440 -2.431 1.00 0.07 C ATOM 1255 C ILE A 403 1.644 8.047 -3.723 1.00 0.08 C ATOM 1256 O ILE A 403 0.881 8.602 -4.505 1.00 0.10 O ATOM 1257 CB ILE A 403 1.165 5.891 -2.505 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.525 5.254 -1.273 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.600 5.399 -2.641 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.615 3.745 -1.288 1.00 0.11 C ATOM 0 H ILE A 403 -0.893 7.679 -2.967 1.00 0.07 H new ATOM 0 HA ILE A 403 1.726 7.746 -1.586 1.00 0.07 H new ATOM 0 HB ILE A 403 0.602 5.593 -3.389 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.013 5.635 -0.376 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.522 5.552 -1.217 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.608 4.310 -2.691 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.040 5.807 -3.551 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.180 5.727 -1.779 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.145 3.344 -0.390 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.103 3.359 -2.169 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.662 3.443 -1.316 1.00 0.11 H new ATOM 1272 N ARG A 404 2.947 7.986 -3.920 1.00 0.10 N ATOM 1273 CA ARG A 404 3.556 8.434 -5.161 1.00 0.13 C ATOM 1274 C ARG A 404 4.643 7.471 -5.581 1.00 0.14 C ATOM 1275 O ARG A 404 5.038 6.579 -4.828 1.00 0.16 O ATOM 1276 CB ARG A 404 4.152 9.829 -5.020 1.00 0.17 C ATOM 1277 CG ARG A 404 5.514 9.818 -4.374 1.00 0.25 C ATOM 1278 CD ARG A 404 6.186 11.174 -4.428 1.00 0.36 C ATOM 1279 NE ARG A 404 6.778 11.446 -5.742 1.00 1.14 N ATOM 1280 CZ ARG A 404 7.601 12.471 -5.994 1.00 1.56 C ATOM 1281 NH1 ARG A 404 7.869 13.365 -5.045 1.00 1.63 N ATOM 1282 NH2 ARG A 404 8.148 12.606 -7.198 1.00 2.39 N ATOM 0 H ARG A 404 3.610 7.628 -3.232 1.00 0.10 H new ATOM 0 HA ARG A 404 2.773 8.468 -5.919 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.226 10.289 -6.005 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.479 10.449 -4.428 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.418 9.503 -3.335 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.145 9.082 -4.873 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.457 11.949 -4.192 1.00 0.36 H new ATOM 0 HD3 ARG A 404 6.962 11.224 -3.664 1.00 0.36 H new ATOM 0 HE ARG A 404 6.549 10.816 -6.510 1.00 1.14 H new ATOM 0 HH11 ARG A 404 7.447 13.270 -4.121 1.00 1.63 H new ATOM 0 HH12 ARG A 404 8.497 14.145 -5.241 1.00 1.63 H new ATOM 0 HH21 ARG A 404 7.941 11.928 -7.931 1.00 2.39 H new ATOM 0 HH22 ARG A 404 8.775 13.388 -7.389 1.00 2.39 H new ATOM 1296 N LYS A 405 5.129 7.686 -6.780 1.00 0.17 N ATOM 1297 CA LYS A 405 6.140 6.844 -7.370 1.00 0.19 C ATOM 1298 C LYS A 405 7.419 7.646 -7.542 1.00 0.22 C ATOM 1299 O LYS A 405 7.383 8.793 -7.979 1.00 0.27 O ATOM 1300 CB LYS A 405 5.646 6.328 -8.713 1.00 0.22 C ATOM 1301 CG LYS A 405 6.504 5.212 -9.266 1.00 0.34 C ATOM 1302 CD LYS A 405 6.749 4.161 -8.232 1.00 0.29 C ATOM 1303 CE LYS A 405 7.489 2.999 -8.830 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.743 3.407 -9.513 1.00 1.08 N ATOM 0 H LYS A 405 4.831 8.457 -7.378 1.00 0.17 H new ATOM 0 HA LYS A 405 6.343 5.991 -6.722 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.621 5.972 -8.605 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.624 7.151 -9.427 1.00 0.22 H new ATOM 0 HG2 LYS A 405 6.014 4.767 -10.132 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.456 5.617 -9.611 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.325 4.581 -7.407 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.800 3.821 -7.818 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.725 2.281 -8.044 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.841 2.489 -9.543 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 9.288 2.560 -9.773 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 8.511 3.946 -10.371 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 9.309 4.000 -8.874 1.00 1.08 H new ATOM 1318 N GLU A 406 8.540 7.052 -7.180 1.00 0.23 N ATOM 1319 CA GLU A 406 9.815 7.729 -7.262 1.00 0.28 C ATOM 1320 C GLU A 406 10.392 7.652 -8.670 1.00 0.34 C ATOM 1321 O GLU A 406 9.986 6.825 -9.493 1.00 0.43 O ATOM 1322 CB GLU A 406 10.799 7.123 -6.260 1.00 0.29 C ATOM 1323 CG GLU A 406 10.637 5.643 -6.090 1.00 0.63 C ATOM 1324 CD GLU A 406 10.954 4.881 -7.350 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.836 5.329 -8.100 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.342 3.822 -7.584 1.00 2.42 O ATOM 0 H GLU A 406 8.591 6.097 -6.825 1.00 0.23 H new ATOM 0 HA GLU A 406 9.654 8.779 -7.018 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.817 7.335 -6.588 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.668 7.609 -5.293 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.289 5.299 -5.287 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.613 5.425 -5.785 1.00 0.63 H new ATOM 1333 N PRO A 407 11.293 8.575 -8.969 1.00 0.41 N ATOM 1334 CA PRO A 407 12.076 8.567 -10.190 1.00 0.51 C ATOM 1335 C PRO A 407 13.176 7.501 -10.192 1.00 0.52 C ATOM 1336 O PRO A 407 14.143 7.605 -9.432 1.00 0.54 O ATOM 1337 CB PRO A 407 12.686 9.964 -10.253 1.00 0.61 C ATOM 1338 CG PRO A 407 12.528 10.571 -8.900 1.00 0.58 C ATOM 1339 CD PRO A 407 11.653 9.668 -8.077 1.00 0.45 C ATOM 0 HA PRO A 407 11.453 8.324 -11.051 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.738 9.913 -10.532 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.185 10.570 -11.008 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.500 10.695 -8.423 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.083 11.563 -8.978 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.182 9.301 -7.197 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.768 10.194 -7.721 1.00 0.45 H new ATOM 1347 N GLY A 408 13.044 6.485 -11.038 1.00 0.54 N ATOM 1348 CA GLY A 408 14.180 5.622 -11.314 1.00 0.58 C ATOM 1349 C GLY A 408 14.097 4.222 -10.727 1.00 0.58 C ATOM 1350 O GLY A 408 14.509 3.263 -11.384 1.00 0.86 O ATOM 0 H GLY A 408 12.184 6.245 -11.532 1.00 0.54 H new ATOM 0 HA2 GLY A 408 14.296 5.538 -12.395 1.00 0.58 H new ATOM 0 HA3 GLY A 408 15.081 6.104 -10.934 1.00 0.58 H new ATOM 1354 N GLN A 409 13.583 4.083 -9.510 1.00 0.47 N ATOM 1355 CA GLN A 409 13.590 2.789 -8.835 1.00 0.51 C ATOM 1356 C GLN A 409 12.469 1.900 -9.377 1.00 0.48 C ATOM 1357 O GLN A 409 11.744 2.282 -10.303 1.00 0.61 O ATOM 1358 CB GLN A 409 13.459 2.932 -7.309 1.00 0.63 C ATOM 1359 CG GLN A 409 14.186 4.138 -6.717 1.00 0.45 C ATOM 1360 CD GLN A 409 14.580 3.936 -5.264 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.645 4.895 -4.489 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.855 2.694 -4.885 1.00 0.45 N ATOM 0 H GLN A 409 13.160 4.841 -8.975 1.00 0.47 H new ATOM 0 HA GLN A 409 14.553 2.322 -9.040 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.402 3.001 -7.053 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.842 2.027 -6.838 1.00 0.63 H new ATOM 0 HG2 GLN A 409 15.080 4.342 -7.306 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.546 5.017 -6.796 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.789 1.929 -5.557 1.00 0.45 H new ATOM 0 HE22 GLN A 409 15.132 2.504 -3.922 1.00 0.45 H new ATOM 1371 N ARG A 410 12.332 0.711 -8.812 1.00 0.41 N ATOM 1372 CA ARG A 410 11.337 -0.247 -9.286 1.00 0.39 C ATOM 1373 C ARG A 410 10.060 -0.201 -8.457 1.00 0.31 C ATOM 1374 O ARG A 410 9.043 0.340 -8.886 1.00 0.42 O ATOM 1375 CB ARG A 410 11.920 -1.669 -9.279 1.00 0.47 C ATOM 1376 CG ARG A 410 12.609 -2.038 -7.971 1.00 0.86 C ATOM 1377 CD ARG A 410 12.496 -3.518 -7.663 1.00 1.11 C ATOM 1378 NE ARG A 410 12.879 -3.815 -6.279 1.00 1.27 N ATOM 1379 CZ ARG A 410 12.866 -5.045 -5.753 1.00 2.04 C ATOM 1380 NH1 ARG A 410 12.483 -6.084 -6.484 1.00 2.65 N ATOM 1381 NH2 ARG A 410 13.246 -5.246 -4.500 1.00 2.43 N ATOM 0 H ARG A 410 12.894 0.384 -8.026 1.00 0.41 H new ATOM 0 HA ARG A 410 11.077 0.032 -10.307 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.119 -2.382 -9.472 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.635 -1.764 -10.096 1.00 0.47 H new ATOM 0 HG2 ARG A 410 13.661 -1.759 -8.025 1.00 0.86 H new ATOM 0 HG3 ARG A 410 12.169 -1.464 -7.156 1.00 0.86 H new ATOM 0 HD2 ARG A 410 11.472 -3.848 -7.836 1.00 1.11 H new ATOM 0 HD3 ARG A 410 13.132 -4.081 -8.346 1.00 1.11 H new ATOM 0 HE ARG A 410 13.172 -3.040 -5.684 1.00 1.27 H new ATOM 0 HH11 ARG A 410 12.196 -5.948 -7.453 1.00 2.65 H new ATOM 0 HH12 ARG A 410 12.475 -7.019 -6.077 1.00 2.65 H new ATOM 0 HH21 ARG A 410 13.552 -4.459 -3.927 1.00 2.43 H new ATOM 0 HH22 ARG A 410 13.233 -6.187 -4.108 1.00 2.43 H new ATOM 1395 N LEU A 411 10.136 -0.767 -7.273 1.00 0.21 N ATOM 1396 CA LEU A 411 8.993 -0.945 -6.413 1.00 0.14 C ATOM 1397 C LEU A 411 9.078 0.000 -5.245 1.00 0.11 C ATOM 1398 O LEU A 411 8.631 -0.300 -4.143 1.00 0.12 O ATOM 1399 CB LEU A 411 8.944 -2.394 -5.957 1.00 0.11 C ATOM 1400 CG LEU A 411 8.600 -3.365 -7.078 1.00 0.11 C ATOM 1401 CD1 LEU A 411 8.814 -4.800 -6.651 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.169 -3.136 -7.501 1.00 0.16 C ATOM 0 H LEU A 411 11.007 -1.121 -6.877 1.00 0.21 H new ATOM 0 HA LEU A 411 8.074 -0.718 -6.953 1.00 0.14 H new ATOM 0 HB2 LEU A 411 9.910 -2.667 -5.532 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.206 -2.493 -5.161 1.00 0.11 H new ATOM 0 HG LEU A 411 9.264 -3.183 -7.923 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.559 -5.467 -7.475 1.00 0.15 H new ATOM 0 HD12 LEU A 411 9.859 -4.946 -6.376 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.179 -5.023 -5.794 1.00 0.15 H new ATOM 0 HD21 LEU A 411 6.912 -3.827 -8.304 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.507 -3.305 -6.652 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.053 -2.111 -7.853 1.00 0.16 H new ATOM 1414 N LEU A 412 9.695 1.130 -5.493 1.00 0.13 N ATOM 1415 CA LEU A 412 9.846 2.144 -4.479 1.00 0.11 C ATOM 1416 C LEU A 412 8.647 3.080 -4.538 1.00 0.10 C ATOM 1417 O LEU A 412 8.246 3.520 -5.612 1.00 0.11 O ATOM 1418 CB LEU A 412 11.138 2.911 -4.729 1.00 0.13 C ATOM 1419 CG LEU A 412 11.796 3.571 -3.522 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.816 4.411 -2.729 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.428 2.519 -2.646 1.00 0.16 C ATOM 0 H LEU A 412 10.103 1.371 -6.396 1.00 0.13 H new ATOM 0 HA LEU A 412 9.894 1.690 -3.489 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.858 2.225 -5.175 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.935 3.685 -5.469 1.00 0.13 H new ATOM 0 HG LEU A 412 12.569 4.246 -3.889 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.328 4.862 -1.879 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.411 5.197 -3.367 1.00 0.13 H new ATOM 0 HD13 LEU A 412 10.003 3.780 -2.370 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.897 2.996 -1.785 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.662 1.823 -2.303 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.183 1.976 -3.216 1.00 0.16 H new ATOM 1433 N PHE A 413 8.068 3.370 -3.390 1.00 0.10 N ATOM 1434 CA PHE A 413 6.927 4.252 -3.329 1.00 0.11 C ATOM 1435 C PHE A 413 7.046 5.145 -2.113 1.00 0.12 C ATOM 1436 O PHE A 413 7.527 4.715 -1.065 1.00 0.19 O ATOM 1437 CB PHE A 413 5.621 3.462 -3.260 1.00 0.12 C ATOM 1438 CG PHE A 413 5.434 2.493 -4.390 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.903 1.201 -4.281 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.791 2.870 -5.554 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.740 0.295 -5.310 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.626 1.970 -6.589 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.100 0.681 -6.467 1.00 0.11 C ATOM 0 H PHE A 413 8.372 3.005 -2.487 1.00 0.10 H new ATOM 0 HA PHE A 413 6.911 4.857 -4.236 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.588 2.916 -2.317 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.785 4.161 -3.253 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.406 0.893 -3.376 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.414 3.877 -5.655 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.113 -0.713 -5.208 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.125 2.277 -7.495 1.00 0.11 H new ATOM 0 HZ PHE A 413 4.970 -0.023 -7.275 1.00 0.11 H new ATOM 1453 N ARG A 414 6.632 6.385 -2.255 1.00 0.10 N ATOM 1454 CA ARG A 414 6.612 7.297 -1.143 1.00 0.12 C ATOM 1455 C ARG A 414 5.190 7.734 -0.865 1.00 0.11 C ATOM 1456 O ARG A 414 4.468 8.154 -1.767 1.00 0.15 O ATOM 1457 CB ARG A 414 7.513 8.502 -1.410 1.00 0.20 C ATOM 1458 CG ARG A 414 7.024 9.772 -0.747 1.00 0.35 C ATOM 1459 CD ARG A 414 8.165 10.656 -0.287 1.00 0.37 C ATOM 1460 NE ARG A 414 9.074 11.007 -1.377 1.00 1.21 N ATOM 1461 CZ ARG A 414 9.601 12.217 -1.537 1.00 1.46 C ATOM 1462 NH1 ARG A 414 9.225 13.212 -0.747 1.00 1.06 N ATOM 1463 NH2 ARG A 414 10.477 12.436 -2.505 1.00 2.58 N ATOM 0 H ARG A 414 6.304 6.782 -3.136 1.00 0.10 H new ATOM 0 HA ARG A 414 7.000 6.786 -0.262 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.520 8.280 -1.056 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.582 8.665 -2.486 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.397 10.326 -1.446 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.399 9.515 0.108 1.00 0.35 H new ATOM 0 HD2 ARG A 414 7.760 11.568 0.152 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.723 10.145 0.497 1.00 0.37 H new ATOM 0 HE ARG A 414 9.318 10.283 -2.053 1.00 1.21 H new ATOM 0 HH11 ARG A 414 8.532 13.049 -0.017 1.00 1.06 H new ATOM 0 HH12 ARG A 414 9.629 14.141 -0.869 1.00 1.06 H new ATOM 0 HH21 ARG A 414 10.748 11.676 -3.129 1.00 2.58 H new ATOM 0 HH22 ARG A 414 10.881 13.365 -2.627 1.00 2.58 H new ATOM 1477 N PHE A 415 4.788 7.610 0.378 1.00 0.10 N ATOM 1478 CA PHE A 415 3.484 8.072 0.802 1.00 0.09 C ATOM 1479 C PHE A 415 3.425 9.594 0.730 1.00 0.11 C ATOM 1480 O PHE A 415 4.106 10.290 1.487 1.00 0.14 O ATOM 1481 CB PHE A 415 3.191 7.620 2.232 1.00 0.10 C ATOM 1482 CG PHE A 415 2.513 6.291 2.378 1.00 0.10 C ATOM 1483 CD1 PHE A 415 3.253 5.132 2.490 1.00 0.10 C ATOM 1484 CD2 PHE A 415 1.129 6.213 2.447 1.00 0.11 C ATOM 1485 CE1 PHE A 415 2.637 3.916 2.662 1.00 0.11 C ATOM 1486 CE2 PHE A 415 0.500 5.000 2.625 1.00 0.13 C ATOM 1487 CZ PHE A 415 1.257 3.846 2.730 1.00 0.12 C ATOM 0 H PHE A 415 5.349 7.190 1.119 1.00 0.10 H new ATOM 0 HA PHE A 415 2.734 7.644 0.136 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.132 7.587 2.781 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.569 8.377 2.710 1.00 0.10 H new ATOM 0 HD1 PHE A 415 4.331 5.181 2.442 1.00 0.10 H new ATOM 0 HD2 PHE A 415 0.538 7.113 2.360 1.00 0.11 H new ATOM 0 HE1 PHE A 415 3.229 3.016 2.744 1.00 0.11 H new ATOM 0 HE2 PHE A 415 -0.577 4.950 2.682 1.00 0.13 H new ATOM 0 HZ PHE A 415 0.771 2.891 2.865 1.00 0.12 H new ATOM 1497 N MET A 416 2.633 10.097 -0.209 1.00 0.11 N ATOM 1498 CA MET A 416 2.372 11.530 -0.329 1.00 0.15 C ATOM 1499 C MET A 416 1.807 12.086 0.973 1.00 0.17 C ATOM 1500 O MET A 416 2.013 13.252 1.310 1.00 0.23 O ATOM 1501 CB MET A 416 1.380 11.793 -1.466 1.00 0.15 C ATOM 1502 CG MET A 416 1.954 11.579 -2.852 1.00 0.24 C ATOM 1503 SD MET A 416 3.276 12.745 -3.248 1.00 1.41 S ATOM 1504 CE MET A 416 2.387 14.298 -3.194 1.00 1.47 C ATOM 0 H MET A 416 2.154 9.528 -0.907 1.00 0.11 H new ATOM 0 HA MET A 416 3.316 12.029 -0.547 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.516 11.141 -1.338 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.019 12.819 -1.389 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.338 10.562 -2.929 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.157 11.676 -3.589 1.00 0.24 H new ATOM 0 HE1 MET A 416 2.935 15.051 -3.761 1.00 1.47 H new ATOM 0 HE2 MET A 416 1.396 14.166 -3.629 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.288 14.625 -2.159 1.00 1.47 H new ATOM 1514 N LYS A 417 1.109 11.236 1.704 1.00 0.16 N ATOM 1515 CA LYS A 417 0.499 11.616 2.965 1.00 0.21 C ATOM 1516 C LYS A 417 0.572 10.474 3.954 1.00 0.21 C ATOM 1517 O LYS A 417 0.992 9.369 3.620 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.966 11.974 2.757 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.205 13.361 2.215 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.691 13.610 2.087 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.989 14.984 1.517 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.026 15.370 0.455 1.00 1.36 N ATOM 0 H LYS A 417 0.949 10.264 1.441 1.00 0.16 H new ATOM 0 HA LYS A 417 1.043 12.477 3.352 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.409 11.250 2.073 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.489 11.875 3.708 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.758 14.102 2.877 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.723 13.470 1.243 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.133 12.848 1.445 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -3.161 13.514 3.066 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -4.000 14.995 1.110 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -2.959 15.722 2.318 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -2.452 16.101 -0.151 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -1.159 15.744 0.892 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -1.792 14.536 -0.121 1.00 1.36 H new ATOM 1536 N THR A 418 0.159 10.758 5.170 1.00 0.24 N ATOM 1537 CA THR A 418 -0.005 9.739 6.180 1.00 0.24 C ATOM 1538 C THR A 418 -1.486 9.459 6.368 1.00 0.26 C ATOM 1539 O THR A 418 -2.317 10.286 5.995 1.00 0.28 O ATOM 1540 CB THR A 418 0.635 10.173 7.502 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.145 11.465 7.889 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.143 10.214 7.352 1.00 0.22 C ATOM 0 H THR A 418 -0.072 11.700 5.485 1.00 0.24 H new ATOM 0 HA THR A 418 0.497 8.828 5.854 1.00 0.24 H new ATOM 0 HB THR A 418 0.372 9.453 8.276 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.559 11.732 8.736 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.594 10.523 8.295 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.509 9.223 7.082 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.412 10.925 6.571 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.840 8.301 6.948 1.00 0.25 N ATOM 1551 CA PRO A 419 -3.230 7.829 7.014 1.00 0.28 C ATOM 1552 C PRO A 419 -4.223 8.887 7.491 1.00 0.31 C ATOM 1553 O PRO A 419 -5.311 9.013 6.931 1.00 0.33 O ATOM 1554 CB PRO A 419 -3.149 6.662 7.993 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.776 6.132 7.783 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.916 7.344 7.587 1.00 0.25 C ATOM 0 HA PRO A 419 -3.608 7.559 6.028 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -3.301 6.989 9.022 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.907 5.908 7.783 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.444 5.547 8.641 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.735 5.475 6.914 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.531 7.724 8.533 1.00 0.25 H new ATOM 0 HD3 PRO A 419 -0.054 7.130 6.955 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.841 9.658 8.497 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.704 10.722 9.013 1.00 0.42 C ATOM 1566 C ASP A 420 -4.998 11.756 7.928 1.00 0.43 C ATOM 1567 O ASP A 420 -6.145 12.157 7.729 1.00 0.48 O ATOM 1568 CB ASP A 420 -4.067 11.412 10.219 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.973 12.478 10.803 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -5.825 12.133 11.649 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -4.844 13.659 10.415 1.00 0.72 O ATOM 0 H ASP A 420 -2.944 9.572 8.974 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.640 10.260 9.328 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.840 10.670 10.984 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -3.120 11.863 9.921 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.955 12.161 7.216 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.076 13.121 6.130 1.00 0.45 C ATOM 1578 C GLU A 421 -4.843 12.526 4.951 1.00 0.42 C ATOM 1579 O GLU A 421 -5.515 13.237 4.207 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.683 13.547 5.665 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.950 14.455 6.638 1.00 0.81 C ATOM 1582 CD GLU A 421 -2.430 15.889 6.563 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -3.427 16.226 7.234 1.00 2.17 O ATOM 1584 OE2 GLU A 421 -1.810 16.685 5.823 1.00 2.21 O ATOM 0 H GLU A 421 -3.002 11.833 7.376 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.628 13.986 6.499 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.081 12.655 5.495 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -2.773 14.058 4.707 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.087 14.082 7.653 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -0.881 14.421 6.427 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.726 11.218 4.786 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.315 10.527 3.649 1.00 0.33 C ATOM 1593 C ILE A 422 -6.811 10.262 3.849 1.00 0.36 C ATOM 1594 O ILE A 422 -7.602 10.321 2.903 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.591 9.191 3.396 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -3.100 9.428 3.163 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.207 8.474 2.218 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.320 8.165 2.865 1.00 0.27 C ATOM 0 H ILE A 422 -4.224 10.608 5.431 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.198 11.181 2.785 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.704 8.562 4.279 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.978 10.124 2.333 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.675 9.907 4.046 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.685 7.532 2.052 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.259 8.275 2.423 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -5.123 9.098 1.328 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.270 8.414 2.711 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.410 7.475 3.704 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.717 7.696 1.965 1.00 0.27 H new ATOM 1610 N MET A 423 -7.196 9.987 5.085 1.00 0.42 N ATOM 1611 CA MET A 423 -8.578 9.657 5.411 1.00 0.51 C ATOM 1612 C MET A 423 -9.470 10.888 5.425 1.00 0.58 C ATOM 1613 O MET A 423 -10.620 10.835 5.857 1.00 0.71 O ATOM 1614 CB MET A 423 -8.651 8.927 6.743 1.00 0.58 C ATOM 1615 CG MET A 423 -7.987 7.571 6.696 1.00 0.58 C ATOM 1616 SD MET A 423 -8.607 6.436 7.956 1.00 0.90 S ATOM 1617 CE MET A 423 -10.277 6.154 7.370 1.00 2.01 C ATOM 0 H MET A 423 -6.566 9.986 5.887 1.00 0.42 H new ATOM 0 HA MET A 423 -8.949 8.998 4.627 1.00 0.51 H new ATOM 0 HB2 MET A 423 -8.176 9.534 7.513 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.695 8.807 7.031 1.00 0.58 H new ATOM 0 HG2 MET A 423 -8.142 7.131 5.711 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.912 7.695 6.824 1.00 0.58 H new ATOM 0 HE1 MET A 423 -10.640 5.200 7.752 1.00 2.01 H new ATOM 0 HE2 MET A 423 -10.926 6.956 7.721 1.00 2.01 H new ATOM 0 HE3 MET A 423 -10.282 6.134 6.280 1.00 2.01 H new ATOM 1627 N SER A 424 -8.928 11.988 4.946 1.00 0.59 N ATOM 1628 CA SER A 424 -9.655 13.254 4.866 1.00 0.72 C ATOM 1629 C SER A 424 -10.694 13.238 3.734 1.00 0.67 C ATOM 1630 O SER A 424 -11.218 14.282 3.339 1.00 1.09 O ATOM 1631 CB SER A 424 -8.665 14.396 4.643 1.00 0.92 C ATOM 1632 OG SER A 424 -7.860 14.145 3.501 1.00 1.57 O ATOM 0 H SER A 424 -7.970 12.038 4.599 1.00 0.59 H new ATOM 0 HA SER A 424 -10.187 13.400 5.806 1.00 0.72 H new ATOM 0 HB2 SER A 424 -9.206 15.333 4.514 1.00 0.92 H new ATOM 0 HB3 SER A 424 -8.032 14.512 5.522 1.00 0.92 H new ATOM 0 HG SER A 424 -7.052 13.661 3.771 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.988 12.053 3.216 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.937 11.933 2.130 1.00 0.42 C ATOM 1640 C GLY A 425 -11.290 11.424 0.860 1.00 0.37 C ATOM 1641 O GLY A 425 -11.977 11.006 -0.070 1.00 0.50 O ATOM 0 H GLY A 425 -10.584 11.171 3.531 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.739 11.256 2.424 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -12.393 12.904 1.939 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.961 11.441 0.831 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.208 11.015 -0.349 1.00 0.36 C ATOM 1647 C ARG A 426 -9.448 9.531 -0.624 1.00 0.33 C ATOM 1648 O ARG A 426 -9.947 9.148 -1.680 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.712 11.266 -0.144 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.392 12.600 0.480 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.463 13.713 -0.534 1.00 0.92 C ATOM 1652 NE ARG A 426 -7.085 14.999 0.051 1.00 1.37 N ATOM 1653 CZ ARG A 426 -6.952 16.129 -0.642 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -7.123 16.135 -1.959 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -6.629 17.249 -0.011 1.00 2.67 N ATOM 0 H ARG A 426 -9.380 11.746 1.612 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.552 11.596 -1.205 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.305 10.475 0.486 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -7.208 11.197 -1.108 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -8.091 12.801 1.292 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.395 12.568 0.918 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.803 13.486 -1.371 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -8.475 13.778 -0.934 1.00 0.92 H new ATOM 0 HE ARG A 426 -6.912 15.033 1.056 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.358 15.270 -2.447 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -7.020 17.004 -2.483 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -6.484 17.242 0.999 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -6.525 18.118 -0.535 1.00 2.67 H new ATOM 1669 N THR A 427 -9.109 8.710 0.358 1.00 0.33 N ATOM 1670 CA THR A 427 -9.284 7.268 0.265 1.00 0.37 C ATOM 1671 C THR A 427 -10.607 6.843 0.892 1.00 0.43 C ATOM 1672 O THR A 427 -10.842 5.661 1.140 1.00 0.58 O ATOM 1673 CB THR A 427 -8.103 6.545 0.945 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.220 5.138 0.809 1.00 1.24 O ATOM 1675 CG2 THR A 427 -8.014 6.890 2.411 1.00 0.41 C ATOM 0 H THR A 427 -8.705 9.023 1.241 1.00 0.33 H new ATOM 0 HA THR A 427 -9.305 6.988 -0.788 1.00 0.37 H new ATOM 0 HB THR A 427 -7.196 6.884 0.445 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.127 4.860 1.055 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.171 6.363 2.858 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.871 7.965 2.524 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.935 6.592 2.912 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.485 7.817 1.106 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.817 7.548 1.634 1.00 0.62 C ATOM 1685 C ASP A 428 -13.610 6.774 0.596 1.00 0.61 C ATOM 1686 O ASP A 428 -14.418 5.909 0.917 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.520 8.864 1.970 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.921 8.668 2.508 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -15.059 8.322 3.699 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -15.889 8.888 1.751 1.00 1.75 O ATOM 0 H ASP A 428 -11.297 8.802 0.921 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.742 6.957 2.547 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -12.928 9.408 2.706 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.564 9.484 1.075 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.332 7.093 -0.658 1.00 0.54 N ATOM 1696 CA ARG A 429 -13.904 6.394 -1.800 1.00 0.65 C ATOM 1697 C ARG A 429 -13.322 4.999 -1.879 1.00 0.55 C ATOM 1698 O ARG A 429 -14.016 4.002 -2.069 1.00 0.66 O ATOM 1699 CB ARG A 429 -13.537 7.139 -3.075 1.00 0.81 C ATOM 1700 CG ARG A 429 -13.658 8.641 -2.943 1.00 0.98 C ATOM 1701 CD ARG A 429 -12.931 9.370 -4.065 1.00 1.12 C ATOM 1702 NE ARG A 429 -13.254 8.835 -5.387 1.00 1.64 N ATOM 1703 CZ ARG A 429 -13.335 9.578 -6.488 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -13.158 10.888 -6.423 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -13.589 9.005 -7.655 1.00 3.05 N ATOM 0 H ARG A 429 -12.698 7.850 -0.915 1.00 0.54 H new ATOM 0 HA ARG A 429 -14.987 6.343 -1.688 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -12.514 6.886 -3.354 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.182 6.799 -3.885 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -14.711 8.922 -2.950 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.250 8.955 -1.982 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -13.190 10.428 -4.033 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -11.856 9.300 -3.902 1.00 1.12 H new ATOM 0 HE ARG A 429 -13.427 7.833 -5.470 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -12.959 11.332 -5.527 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -13.221 11.454 -7.269 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -13.722 7.995 -7.709 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -13.651 9.574 -8.500 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.021 4.972 -1.691 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.202 3.792 -1.863 1.00 0.36 C ATOM 1721 C LEU A 430 -11.591 2.664 -0.932 1.00 0.39 C ATOM 1722 O LEU A 430 -11.529 1.491 -1.300 1.00 0.45 O ATOM 1723 CB LEU A 430 -9.768 4.190 -1.641 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.141 4.940 -2.789 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.895 5.599 -2.292 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.828 3.998 -3.939 1.00 0.56 C ATOM 0 H LEU A 430 -11.488 5.794 -1.406 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.351 3.409 -2.872 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -9.711 4.808 -0.745 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.181 3.292 -1.447 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.835 5.692 -3.164 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.424 6.148 -3.107 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.145 6.289 -1.486 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.206 4.841 -1.920 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.376 4.560 -4.757 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.134 3.229 -3.600 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.749 3.529 -4.286 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.000 3.033 0.265 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.451 2.070 1.269 1.00 0.53 C ATOM 1740 C GLU A 431 -13.584 1.170 0.749 1.00 0.59 C ATOM 1741 O GLU A 431 -13.894 0.142 1.350 1.00 0.72 O ATOM 1742 CB GLU A 431 -12.900 2.799 2.525 1.00 0.61 C ATOM 1743 CG GLU A 431 -11.763 3.434 3.297 1.00 0.73 C ATOM 1744 CD GLU A 431 -12.241 4.254 4.476 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -12.515 5.461 4.297 1.00 1.25 O ATOM 1746 OE2 GLU A 431 -12.356 3.698 5.588 1.00 1.31 O ATOM 0 H GLU A 431 -12.032 4.004 0.576 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.605 1.424 1.501 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -13.617 3.572 2.249 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -13.422 2.097 3.175 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -11.090 2.653 3.652 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -11.186 4.071 2.627 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.187 1.551 -0.375 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.337 0.828 -0.913 1.00 0.66 C ATOM 1755 C HIS A 432 -14.941 -0.141 -2.021 1.00 0.60 C ATOM 1756 O HIS A 432 -15.605 -1.152 -2.229 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.375 1.807 -1.446 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.896 2.737 -0.407 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -18.065 2.525 0.283 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -16.388 3.891 0.056 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -18.255 3.516 1.132 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -17.247 4.360 1.015 1.00 3.38 N ATOM 0 H HIS A 432 -13.898 2.356 -0.931 1.00 0.58 H new ATOM 0 HA HIS A 432 -15.760 0.247 -0.093 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -15.934 2.388 -2.256 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -17.207 1.247 -1.872 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -15.472 4.362 -0.268 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -19.092 3.619 1.807 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -17.127 5.220 1.550 1.00 3.38 H new ATOM 1771 N LEU A 433 -13.880 0.171 -2.747 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.412 -0.720 -3.805 1.00 0.53 C ATOM 1773 C LEU A 433 -12.398 -1.707 -3.257 1.00 0.54 C ATOM 1774 O LEU A 433 -12.329 -2.856 -3.693 1.00 0.67 O ATOM 1775 CB LEU A 433 -12.808 0.062 -4.972 1.00 0.60 C ATOM 1776 CG LEU A 433 -11.713 1.056 -4.609 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -10.561 0.974 -5.602 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.284 2.461 -4.582 1.00 0.88 C ATOM 0 H LEU A 433 -13.330 1.022 -2.629 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.276 -1.268 -4.180 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -12.402 -0.650 -5.690 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -13.610 0.602 -5.476 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.329 0.807 -3.620 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -9.790 1.692 -5.324 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.141 -0.032 -5.590 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -10.927 1.203 -6.603 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.497 3.169 -4.322 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -12.685 2.710 -5.564 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.081 2.516 -3.840 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.626 -1.252 -2.288 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.601 -2.079 -1.670 1.00 0.60 C ATOM 1792 C GLU A 434 -11.200 -3.145 -0.767 1.00 0.76 C ATOM 1793 O GLU A 434 -10.537 -4.126 -0.431 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.616 -1.213 -0.899 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.692 -0.430 -1.813 1.00 0.63 C ATOM 1796 CD GLU A 434 -7.714 -1.316 -2.561 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -8.117 -2.398 -3.049 1.00 1.90 O ATOM 1798 OE2 GLU A 434 -6.534 -0.935 -2.640 1.00 1.36 O ATOM 0 H GLU A 434 -11.689 -0.307 -1.908 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.068 -2.595 -2.469 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -10.167 -0.519 -0.264 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -9.020 -1.845 -0.240 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -9.289 0.131 -2.532 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -8.136 0.299 -1.223 1.00 0.63 H new ATOM 1805 N SER A 435 -12.459 -2.960 -0.403 1.00 0.72 N ATOM 1806 CA SER A 435 -13.162 -3.921 0.435 1.00 0.89 C ATOM 1807 C SER A 435 -13.431 -5.203 -0.352 1.00 1.03 C ATOM 1808 O SER A 435 -13.706 -6.261 0.218 1.00 1.20 O ATOM 1809 CB SER A 435 -14.471 -3.316 0.946 1.00 0.97 C ATOM 1810 OG SER A 435 -15.286 -2.875 -0.124 1.00 1.47 O ATOM 0 H SER A 435 -13.017 -2.151 -0.675 1.00 0.72 H new ATOM 0 HA SER A 435 -12.538 -4.167 1.295 1.00 0.89 H new ATOM 0 HB2 SER A 435 -15.011 -4.057 1.536 1.00 0.97 H new ATOM 0 HB3 SER A 435 -14.253 -2.479 1.609 1.00 0.97 H new ATOM 0 HG SER A 435 -16.116 -2.495 0.232 1.00 1.47 H new ATOM 1816 N GLN A 436 -13.349 -5.085 -1.668 1.00 1.04 N ATOM 1817 CA GLN A 436 -13.462 -6.219 -2.556 1.00 1.24 C ATOM 1818 C GLN A 436 -12.072 -6.762 -2.858 1.00 1.47 C ATOM 1819 O GLN A 436 -11.672 -7.755 -2.222 1.00 1.78 O ATOM 1820 CB GLN A 436 -14.166 -5.802 -3.847 1.00 1.17 C ATOM 1821 CG GLN A 436 -15.568 -5.261 -3.631 1.00 1.30 C ATOM 1822 CD GLN A 436 -16.537 -6.308 -3.115 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -16.419 -7.492 -3.426 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -17.503 -5.882 -2.319 1.00 2.60 N ATOM 1825 OXT GLN A 436 -11.370 -6.160 -3.700 1.00 2.10 O ATOM 0 H GLN A 436 -13.202 -4.196 -2.146 1.00 1.04 H new ATOM 0 HA GLN A 436 -14.053 -7.000 -2.079 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -13.566 -5.042 -4.348 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -14.217 -6.661 -4.516 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -15.526 -4.433 -2.923 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -15.944 -4.858 -4.571 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -17.570 -4.892 -2.083 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -18.181 -6.543 -1.941 1.00 2.60 H new TER 1834 GLN A 436