USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 914 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 396 HIS : no HD1:sc= -1.6 K(o=-2.2,f=-10!) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 161:sc= -0.61! (180deg=-2.29!) USER MOD Set 2.1: A 332 SER OG : rot -39:sc= 1.24 USER MOD Set 2.2: A 423 MET CE :methyl 153:sc= -0.369 (180deg=-1.2) USER MOD Single : A 333 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 334 MET CE :methyl -138:sc= -0.259 (180deg=-1.01) USER MOD Single : A 340 TYR OH : rot 30:sc= -0.293 USER MOD Single : A 342 TYR OH : rot 123:sc= -0.38 USER MOD Single : A 343 GLN : amide:sc= -1.32 K(o=-1.3,f=-0.12) USER MOD Single : A 346 SER OG : rot -35:sc= 0.403 USER MOD Single : A 348 SER OG : rot 92:sc= 1.21 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc= -0.0179 X(o=-0.018,f=-0.36) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0.943 (180deg=0.943) USER MOD Single : A 361 SER OG : rot 74:sc= 1.03 USER MOD Single : A 362 LYS NZ :NH3+ 166:sc= 0.114 (180deg=0.0752) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.188 K(o=-0.19,f=-1.2!) USER MOD Single : A 379 HIS : no HD1:sc= -2.01 K(o=-2,f=-4.5!) USER MOD Single : A 380 LYS NZ :NH3+ 168:sc= 1.96 (180deg=1.51) USER MOD Single : A 381 ASN : amide:sc= -1.65! K(o=-1.7!,f=-0.26) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= -0.0298 K(o=-0.03,f=-1.6!) USER MOD Single : A 385 MET CE :methyl 151:sc= -3.12! (180deg=-6.04!) USER MOD Single : A 386 THR OG1 : rot 180:sc= -0.734 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 LYS NZ :NH3+ -163:sc= 1.14 (180deg=0.975) USER MOD Single : A 390 MET CE :methyl -177:sc= -9.11! (180deg=-9.46!) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot -12:sc= -1.5! USER MOD Single : A 398 TYR OH : rot -25:sc= 0.327 USER MOD Single : A 401 ASN : amide:sc= -1.27! K(o=-1.3!,f=-0.0073) USER MOD Single : A 405 LYS NZ :NH3+ 171:sc= 0.79 (180deg=0.636) USER MOD Single : A 409 GLN : amide:sc= -4.57! C(o=-4.6!,f=-3.2!) USER MOD Single : A 416 MET CE :methyl -159:sc= -0.265 (180deg=-0.899) USER MOD Single : A 417 LYS NZ :NH3+ 175:sc= -0.0341 (180deg=-0.101) USER MOD Single : A 418 THR OG1 : rot -74:sc= 1.21 USER MOD Single : A 424 SER OG : rot 180:sc= -0.0701 USER MOD Single : A 427 THR OG1 : rot -39:sc= -2.61! USER MOD Single : A 432 HIS : no HD1:sc= -0.0132 X(o=-0.013,f=-0.0017) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 0.504 K(o=0.5,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -14.389 4.864 10.874 1.00 6.78 N ATOM 2 CA GLY A 331 -14.488 3.425 10.531 1.00 6.11 C ATOM 3 C GLY A 331 -13.128 2.804 10.300 1.00 5.22 C ATOM 4 O GLY A 331 -12.318 2.722 11.224 1.00 5.14 O ATOM 0 HA2 GLY A 331 -14.997 2.894 11.336 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -15.098 3.307 9.635 1.00 6.11 H new ATOM 10 N SER A 332 -12.885 2.369 9.065 1.00 4.99 N ATOM 11 CA SER A 332 -11.593 1.823 8.658 1.00 4.63 C ATOM 12 C SER A 332 -11.140 0.690 9.578 1.00 3.82 C ATOM 13 O SER A 332 -10.110 0.780 10.250 1.00 4.13 O ATOM 14 CB SER A 332 -10.551 2.940 8.612 1.00 5.44 C ATOM 15 OG SER A 332 -11.000 4.006 7.790 1.00 6.08 O ATOM 0 H SER A 332 -13.579 2.385 8.318 1.00 4.99 H new ATOM 0 HA SER A 332 -11.703 1.397 7.661 1.00 4.63 H new ATOM 0 HB2 SER A 332 -10.358 3.307 9.620 1.00 5.44 H new ATOM 0 HB3 SER A 332 -9.608 2.550 8.229 1.00 5.44 H new ATOM 0 HG SER A 332 -11.458 3.642 7.004 1.00 6.08 H new ATOM 21 N HIS A 333 -11.921 -0.375 9.603 1.00 3.28 N ATOM 22 CA HIS A 333 -11.581 -1.556 10.383 1.00 2.94 C ATOM 23 C HIS A 333 -10.936 -2.602 9.485 1.00 2.02 C ATOM 24 O HIS A 333 -10.407 -3.611 9.953 1.00 2.49 O ATOM 25 CB HIS A 333 -12.824 -2.124 11.067 1.00 3.89 C ATOM 26 CG HIS A 333 -13.348 -1.250 12.166 1.00 4.68 C ATOM 27 ND1 HIS A 333 -14.424 -0.402 12.016 1.00 5.34 N ATOM 28 CD2 HIS A 333 -12.931 -1.102 13.445 1.00 5.35 C ATOM 29 CE1 HIS A 333 -14.645 0.229 13.155 1.00 6.24 C ATOM 30 NE2 HIS A 333 -13.754 -0.178 14.041 1.00 6.26 N ATOM 0 H HIS A 333 -12.800 -0.448 9.090 1.00 3.28 H new ATOM 0 HA HIS A 333 -10.869 -1.273 11.158 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -13.607 -2.267 10.322 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -12.588 -3.107 11.475 1.00 3.89 H new ATOM 0 HD2 HIS A 333 -12.103 -1.616 13.911 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -15.424 0.956 13.332 1.00 6.24 H new ATOM 0 HE2 HIS A 333 -13.688 0.141 15.008 1.00 6.26 H new ATOM 39 N MET A 334 -10.982 -2.336 8.189 1.00 1.20 N ATOM 40 CA MET A 334 -10.348 -3.190 7.197 1.00 0.62 C ATOM 41 C MET A 334 -9.283 -2.378 6.465 1.00 0.57 C ATOM 42 O MET A 334 -9.595 -1.355 5.848 1.00 0.92 O ATOM 43 CB MET A 334 -11.410 -3.724 6.220 1.00 1.35 C ATOM 44 CG MET A 334 -10.950 -4.883 5.343 1.00 2.01 C ATOM 45 SD MET A 334 -9.858 -4.382 3.997 1.00 3.03 S ATOM 46 CE MET A 334 -10.920 -3.271 3.077 1.00 3.71 C ATOM 0 H MET A 334 -11.459 -1.524 7.796 1.00 1.20 H new ATOM 0 HA MET A 334 -9.873 -4.046 7.676 1.00 0.62 H new ATOM 0 HB2 MET A 334 -12.281 -4.044 6.792 1.00 1.35 H new ATOM 0 HB3 MET A 334 -11.734 -2.906 5.576 1.00 1.35 H new ATOM 0 HG2 MET A 334 -10.435 -5.615 5.964 1.00 2.01 H new ATOM 0 HG3 MET A 334 -11.825 -5.380 4.924 1.00 2.01 H new ATOM 0 HE1 MET A 334 -10.798 -3.452 2.009 1.00 3.71 H new ATOM 0 HE2 MET A 334 -11.959 -3.444 3.358 1.00 3.71 H new ATOM 0 HE3 MET A 334 -10.650 -2.239 3.303 1.00 3.71 H new ATOM 56 N ARG A 335 -8.028 -2.808 6.567 1.00 0.40 N ATOM 57 CA ARG A 335 -6.918 -2.058 5.983 1.00 0.32 C ATOM 58 C ARG A 335 -6.995 -2.023 4.468 1.00 0.28 C ATOM 59 O ARG A 335 -7.079 -3.065 3.819 1.00 0.42 O ATOM 60 CB ARG A 335 -5.557 -2.643 6.375 1.00 0.37 C ATOM 61 CG ARG A 335 -5.226 -2.559 7.852 1.00 0.56 C ATOM 62 CD ARG A 335 -5.642 -3.800 8.615 1.00 0.93 C ATOM 63 NE ARG A 335 -5.208 -3.736 10.004 1.00 1.32 N ATOM 64 CZ ARG A 335 -4.689 -4.766 10.666 1.00 2.05 C ATOM 65 NH1 ARG A 335 -4.662 -5.973 10.109 1.00 2.81 N ATOM 66 NH2 ARG A 335 -4.226 -4.595 11.895 1.00 2.51 N ATOM 0 H ARG A 335 -7.755 -3.666 7.045 1.00 0.40 H new ATOM 0 HA ARG A 335 -7.008 -1.047 6.381 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.526 -3.689 6.070 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.780 -2.124 5.814 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -4.153 -2.406 7.972 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -5.722 -1.689 8.283 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -6.726 -3.908 8.575 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -5.216 -4.683 8.139 1.00 0.93 H new ATOM 0 HE ARG A 335 -5.308 -2.849 10.498 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -5.040 -6.111 9.172 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -4.263 -6.761 10.619 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -4.268 -3.674 12.332 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -3.828 -5.384 12.404 1.00 2.51 H new ATOM 80 N LEU A 336 -6.971 -0.813 3.918 1.00 0.23 N ATOM 81 CA LEU A 336 -6.793 -0.618 2.483 1.00 0.28 C ATOM 82 C LEU A 336 -5.441 -1.140 2.064 1.00 0.14 C ATOM 83 O LEU A 336 -4.671 -1.571 2.902 1.00 0.20 O ATOM 84 CB LEU A 336 -6.878 0.860 2.106 1.00 0.48 C ATOM 85 CG LEU A 336 -8.223 1.523 2.344 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.556 2.415 1.172 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.297 0.478 2.558 1.00 0.67 C ATOM 0 H LEU A 336 -7.073 0.052 4.448 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.590 -1.159 1.974 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -6.120 1.404 2.670 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.625 0.962 1.051 1.00 0.48 H new ATOM 0 HG LEU A 336 -8.173 2.134 3.245 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.521 2.892 1.341 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.787 3.180 1.067 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.601 1.818 0.261 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.255 0.970 2.727 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.367 -0.158 1.676 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -9.044 -0.131 3.426 1.00 0.67 H new ATOM 99 N LEU A 337 -5.127 -1.076 0.788 1.00 0.15 N ATOM 100 CA LEU A 337 -3.853 -1.584 0.328 1.00 0.12 C ATOM 101 C LEU A 337 -2.716 -0.775 0.957 1.00 0.11 C ATOM 102 O LEU A 337 -1.781 -1.349 1.506 1.00 0.12 O ATOM 103 CB LEU A 337 -3.815 -1.567 -1.203 1.00 0.14 C ATOM 104 CG LEU A 337 -2.616 -2.218 -1.878 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.572 -1.180 -2.167 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.032 -3.331 -1.026 1.00 0.15 C ATOM 0 H LEU A 337 -5.725 -0.684 0.061 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.722 -2.619 0.643 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.716 -2.059 -1.568 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.864 -0.528 -1.530 1.00 0.14 H new ATOM 0 HG LEU A 337 -2.953 -2.664 -2.814 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.715 -1.650 -2.650 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -1.988 -0.419 -2.827 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.253 -0.716 -1.234 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.178 -3.773 -1.540 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.709 -2.924 -0.068 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -2.790 -4.096 -0.858 1.00 0.15 H new ATOM 118 N TRP A 338 -2.823 0.551 0.941 1.00 0.12 N ATOM 119 CA TRP A 338 -1.829 1.391 1.619 1.00 0.14 C ATOM 120 C TRP A 338 -1.920 1.224 3.137 1.00 0.14 C ATOM 121 O TRP A 338 -0.906 1.251 3.834 1.00 0.17 O ATOM 122 CB TRP A 338 -1.970 2.882 1.244 1.00 0.16 C ATOM 123 CG TRP A 338 -3.254 3.527 1.678 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.354 3.745 0.910 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.564 4.053 2.973 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.330 4.362 1.643 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.873 4.556 2.914 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.866 4.136 4.176 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.495 5.136 4.009 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.484 4.707 5.262 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.792 5.201 5.174 1.00 0.21 C ATOM 0 H TRP A 338 -3.572 1.064 0.476 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.849 1.055 1.279 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.138 3.432 1.684 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.880 2.979 0.162 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.444 3.470 -0.131 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.250 4.633 1.296 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.857 3.758 4.253 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.501 5.523 3.941 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.952 4.776 6.200 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.252 5.642 6.046 1.00 0.21 H new ATOM 142 N ASP A 339 -3.135 1.039 3.650 1.00 0.14 N ATOM 143 CA ASP A 339 -3.335 0.885 5.091 1.00 0.17 C ATOM 144 C ASP A 339 -2.777 -0.460 5.528 1.00 0.16 C ATOM 145 O ASP A 339 -2.358 -0.651 6.669 1.00 0.23 O ATOM 146 CB ASP A 339 -4.825 1.034 5.449 1.00 0.23 C ATOM 147 CG ASP A 339 -5.065 1.115 6.949 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.302 1.815 7.648 1.00 0.86 O ATOM 149 OD2 ASP A 339 -6.001 0.453 7.442 1.00 1.15 O ATOM 0 H ASP A 339 -3.990 0.992 3.095 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.801 1.670 5.626 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.220 1.931 4.973 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.378 0.188 5.042 1.00 0.23 H new ATOM 154 N TYR A 340 -2.761 -1.374 4.579 1.00 0.11 N ATOM 155 CA TYR A 340 -2.167 -2.680 4.742 1.00 0.10 C ATOM 156 C TYR A 340 -0.645 -2.595 4.724 1.00 0.08 C ATOM 157 O TYR A 340 0.015 -3.134 5.611 1.00 0.09 O ATOM 158 CB TYR A 340 -2.654 -3.588 3.622 1.00 0.11 C ATOM 159 CG TYR A 340 -2.350 -5.030 3.857 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.635 -5.613 5.077 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.786 -5.805 2.866 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.364 -6.936 5.307 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.510 -7.133 3.083 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.802 -7.700 4.309 1.00 0.16 C ATOM 165 OH TYR A 340 -1.530 -9.028 4.540 1.00 0.20 O ATOM 0 H TYR A 340 -3.169 -1.224 3.656 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.467 -3.088 5.707 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.731 -3.465 3.506 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.195 -3.275 2.684 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.078 -5.017 5.861 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.558 -5.363 1.907 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.590 -7.377 6.266 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.067 -7.731 2.300 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.172 -9.385 5.188 1.00 0.20 H new ATOM 175 N VAL A 341 -0.087 -1.911 3.715 1.00 0.08 N ATOM 176 CA VAL A 341 1.368 -1.835 3.570 1.00 0.07 C ATOM 177 C VAL A 341 1.995 -1.226 4.813 1.00 0.08 C ATOM 178 O VAL A 341 3.076 -1.619 5.204 1.00 0.08 O ATOM 179 CB VAL A 341 1.842 -1.040 2.317 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.066 -1.436 1.084 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.784 0.464 2.517 1.00 0.09 C ATOM 0 H VAL A 341 -0.614 -1.411 2.999 1.00 0.08 H new ATOM 0 HA VAL A 341 1.700 -2.864 3.435 1.00 0.07 H new ATOM 0 HB VAL A 341 2.889 -1.306 2.171 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.423 -0.862 0.229 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.207 -2.499 0.891 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.006 -1.233 1.240 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.126 0.965 1.611 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.758 0.763 2.732 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.426 0.745 3.352 1.00 0.09 H new ATOM 191 N TYR A 342 1.306 -0.272 5.430 1.00 0.08 N ATOM 192 CA TYR A 342 1.775 0.319 6.689 1.00 0.10 C ATOM 193 C TYR A 342 1.985 -0.743 7.765 1.00 0.11 C ATOM 194 O TYR A 342 2.956 -0.686 8.521 1.00 0.14 O ATOM 195 CB TYR A 342 0.795 1.367 7.222 1.00 0.11 C ATOM 196 CG TYR A 342 1.079 2.779 6.774 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.178 3.470 7.261 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.242 3.431 5.883 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.440 4.769 6.869 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.499 4.726 5.486 1.00 0.19 C ATOM 201 CZ TYR A 342 1.598 5.390 5.981 1.00 0.17 C ATOM 202 OH TYR A 342 1.859 6.680 5.581 1.00 0.21 O ATOM 0 H TYR A 342 0.425 0.110 5.085 1.00 0.08 H new ATOM 0 HA TYR A 342 2.727 0.798 6.463 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.213 1.096 6.907 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.808 1.336 8.311 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.842 2.984 7.960 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.625 2.917 5.494 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.301 5.292 7.259 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.161 5.219 4.788 1.00 0.19 H new ATOM 0 HH TYR A 342 1.944 6.709 4.605 1.00 0.21 H new ATOM 212 N GLN A 343 1.088 -1.722 7.823 1.00 0.12 N ATOM 213 CA GLN A 343 1.151 -2.737 8.851 1.00 0.18 C ATOM 214 C GLN A 343 2.270 -3.701 8.504 1.00 0.18 C ATOM 215 O GLN A 343 2.972 -4.215 9.375 1.00 0.25 O ATOM 216 CB GLN A 343 -0.209 -3.448 8.964 1.00 0.28 C ATOM 217 CG GLN A 343 -0.265 -4.842 8.375 1.00 0.55 C ATOM 218 CD GLN A 343 -0.133 -5.922 9.435 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.130 -6.429 9.948 1.00 1.40 O ATOM 220 NE2 GLN A 343 1.092 -6.246 9.804 1.00 1.15 N ATOM 0 H GLN A 343 0.313 -1.828 7.168 1.00 0.12 H new ATOM 0 HA GLN A 343 1.364 -2.293 9.823 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.483 -3.506 10.017 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.963 -2.834 8.472 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.208 -4.972 7.843 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.533 -4.956 7.642 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.894 -5.804 9.355 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.237 -6.939 10.538 1.00 1.15 H new ATOM 229 N LEU A 344 2.438 -3.918 7.211 1.00 0.15 N ATOM 230 CA LEU A 344 3.482 -4.781 6.711 1.00 0.16 C ATOM 231 C LEU A 344 4.842 -4.107 6.880 1.00 0.18 C ATOM 232 O LEU A 344 5.837 -4.740 7.217 1.00 0.27 O ATOM 233 CB LEU A 344 3.212 -5.069 5.237 1.00 0.13 C ATOM 234 CG LEU A 344 1.805 -5.577 4.929 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.582 -5.619 3.439 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.579 -6.953 5.520 1.00 0.18 C ATOM 0 H LEU A 344 1.855 -3.501 6.485 1.00 0.15 H new ATOM 0 HA LEU A 344 3.492 -5.716 7.271 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.387 -4.157 4.666 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.934 -5.807 4.888 1.00 0.13 H new ATOM 0 HG LEU A 344 1.092 -4.888 5.382 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.576 -5.983 3.232 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.698 -4.617 3.025 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.311 -6.287 2.981 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.569 -7.289 5.285 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.301 -7.653 5.099 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.704 -6.909 6.602 1.00 0.18 H new ATOM 248 N LEU A 345 4.837 -2.803 6.655 1.00 0.12 N ATOM 249 CA LEU A 345 6.015 -1.946 6.776 1.00 0.13 C ATOM 250 C LEU A 345 6.573 -1.974 8.194 1.00 0.19 C ATOM 251 O LEU A 345 7.780 -1.858 8.404 1.00 0.29 O ATOM 252 CB LEU A 345 5.632 -0.508 6.400 1.00 0.10 C ATOM 253 CG LEU A 345 6.057 -0.036 5.000 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.334 -1.210 4.085 1.00 0.12 C ATOM 255 CD2 LEU A 345 4.992 0.866 4.389 1.00 0.10 C ATOM 0 H LEU A 345 3.997 -2.295 6.377 1.00 0.12 H new ATOM 0 HA LEU A 345 6.786 -2.318 6.102 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.549 -0.410 6.481 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.069 0.167 7.136 1.00 0.10 H new ATOM 0 HG LEU A 345 6.979 0.535 5.110 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.632 -0.843 3.103 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.136 -1.817 4.505 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.433 -1.816 3.988 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.313 1.189 3.399 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.054 0.317 4.306 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.846 1.739 5.025 1.00 0.10 H new ATOM 267 N SER A 346 5.685 -2.140 9.164 1.00 0.25 N ATOM 268 CA SER A 346 6.064 -2.077 10.566 1.00 0.33 C ATOM 269 C SER A 346 6.388 -3.464 11.125 1.00 0.30 C ATOM 270 O SER A 346 6.758 -3.597 12.296 1.00 0.53 O ATOM 271 CB SER A 346 4.933 -1.429 11.377 1.00 0.51 C ATOM 272 OG SER A 346 5.326 -1.188 12.721 1.00 1.43 O ATOM 0 H SER A 346 4.694 -2.320 9.004 1.00 0.25 H new ATOM 0 HA SER A 346 6.966 -1.471 10.647 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.641 -0.489 10.909 1.00 0.51 H new ATOM 0 HB3 SER A 346 4.057 -2.078 11.364 1.00 0.51 H new ATOM 0 HG SER A 346 5.925 -1.904 13.020 1.00 1.43 H new ATOM 278 N ASP A 347 6.256 -4.495 10.299 1.00 0.32 N ATOM 279 CA ASP A 347 6.487 -5.862 10.753 1.00 0.32 C ATOM 280 C ASP A 347 7.498 -6.570 9.854 1.00 0.30 C ATOM 281 O ASP A 347 7.262 -6.772 8.663 1.00 0.30 O ATOM 282 CB ASP A 347 5.167 -6.636 10.788 1.00 0.35 C ATOM 283 CG ASP A 347 5.258 -7.927 11.579 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.360 -8.512 11.626 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.237 -8.368 12.149 1.00 0.67 O ATOM 0 H ASP A 347 5.992 -4.412 9.317 1.00 0.32 H new ATOM 0 HA ASP A 347 6.899 -5.825 11.761 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.393 -6.004 11.223 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.858 -6.863 9.768 1.00 0.35 H new ATOM 290 N SER A 348 8.619 -6.959 10.449 1.00 0.34 N ATOM 291 CA SER A 348 9.728 -7.566 9.720 1.00 0.35 C ATOM 292 C SER A 348 9.335 -8.868 9.019 1.00 0.31 C ATOM 293 O SER A 348 9.993 -9.275 8.062 1.00 0.32 O ATOM 294 CB SER A 348 10.893 -7.820 10.677 1.00 0.46 C ATOM 295 OG SER A 348 11.964 -8.493 10.037 1.00 1.53 O ATOM 0 H SER A 348 8.786 -6.863 11.451 1.00 0.34 H new ATOM 0 HA SER A 348 10.025 -6.864 8.941 1.00 0.35 H new ATOM 0 HB2 SER A 348 11.248 -6.870 11.077 1.00 0.46 H new ATOM 0 HB3 SER A 348 10.545 -8.413 11.523 1.00 0.46 H new ATOM 0 HG SER A 348 12.600 -7.836 9.686 1.00 1.53 H new ATOM 301 N ARG A 349 8.261 -9.522 9.460 1.00 0.33 N ATOM 302 CA ARG A 349 7.866 -10.780 8.830 1.00 0.35 C ATOM 303 C ARG A 349 7.414 -10.548 7.393 1.00 0.29 C ATOM 304 O ARG A 349 7.353 -11.479 6.592 1.00 0.34 O ATOM 305 CB ARG A 349 6.792 -11.514 9.614 1.00 0.42 C ATOM 306 CG ARG A 349 5.490 -10.778 9.765 1.00 0.55 C ATOM 307 CD ARG A 349 4.550 -11.617 10.590 1.00 0.59 C ATOM 308 NE ARG A 349 3.488 -10.825 11.204 1.00 1.23 N ATOM 309 CZ ARG A 349 2.352 -11.330 11.692 1.00 1.67 C ATOM 310 NH1 ARG A 349 2.131 -12.639 11.687 1.00 1.93 N ATOM 311 NH2 ARG A 349 1.435 -10.518 12.199 1.00 2.56 N ATOM 0 H ARG A 349 7.665 -9.213 10.228 1.00 0.33 H new ATOM 0 HA ARG A 349 8.750 -11.418 8.825 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.596 -12.468 9.125 1.00 0.42 H new ATOM 0 HB3 ARG A 349 7.180 -11.739 10.607 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.655 -9.814 10.245 1.00 0.55 H new ATOM 0 HG3 ARG A 349 5.055 -10.576 8.786 1.00 0.55 H new ATOM 0 HD2 ARG A 349 4.106 -12.387 9.959 1.00 0.59 H new ATOM 0 HD3 ARG A 349 5.114 -12.129 11.369 1.00 0.59 H new ATOM 0 HE ARG A 349 3.623 -9.816 11.264 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.834 -13.273 11.307 1.00 1.93 H new ATOM 0 HH12 ARG A 349 1.259 -13.010 12.063 1.00 1.93 H new ATOM 0 HH21 ARG A 349 1.598 -9.511 12.215 1.00 2.56 H new ATOM 0 HH22 ARG A 349 0.566 -10.900 12.573 1.00 2.56 H new ATOM 325 N TYR A 350 7.107 -9.298 7.066 1.00 0.22 N ATOM 326 CA TYR A 350 6.692 -8.950 5.720 1.00 0.17 C ATOM 327 C TYR A 350 7.774 -8.168 5.001 1.00 0.16 C ATOM 328 O TYR A 350 7.604 -7.804 3.841 1.00 0.15 O ATOM 329 CB TYR A 350 5.439 -8.096 5.743 1.00 0.17 C ATOM 330 CG TYR A 350 4.352 -8.610 6.635 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.640 -9.751 6.312 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.012 -7.921 7.781 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.616 -10.193 7.109 1.00 0.29 C ATOM 334 CE2 TYR A 350 2.996 -8.356 8.591 1.00 0.28 C ATOM 335 CZ TYR A 350 2.293 -9.493 8.253 1.00 0.31 C ATOM 336 OH TYR A 350 1.260 -9.924 9.054 1.00 0.39 O ATOM 0 H TYR A 350 7.139 -8.513 7.716 1.00 0.22 H new ATOM 0 HA TYR A 350 6.498 -9.886 5.197 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.707 -7.089 6.062 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.051 -8.016 4.728 1.00 0.17 H new ATOM 0 HD1 TYR A 350 3.895 -10.302 5.419 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.555 -7.025 8.044 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.066 -11.083 6.843 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.747 -7.811 9.490 1.00 0.28 H new ATOM 0 HH TYR A 350 1.165 -9.319 9.819 1.00 0.39 H new ATOM 346 N GLU A 351 8.891 -7.913 5.680 1.00 0.18 N ATOM 347 CA GLU A 351 9.941 -7.066 5.112 1.00 0.21 C ATOM 348 C GLU A 351 10.632 -7.757 3.933 1.00 0.21 C ATOM 349 O GLU A 351 11.464 -7.164 3.246 1.00 0.24 O ATOM 350 CB GLU A 351 10.959 -6.632 6.173 1.00 0.28 C ATOM 351 CG GLU A 351 12.024 -7.658 6.478 1.00 0.48 C ATOM 352 CD GLU A 351 13.229 -7.035 7.142 1.00 0.99 C ATOM 353 OE1 GLU A 351 14.118 -6.535 6.420 1.00 1.05 O ATOM 354 OE2 GLU A 351 13.286 -7.022 8.384 1.00 1.78 O ATOM 0 H GLU A 351 9.092 -8.275 6.612 1.00 0.18 H new ATOM 0 HA GLU A 351 9.460 -6.163 4.737 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.442 -5.714 5.840 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.426 -6.396 7.094 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.610 -8.430 7.127 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.331 -8.149 5.554 1.00 0.48 H new ATOM 361 N ASN A 352 10.277 -9.017 3.712 1.00 0.19 N ATOM 362 CA ASN A 352 10.720 -9.751 2.537 1.00 0.21 C ATOM 363 C ASN A 352 9.837 -9.405 1.340 1.00 0.16 C ATOM 364 O ASN A 352 10.231 -9.572 0.193 1.00 0.18 O ATOM 365 CB ASN A 352 10.669 -11.251 2.815 1.00 0.27 C ATOM 366 CG ASN A 352 11.058 -12.102 1.622 1.00 1.03 C ATOM 367 OD1 ASN A 352 11.936 -11.740 0.839 1.00 1.83 O ATOM 368 ND2 ASN A 352 10.407 -13.242 1.479 1.00 1.62 N ATOM 0 H ASN A 352 9.678 -9.554 4.339 1.00 0.19 H new ATOM 0 HA ASN A 352 11.747 -9.469 2.306 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.334 -11.481 3.647 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.661 -11.520 3.129 1.00 0.27 H new ATOM 0 HD21 ASN A 352 10.625 -13.859 0.697 1.00 1.62 H new ATOM 0 HD22 ASN A 352 9.686 -13.505 2.151 1.00 1.62 H new ATOM 375 N PHE A 353 8.638 -8.914 1.632 1.00 0.13 N ATOM 376 CA PHE A 353 7.671 -8.548 0.608 1.00 0.10 C ATOM 377 C PHE A 353 7.598 -7.032 0.427 1.00 0.08 C ATOM 378 O PHE A 353 7.310 -6.543 -0.661 1.00 0.07 O ATOM 379 CB PHE A 353 6.287 -9.062 0.991 1.00 0.09 C ATOM 380 CG PHE A 353 6.230 -10.532 1.282 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.901 -11.440 0.488 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.509 -10.999 2.362 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.853 -12.789 0.761 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.457 -12.348 2.646 1.00 0.17 C ATOM 385 CZ PHE A 353 6.130 -13.245 1.843 1.00 0.18 C ATOM 0 H PHE A 353 8.311 -8.759 2.585 1.00 0.13 H new ATOM 0 HA PHE A 353 7.997 -9.000 -0.329 1.00 0.10 H new ATOM 0 HB2 PHE A 353 5.941 -8.517 1.869 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.593 -8.837 0.181 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.471 -11.088 -0.359 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.979 -10.300 2.992 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.380 -13.488 0.129 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.891 -12.701 3.495 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.091 -14.302 2.061 1.00 0.18 H new ATOM 395 N ILE A 354 7.863 -6.297 1.494 1.00 0.08 N ATOM 396 CA ILE A 354 7.751 -4.841 1.485 1.00 0.07 C ATOM 397 C ILE A 354 8.451 -4.288 2.721 1.00 0.08 C ATOM 398 O ILE A 354 8.546 -4.977 3.732 1.00 0.10 O ATOM 399 CB ILE A 354 6.267 -4.402 1.478 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.108 -2.931 1.086 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.644 -4.659 2.839 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.669 -2.463 1.084 1.00 0.07 C ATOM 0 H ILE A 354 8.161 -6.687 2.388 1.00 0.08 H new ATOM 0 HA ILE A 354 8.221 -4.451 0.582 1.00 0.07 H new ATOM 0 HB ILE A 354 5.748 -4.995 0.725 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.682 -2.314 1.777 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.533 -2.779 0.094 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.600 -4.347 2.826 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.702 -5.722 3.071 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.182 -4.092 3.598 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.629 -1.412 0.798 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.095 -3.056 0.372 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.246 -2.584 2.081 1.00 0.07 H new ATOM 414 N ARG A 355 8.952 -3.069 2.649 1.00 0.09 N ATOM 415 CA ARG A 355 9.705 -2.514 3.767 1.00 0.11 C ATOM 416 C ARG A 355 9.826 -1.003 3.661 1.00 0.10 C ATOM 417 O ARG A 355 9.775 -0.444 2.569 1.00 0.14 O ATOM 418 CB ARG A 355 11.110 -3.114 3.793 1.00 0.16 C ATOM 419 CG ARG A 355 12.020 -2.534 2.728 1.00 0.22 C ATOM 420 CD ARG A 355 13.422 -3.086 2.832 1.00 0.25 C ATOM 421 NE ARG A 355 14.387 -2.227 2.155 1.00 0.98 N ATOM 422 CZ ARG A 355 15.692 -2.224 2.405 1.00 1.40 C ATOM 423 NH1 ARG A 355 16.204 -3.076 3.283 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.477 -1.352 1.784 1.00 2.08 N ATOM 0 H ARG A 355 8.856 -2.450 1.844 1.00 0.09 H new ATOM 0 HA ARG A 355 9.166 -2.761 4.682 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.554 -2.945 4.774 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.041 -4.193 3.656 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.613 -2.756 1.741 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.048 -1.449 2.824 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.697 -3.187 3.882 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.454 -4.085 2.396 1.00 0.25 H new ATOM 0 HE ARG A 355 14.037 -1.586 1.443 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.596 -3.736 3.768 1.00 1.43 H new ATOM 0 HH12 ARG A 355 17.206 -3.072 3.473 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.078 -0.689 1.119 1.00 2.08 H new ATOM 0 HH22 ARG A 355 17.480 -1.345 1.972 1.00 2.08 H new ATOM 438 N TRP A 356 9.986 -0.354 4.805 1.00 0.10 N ATOM 439 CA TRP A 356 10.323 1.059 4.836 1.00 0.09 C ATOM 440 C TRP A 356 11.746 1.260 4.347 1.00 0.09 C ATOM 441 O TRP A 356 12.680 0.677 4.891 1.00 0.14 O ATOM 442 CB TRP A 356 10.242 1.629 6.251 1.00 0.10 C ATOM 443 CG TRP A 356 8.864 1.843 6.790 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.342 1.294 7.924 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.846 2.689 6.245 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.065 1.752 8.125 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.737 2.605 7.105 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.761 3.511 5.116 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.564 3.309 6.873 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.596 4.211 4.888 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.511 4.111 5.762 1.00 0.13 C ATOM 0 H TRP A 356 9.887 -0.785 5.724 1.00 0.10 H new ATOM 0 HA TRP A 356 9.606 1.572 4.195 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.774 0.957 6.924 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.771 2.582 6.269 1.00 0.10 H new ATOM 0 HD1 TRP A 356 8.859 0.600 8.570 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.459 1.499 8.906 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.595 3.596 4.434 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.722 3.228 7.544 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.521 4.848 4.019 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.613 4.676 5.559 1.00 0.13 H new ATOM 462 N GLU A 357 11.908 2.072 3.324 1.00 0.10 N ATOM 463 CA GLU A 357 13.225 2.516 2.909 1.00 0.12 C ATOM 464 C GLU A 357 13.595 3.741 3.722 1.00 0.14 C ATOM 465 O GLU A 357 14.743 3.927 4.123 1.00 0.21 O ATOM 466 CB GLU A 357 13.228 2.844 1.428 1.00 0.16 C ATOM 467 CG GLU A 357 13.055 1.625 0.547 1.00 0.25 C ATOM 468 CD GLU A 357 14.282 0.740 0.499 1.00 0.36 C ATOM 469 OE1 GLU A 357 15.396 1.257 0.712 1.00 0.78 O ATOM 470 OE2 GLU A 357 14.142 -0.476 0.269 1.00 0.61 O ATOM 0 H GLU A 357 11.141 2.440 2.761 1.00 0.10 H new ATOM 0 HA GLU A 357 13.955 1.724 3.079 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.427 3.553 1.218 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.166 3.338 1.174 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.209 1.041 0.909 1.00 0.25 H new ATOM 0 HG3 GLU A 357 12.810 1.949 -0.464 1.00 0.25 H new ATOM 477 N ASP A 358 12.585 4.567 3.954 1.00 0.14 N ATOM 478 CA ASP A 358 12.688 5.718 4.838 1.00 0.16 C ATOM 479 C ASP A 358 11.354 5.918 5.526 1.00 0.16 C ATOM 480 O ASP A 358 10.475 6.586 4.989 1.00 0.20 O ATOM 481 CB ASP A 358 13.009 6.997 4.073 1.00 0.20 C ATOM 482 CG ASP A 358 13.770 7.985 4.931 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.166 8.574 5.849 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.978 8.190 4.681 1.00 1.33 O ATOM 0 H ASP A 358 11.664 4.456 3.530 1.00 0.14 H new ATOM 0 HA ASP A 358 13.492 5.523 5.548 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.597 6.754 3.188 1.00 0.20 H new ATOM 0 HB3 ASP A 358 12.083 7.455 3.724 1.00 0.20 H new ATOM 489 N LYS A 359 11.198 5.339 6.703 1.00 0.15 N ATOM 490 CA LYS A 359 9.921 5.367 7.404 1.00 0.17 C ATOM 491 C LYS A 359 9.411 6.781 7.633 1.00 0.19 C ATOM 492 O LYS A 359 8.233 7.063 7.433 1.00 0.23 O ATOM 493 CB LYS A 359 10.034 4.663 8.745 1.00 0.23 C ATOM 494 CG LYS A 359 8.774 4.795 9.579 1.00 0.29 C ATOM 495 CD LYS A 359 8.778 3.873 10.774 1.00 0.38 C ATOM 496 CE LYS A 359 7.624 4.204 11.701 1.00 0.91 C ATOM 497 NZ LYS A 359 7.801 5.523 12.375 1.00 1.50 N ATOM 0 H LYS A 359 11.940 4.842 7.197 1.00 0.15 H new ATOM 0 HA LYS A 359 9.207 4.849 6.764 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.248 3.607 8.580 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.877 5.076 9.299 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.672 5.826 9.919 1.00 0.29 H new ATOM 0 HG3 LYS A 359 7.905 4.577 8.958 1.00 0.29 H new ATOM 0 HD2 LYS A 359 8.701 2.837 10.443 1.00 0.38 H new ATOM 0 HD3 LYS A 359 9.722 3.967 11.310 1.00 0.38 H new ATOM 0 HE2 LYS A 359 6.694 4.211 11.132 1.00 0.91 H new ATOM 0 HE3 LYS A 359 7.531 3.423 12.455 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 6.989 5.706 12.998 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.674 5.510 12.940 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 7.864 6.274 11.658 1.00 1.50 H new ATOM 511 N GLU A 360 10.286 7.661 8.066 1.00 0.21 N ATOM 512 CA GLU A 360 9.873 9.009 8.412 1.00 0.27 C ATOM 513 C GLU A 360 9.688 9.892 7.182 1.00 0.24 C ATOM 514 O GLU A 360 8.956 10.880 7.227 1.00 0.37 O ATOM 515 CB GLU A 360 10.827 9.624 9.414 1.00 0.41 C ATOM 516 CG GLU A 360 10.794 8.880 10.732 1.00 0.63 C ATOM 517 CD GLU A 360 9.383 8.737 11.275 1.00 1.75 C ATOM 518 OE1 GLU A 360 8.899 9.672 11.945 1.00 1.97 O ATOM 519 OE2 GLU A 360 8.746 7.688 11.026 1.00 2.67 O ATOM 0 H GLU A 360 11.281 7.473 8.187 1.00 0.21 H new ATOM 0 HA GLU A 360 8.893 8.939 8.885 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.840 9.610 9.011 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.563 10.669 9.577 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.233 7.891 10.600 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.410 9.407 11.460 1.00 0.63 H new ATOM 526 N SER A 361 10.336 9.526 6.083 1.00 0.19 N ATOM 527 CA SER A 361 10.073 10.159 4.799 1.00 0.21 C ATOM 528 C SER A 361 8.890 9.466 4.118 1.00 0.19 C ATOM 529 O SER A 361 8.496 9.818 3.008 1.00 0.24 O ATOM 530 CB SER A 361 11.324 10.081 3.920 1.00 0.26 C ATOM 531 OG SER A 361 12.412 10.775 4.508 1.00 0.31 O ATOM 0 H SER A 361 11.047 8.795 6.056 1.00 0.19 H new ATOM 0 HA SER A 361 9.821 11.208 4.952 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.597 9.037 3.765 1.00 0.26 H new ATOM 0 HB3 SER A 361 11.108 10.504 2.939 1.00 0.26 H new ATOM 0 HG SER A 361 12.758 10.259 5.266 1.00 0.31 H new ATOM 537 N LYS A 362 8.341 8.473 4.828 1.00 0.15 N ATOM 538 CA LYS A 362 7.228 7.646 4.355 1.00 0.14 C ATOM 539 C LYS A 362 7.565 6.986 3.029 1.00 0.12 C ATOM 540 O LYS A 362 6.727 6.848 2.141 1.00 0.15 O ATOM 541 CB LYS A 362 5.936 8.451 4.261 1.00 0.20 C ATOM 542 CG LYS A 362 5.533 9.062 5.587 1.00 0.48 C ATOM 543 CD LYS A 362 5.488 8.031 6.705 1.00 0.48 C ATOM 544 CE LYS A 362 5.368 8.704 8.066 1.00 0.51 C ATOM 545 NZ LYS A 362 5.745 7.793 9.182 1.00 1.23 N ATOM 0 H LYS A 362 8.664 8.219 5.762 1.00 0.15 H new ATOM 0 HA LYS A 362 7.067 6.857 5.089 1.00 0.14 H new ATOM 0 HB2 LYS A 362 6.059 9.243 3.522 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.134 7.804 3.905 1.00 0.20 H new ATOM 0 HG2 LYS A 362 6.238 9.851 5.851 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.554 9.530 5.487 1.00 0.48 H new ATOM 0 HD2 LYS A 362 4.643 7.360 6.552 1.00 0.48 H new ATOM 0 HD3 LYS A 362 6.390 7.419 6.676 1.00 0.48 H new ATOM 0 HE2 LYS A 362 6.006 9.587 8.090 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.343 9.047 8.210 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.878 8.347 10.052 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 4.990 7.093 9.329 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 6.631 7.302 8.945 1.00 1.23 H new ATOM 559 N ILE A 363 8.811 6.574 2.922 1.00 0.09 N ATOM 560 CA ILE A 363 9.306 5.902 1.749 1.00 0.09 C ATOM 561 C ILE A 363 9.419 4.421 2.026 1.00 0.08 C ATOM 562 O ILE A 363 10.040 4.013 3.005 1.00 0.10 O ATOM 563 CB ILE A 363 10.687 6.450 1.357 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.568 7.912 0.940 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.308 5.616 0.247 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.894 8.629 0.894 1.00 0.46 C ATOM 0 H ILE A 363 9.510 6.699 3.654 1.00 0.09 H new ATOM 0 HA ILE A 363 8.610 6.075 0.928 1.00 0.09 H new ATOM 0 HB ILE A 363 11.345 6.388 2.223 1.00 0.10 H new ATOM 0 HG12 ILE A 363 10.100 7.965 -0.043 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.907 8.429 1.636 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.285 6.025 -0.012 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.424 4.587 0.587 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.661 5.638 -0.630 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.738 9.664 0.590 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.354 8.606 1.882 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.550 8.136 0.177 1.00 0.46 H new ATOM 578 N PHE A 364 8.826 3.622 1.173 1.00 0.09 N ATOM 579 CA PHE A 364 8.870 2.191 1.334 1.00 0.09 C ATOM 580 C PHE A 364 9.137 1.563 -0.016 1.00 0.10 C ATOM 581 O PHE A 364 8.846 2.149 -1.056 1.00 0.13 O ATOM 582 CB PHE A 364 7.559 1.646 1.925 1.00 0.09 C ATOM 583 CG PHE A 364 6.418 1.602 0.955 1.00 0.08 C ATOM 584 CD1 PHE A 364 6.258 0.522 0.103 1.00 0.12 C ATOM 585 CD2 PHE A 364 5.509 2.631 0.904 1.00 0.13 C ATOM 586 CE1 PHE A 364 5.206 0.477 -0.789 1.00 0.12 C ATOM 587 CE2 PHE A 364 4.451 2.598 0.015 1.00 0.14 C ATOM 588 CZ PHE A 364 4.300 1.517 -0.834 1.00 0.08 C ATOM 0 H PHE A 364 8.305 3.941 0.356 1.00 0.09 H new ATOM 0 HA PHE A 364 9.667 1.939 2.033 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.736 0.640 2.306 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.273 2.264 2.777 1.00 0.09 H new ATOM 0 HD1 PHE A 364 6.964 -0.294 0.137 1.00 0.12 H new ATOM 0 HD2 PHE A 364 5.623 3.476 1.567 1.00 0.13 H new ATOM 0 HE1 PHE A 364 5.092 -0.370 -1.450 1.00 0.12 H new ATOM 0 HE2 PHE A 364 3.744 3.414 -0.016 1.00 0.14 H new ATOM 0 HZ PHE A 364 3.475 1.487 -1.531 1.00 0.08 H new ATOM 598 N ARG A 365 9.714 0.396 -0.001 1.00 0.10 N ATOM 599 CA ARG A 365 9.904 -0.361 -1.203 1.00 0.12 C ATOM 600 C ARG A 365 9.121 -1.656 -1.133 1.00 0.11 C ATOM 601 O ARG A 365 8.983 -2.240 -0.057 1.00 0.18 O ATOM 602 CB ARG A 365 11.377 -0.653 -1.363 1.00 0.17 C ATOM 603 CG ARG A 365 11.662 -1.875 -2.186 1.00 0.17 C ATOM 604 CD ARG A 365 12.896 -1.671 -3.009 1.00 0.31 C ATOM 605 NE ARG A 365 14.088 -1.572 -2.166 1.00 0.77 N ATOM 606 CZ ARG A 365 15.305 -1.998 -2.495 1.00 0.63 C ATOM 607 NH1 ARG A 365 15.531 -2.616 -3.646 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.304 -1.805 -1.649 1.00 0.99 N ATOM 0 H ARG A 365 10.065 -0.056 0.843 1.00 0.10 H new ATOM 0 HA ARG A 365 9.546 0.211 -2.059 1.00 0.12 H new ATOM 0 HB2 ARG A 365 11.861 0.207 -1.826 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.823 -0.778 -0.376 1.00 0.17 H new ATOM 0 HG2 ARG A 365 11.790 -2.739 -1.534 1.00 0.17 H new ATOM 0 HG3 ARG A 365 10.814 -2.090 -2.837 1.00 0.17 H new ATOM 0 HD2 ARG A 365 13.010 -2.499 -3.708 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.793 -0.764 -3.604 1.00 0.31 H new ATOM 0 HE ARG A 365 13.977 -1.140 -1.249 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.764 -2.773 -4.300 1.00 1.48 H new ATOM 0 HH12 ARG A 365 16.472 -2.934 -3.878 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.135 -1.336 -0.759 1.00 0.99 H new ATOM 0 HH22 ARG A 365 17.243 -2.126 -1.887 1.00 0.99 H new ATOM 622 N ILE A 366 8.617 -2.112 -2.265 1.00 0.07 N ATOM 623 CA ILE A 366 8.007 -3.407 -2.327 1.00 0.06 C ATOM 624 C ILE A 366 9.081 -4.414 -2.666 1.00 0.07 C ATOM 625 O ILE A 366 9.567 -4.502 -3.790 1.00 0.10 O ATOM 626 CB ILE A 366 6.839 -3.439 -3.325 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.652 -2.698 -2.703 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.470 -4.876 -3.684 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.573 -2.340 -3.683 1.00 0.09 C ATOM 0 H ILE A 366 8.623 -1.599 -3.146 1.00 0.07 H new ATOM 0 HA ILE A 366 7.569 -3.659 -1.361 1.00 0.06 H new ATOM 0 HB ILE A 366 7.129 -2.945 -4.252 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.222 -3.318 -1.916 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.015 -1.786 -2.229 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.641 -4.873 -4.392 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.330 -5.371 -4.135 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.175 -5.412 -2.782 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.769 -1.818 -3.164 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.985 -1.693 -4.458 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.180 -3.248 -4.140 1.00 0.09 H new ATOM 641 N VAL A 367 9.486 -5.120 -1.645 1.00 0.07 N ATOM 642 CA VAL A 367 10.628 -6.007 -1.712 1.00 0.08 C ATOM 643 C VAL A 367 10.310 -7.253 -2.526 1.00 0.09 C ATOM 644 O VAL A 367 11.088 -7.665 -3.387 1.00 0.12 O ATOM 645 CB VAL A 367 11.069 -6.362 -0.289 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.209 -7.354 -0.303 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.459 -5.089 0.443 1.00 0.10 C ATOM 0 H VAL A 367 9.032 -5.099 -0.732 1.00 0.07 H new ATOM 0 HA VAL A 367 11.448 -5.501 -2.221 1.00 0.08 H new ATOM 0 HB VAL A 367 10.239 -6.836 0.235 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.501 -7.587 0.721 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.891 -8.267 -0.807 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.059 -6.924 -0.834 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.774 -5.334 1.457 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.280 -4.603 -0.084 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.603 -4.415 0.482 1.00 0.10 H new ATOM 657 N ASP A 368 9.152 -7.822 -2.271 1.00 0.08 N ATOM 658 CA ASP A 368 8.658 -8.940 -3.053 1.00 0.09 C ATOM 659 C ASP A 368 7.172 -8.759 -3.290 1.00 0.08 C ATOM 660 O ASP A 368 6.335 -9.150 -2.479 1.00 0.09 O ATOM 661 CB ASP A 368 8.941 -10.266 -2.361 1.00 0.12 C ATOM 662 CG ASP A 368 8.668 -11.472 -3.245 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.520 -11.649 -3.699 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.616 -12.248 -3.496 1.00 0.78 O ATOM 0 H ASP A 368 8.528 -7.527 -1.521 1.00 0.08 H new ATOM 0 HA ASP A 368 9.178 -8.962 -4.011 1.00 0.09 H new ATOM 0 HB2 ASP A 368 9.983 -10.286 -2.041 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.330 -10.337 -1.461 1.00 0.12 H new ATOM 669 N PRO A 369 6.851 -8.125 -4.411 1.00 0.09 N ATOM 670 CA PRO A 369 5.486 -7.772 -4.796 1.00 0.10 C ATOM 671 C PRO A 369 4.567 -8.975 -4.896 1.00 0.12 C ATOM 672 O PRO A 369 3.379 -8.881 -4.601 1.00 0.14 O ATOM 673 CB PRO A 369 5.661 -7.113 -6.169 1.00 0.12 C ATOM 674 CG PRO A 369 7.009 -7.524 -6.632 1.00 0.12 C ATOM 675 CD PRO A 369 7.827 -7.690 -5.401 1.00 0.10 C ATOM 0 HA PRO A 369 5.015 -7.128 -4.053 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.889 -7.442 -6.864 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.584 -6.028 -6.097 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.961 -8.454 -7.198 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.442 -6.772 -7.291 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.617 -8.428 -5.539 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.309 -6.757 -5.109 1.00 0.10 H new ATOM 683 N ASN A 370 5.123 -10.102 -5.292 1.00 0.13 N ATOM 684 CA ASN A 370 4.344 -11.319 -5.433 1.00 0.17 C ATOM 685 C ASN A 370 3.954 -11.820 -4.055 1.00 0.17 C ATOM 686 O ASN A 370 2.811 -12.204 -3.809 1.00 0.21 O ATOM 687 CB ASN A 370 5.163 -12.372 -6.163 1.00 0.21 C ATOM 688 CG ASN A 370 4.301 -13.302 -6.998 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.051 -13.044 -8.178 1.00 0.62 O ATOM 690 ND2 ASN A 370 3.842 -14.392 -6.398 1.00 0.59 N ATOM 0 H ASN A 370 6.112 -10.202 -5.522 1.00 0.13 H new ATOM 0 HA ASN A 370 3.443 -11.116 -6.012 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.891 -11.879 -6.808 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.726 -12.958 -5.437 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.260 -15.052 -6.914 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.071 -14.571 -5.420 1.00 0.59 H new ATOM 697 N GLY A 371 4.923 -11.774 -3.154 1.00 0.16 N ATOM 698 CA GLY A 371 4.687 -12.133 -1.774 1.00 0.19 C ATOM 699 C GLY A 371 3.769 -11.146 -1.089 1.00 0.13 C ATOM 700 O GLY A 371 2.968 -11.514 -0.231 1.00 0.13 O ATOM 0 H GLY A 371 5.881 -11.490 -3.359 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.249 -13.130 -1.727 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.637 -12.176 -1.242 1.00 0.19 H new ATOM 704 N LEU A 372 3.876 -9.890 -1.496 1.00 0.10 N ATOM 705 CA LEU A 372 3.135 -8.813 -0.861 1.00 0.08 C ATOM 706 C LEU A 372 1.688 -8.880 -1.313 1.00 0.11 C ATOM 707 O LEU A 372 0.758 -8.622 -0.552 1.00 0.13 O ATOM 708 CB LEU A 372 3.752 -7.459 -1.236 1.00 0.08 C ATOM 709 CG LEU A 372 3.591 -6.337 -0.204 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.185 -5.774 -0.193 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.930 -6.850 1.179 1.00 0.09 C ATOM 0 H LEU A 372 4.473 -9.592 -2.268 1.00 0.10 H new ATOM 0 HA LEU A 372 3.181 -8.921 0.223 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.816 -7.606 -1.420 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.309 -7.128 -2.175 1.00 0.08 H new ATOM 0 HG LEU A 372 4.276 -5.538 -0.487 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.116 -4.982 0.553 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.948 -5.368 -1.176 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.478 -6.566 0.053 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.812 -6.045 1.905 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.261 -7.671 1.436 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.961 -7.204 1.193 1.00 0.09 H new ATOM 723 N ALA A 373 1.516 -9.241 -2.571 1.00 0.12 N ATOM 724 CA ALA A 373 0.202 -9.378 -3.163 1.00 0.15 C ATOM 725 C ALA A 373 -0.533 -10.568 -2.578 1.00 0.14 C ATOM 726 O ALA A 373 -1.755 -10.544 -2.429 1.00 0.16 O ATOM 727 CB ALA A 373 0.333 -9.526 -4.654 1.00 0.20 C ATOM 0 H ALA A 373 2.284 -9.447 -3.210 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.377 -8.482 -2.940 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.657 -9.629 -5.098 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.825 -8.645 -5.065 1.00 0.20 H new ATOM 0 HB3 ALA A 373 0.926 -10.412 -4.881 1.00 0.20 H new ATOM 733 N ARG A 374 0.217 -11.613 -2.249 1.00 0.14 N ATOM 734 CA ARG A 374 -0.362 -12.770 -1.589 1.00 0.17 C ATOM 735 C ARG A 374 -0.859 -12.365 -0.204 1.00 0.14 C ATOM 736 O ARG A 374 -1.837 -12.913 0.294 1.00 0.16 O ATOM 737 CB ARG A 374 0.643 -13.926 -1.508 1.00 0.24 C ATOM 738 CG ARG A 374 1.249 -14.128 -0.138 1.00 0.28 C ATOM 739 CD ARG A 374 2.021 -15.431 -0.058 1.00 0.47 C ATOM 740 NE ARG A 374 1.138 -16.589 -0.195 1.00 1.44 N ATOM 741 CZ ARG A 374 1.560 -17.834 -0.400 1.00 2.04 C ATOM 742 NH1 ARG A 374 2.856 -18.084 -0.564 1.00 2.01 N ATOM 743 NH2 ARG A 374 0.675 -18.826 -0.455 1.00 3.03 N ATOM 0 H ARG A 374 1.219 -11.681 -2.428 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.208 -13.128 -2.176 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.145 -14.847 -1.812 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.445 -13.746 -2.224 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.913 -13.295 0.093 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.460 -14.125 0.614 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.778 -15.455 -0.842 1.00 0.47 H new ATOM 0 HD3 ARG A 374 2.547 -15.485 0.895 1.00 0.47 H new ATOM 0 HE ARG A 374 0.132 -16.432 -0.129 1.00 1.44 H new ATOM 0 HH11 ARG A 374 3.531 -17.320 -0.533 1.00 2.01 H new ATOM 0 HH12 ARG A 374 3.175 -19.040 -0.721 1.00 2.01 H new ATOM 0 HH21 ARG A 374 -0.319 -18.629 -0.340 1.00 3.03 H new ATOM 0 HH22 ARG A 374 0.991 -19.783 -0.612 1.00 3.03 H new ATOM 757 N LEU A 375 -0.185 -11.385 0.398 1.00 0.13 N ATOM 758 CA LEU A 375 -0.639 -10.784 1.649 1.00 0.15 C ATOM 759 C LEU A 375 -1.939 -10.040 1.410 1.00 0.16 C ATOM 760 O LEU A 375 -2.909 -10.207 2.144 1.00 0.18 O ATOM 761 CB LEU A 375 0.406 -9.793 2.162 1.00 0.17 C ATOM 762 CG LEU A 375 1.439 -10.308 3.153 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.884 -11.715 2.822 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.627 -9.372 3.138 1.00 0.15 C ATOM 0 H LEU A 375 0.683 -10.990 0.035 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.788 -11.573 2.386 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.939 -9.391 1.300 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.121 -8.961 2.628 1.00 0.17 H new ATOM 0 HG LEU A 375 0.988 -10.338 4.145 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.622 -12.045 3.554 1.00 0.29 H new ATOM 0 HD12 LEU A 375 1.024 -12.384 2.847 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.328 -11.732 1.827 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.378 -9.726 3.844 1.00 0.15 H new ATOM 0 HD22 LEU A 375 3.055 -9.343 2.136 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.305 -8.371 3.424 1.00 0.15 H new ATOM 776 N TRP A 376 -1.937 -9.217 0.368 1.00 0.16 N ATOM 777 CA TRP A 376 -3.104 -8.435 -0.010 1.00 0.18 C ATOM 778 C TRP A 376 -4.306 -9.350 -0.196 1.00 0.20 C ATOM 779 O TRP A 376 -5.386 -9.097 0.341 1.00 0.25 O ATOM 780 CB TRP A 376 -2.815 -7.656 -1.299 1.00 0.19 C ATOM 781 CG TRP A 376 -3.845 -6.625 -1.644 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.309 -6.324 -2.889 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.535 -5.756 -0.739 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.244 -5.323 -2.816 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.402 -4.962 -1.510 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.508 -5.572 0.647 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.235 -4.007 -0.945 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.331 -4.615 1.203 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.186 -3.848 0.405 1.00 0.24 C ATOM 0 H TRP A 376 -1.128 -9.074 -0.236 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.331 -7.723 0.783 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.846 -7.166 -1.203 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.735 -8.362 -2.125 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.987 -6.804 -3.801 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.740 -4.915 -3.609 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.856 -6.167 1.269 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.898 -3.412 -1.555 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.315 -4.455 2.271 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.823 -3.111 0.872 1.00 0.24 H new ATOM 800 N GLY A 377 -4.103 -10.426 -0.944 1.00 0.21 N ATOM 801 CA GLY A 377 -5.146 -11.410 -1.117 1.00 0.27 C ATOM 802 C GLY A 377 -5.513 -12.073 0.192 1.00 0.30 C ATOM 803 O GLY A 377 -6.686 -12.183 0.521 1.00 0.38 O ATOM 0 H GLY A 377 -3.232 -10.633 -1.434 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.029 -10.933 -1.543 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.817 -12.167 -1.829 1.00 0.27 H new ATOM 807 N ASN A 378 -4.502 -12.489 0.943 1.00 0.27 N ATOM 808 CA ASN A 378 -4.695 -13.121 2.251 1.00 0.30 C ATOM 809 C ASN A 378 -5.533 -12.249 3.188 1.00 0.30 C ATOM 810 O ASN A 378 -6.451 -12.730 3.853 1.00 0.35 O ATOM 811 CB ASN A 378 -3.343 -13.422 2.879 1.00 0.32 C ATOM 812 CG ASN A 378 -2.885 -14.840 2.602 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.688 -15.768 2.507 1.00 0.76 O ATOM 814 ND2 ASN A 378 -1.589 -15.006 2.452 1.00 0.42 N ATOM 0 H ASN A 378 -3.524 -12.400 0.667 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.242 -14.051 2.097 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.602 -12.721 2.495 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.402 -13.265 3.956 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.214 -15.932 2.248 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -0.959 -14.208 2.539 1.00 0.42 H new ATOM 821 N HIS A 379 -5.215 -10.962 3.214 1.00 0.28 N ATOM 822 CA HIS A 379 -5.925 -9.983 4.032 1.00 0.30 C ATOM 823 C HIS A 379 -7.391 -9.871 3.612 1.00 0.32 C ATOM 824 O HIS A 379 -8.294 -9.889 4.451 1.00 0.38 O ATOM 825 CB HIS A 379 -5.213 -8.632 3.906 1.00 0.28 C ATOM 826 CG HIS A 379 -5.916 -7.470 4.542 1.00 0.32 C ATOM 827 ND1 HIS A 379 -5.692 -7.113 5.849 1.00 0.43 N ATOM 828 CD2 HIS A 379 -6.785 -6.595 3.988 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.424 -6.032 6.053 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.104 -5.681 4.953 1.00 0.38 N ATOM 0 H HIS A 379 -4.453 -10.563 2.666 1.00 0.28 H new ATOM 0 HA HIS A 379 -5.916 -10.306 5.073 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.221 -8.721 4.349 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.071 -8.413 2.848 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.157 -6.614 2.974 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -6.469 -5.497 6.990 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -7.736 -4.887 4.855 1.00 0.38 H new ATOM 838 N LYS A 380 -7.623 -9.772 2.311 1.00 0.32 N ATOM 839 CA LYS A 380 -8.979 -9.635 1.786 1.00 0.36 C ATOM 840 C LYS A 380 -9.653 -11.001 1.657 1.00 0.41 C ATOM 841 O LYS A 380 -10.806 -11.102 1.238 1.00 0.45 O ATOM 842 CB LYS A 380 -8.947 -8.925 0.433 1.00 0.36 C ATOM 843 CG LYS A 380 -8.445 -7.493 0.516 1.00 0.38 C ATOM 844 CD LYS A 380 -7.591 -7.136 -0.686 1.00 0.63 C ATOM 845 CE LYS A 380 -8.387 -7.110 -1.974 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.786 -5.728 -2.369 1.00 0.77 N ATOM 0 H LYS A 380 -6.893 -9.784 1.599 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.562 -9.036 2.485 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.309 -9.487 -0.249 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.950 -8.927 0.006 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.293 -6.811 0.577 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.864 -7.362 1.429 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -7.133 -6.160 -0.526 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -6.779 -7.858 -0.778 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.795 -7.556 -2.773 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.280 -7.724 -1.858 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.146 -5.736 -3.345 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.530 -5.385 -1.729 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -7.961 -5.098 -2.309 1.00 0.77 H new ATOM 860 N ASN A 381 -8.911 -12.039 2.036 1.00 0.44 N ATOM 861 CA ASN A 381 -9.373 -13.424 1.985 1.00 0.52 C ATOM 862 C ASN A 381 -9.661 -13.861 0.543 1.00 0.53 C ATOM 863 O ASN A 381 -10.593 -14.623 0.278 1.00 0.60 O ATOM 864 CB ASN A 381 -10.612 -13.610 2.863 1.00 0.58 C ATOM 865 CG ASN A 381 -10.858 -15.063 3.219 1.00 1.20 C ATOM 866 OD1 ASN A 381 -11.998 -15.505 3.334 1.00 1.87 O ATOM 867 ND2 ASN A 381 -9.786 -15.814 3.417 1.00 2.01 N ATOM 0 H ASN A 381 -7.960 -11.941 2.392 1.00 0.44 H new ATOM 0 HA ASN A 381 -8.576 -14.058 2.373 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -10.495 -13.030 3.778 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.484 -13.214 2.343 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -9.891 -16.795 3.674 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -8.855 -15.411 3.312 1.00 2.01 H new ATOM 874 N ARG A 382 -8.840 -13.382 -0.382 1.00 0.50 N ATOM 875 CA ARG A 382 -8.951 -13.757 -1.785 1.00 0.55 C ATOM 876 C ARG A 382 -7.753 -14.608 -2.173 1.00 0.68 C ATOM 877 O ARG A 382 -6.714 -14.574 -1.515 1.00 0.78 O ATOM 878 CB ARG A 382 -8.995 -12.520 -2.692 1.00 0.49 C ATOM 879 CG ARG A 382 -9.924 -11.420 -2.211 1.00 0.48 C ATOM 880 CD ARG A 382 -11.380 -11.823 -2.338 1.00 0.57 C ATOM 881 NE ARG A 382 -12.279 -10.727 -1.984 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.296 -10.321 -2.743 1.00 1.11 C ATOM 883 NH1 ARG A 382 -13.565 -10.941 -3.886 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.044 -9.297 -2.355 1.00 1.27 N ATOM 0 H ARG A 382 -8.084 -12.727 -0.183 1.00 0.50 H new ATOM 0 HA ARG A 382 -9.878 -14.316 -1.915 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -7.987 -12.114 -2.781 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.304 -12.828 -3.691 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.701 -11.184 -1.171 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.745 -10.513 -2.789 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.581 -12.142 -3.361 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.578 -12.679 -1.692 1.00 0.57 H new ATOM 0 HE ARG A 382 -12.118 -10.243 -1.101 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -12.992 -11.730 -4.185 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -14.344 -10.628 -4.465 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -13.841 -8.821 -1.476 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -14.823 -8.985 -2.935 1.00 1.27 H new ATOM 898 N THR A 383 -7.907 -15.378 -3.230 1.00 0.76 N ATOM 899 CA THR A 383 -6.835 -16.210 -3.746 1.00 0.95 C ATOM 900 C THR A 383 -6.263 -15.612 -5.024 1.00 0.94 C ATOM 901 O THR A 383 -5.059 -15.654 -5.269 1.00 1.22 O ATOM 902 CB THR A 383 -7.352 -17.634 -4.032 1.00 1.17 C ATOM 903 OG1 THR A 383 -7.698 -18.279 -2.800 1.00 1.24 O ATOM 904 CG2 THR A 383 -6.322 -18.463 -4.785 1.00 1.37 C ATOM 0 H THR A 383 -8.778 -15.446 -3.757 1.00 0.76 H new ATOM 0 HA THR A 383 -6.049 -16.258 -2.992 1.00 0.95 H new ATOM 0 HB THR A 383 -8.237 -17.552 -4.664 1.00 1.17 H new ATOM 0 HG1 THR A 383 -8.028 -19.183 -2.985 1.00 1.24 H new ATOM 0 HG21 THR A 383 -6.722 -19.460 -4.969 1.00 1.37 H new ATOM 0 HG22 THR A 383 -6.093 -17.983 -5.736 1.00 1.37 H new ATOM 0 HG23 THR A 383 -5.412 -18.541 -4.190 1.00 1.37 H new ATOM 912 N ASN A 384 -7.142 -15.020 -5.807 1.00 0.84 N ATOM 913 CA ASN A 384 -6.794 -14.529 -7.130 1.00 0.81 C ATOM 914 C ASN A 384 -6.305 -13.088 -7.092 1.00 0.64 C ATOM 915 O ASN A 384 -6.550 -12.308 -8.018 1.00 0.77 O ATOM 916 CB ASN A 384 -8.012 -14.628 -8.035 1.00 0.89 C ATOM 917 CG ASN A 384 -8.337 -16.057 -8.435 1.00 1.40 C ATOM 918 OD1 ASN A 384 -8.088 -17.005 -7.688 1.00 2.21 O ATOM 919 ND2 ASN A 384 -8.908 -16.221 -9.614 1.00 1.70 N ATOM 0 H ASN A 384 -8.116 -14.865 -5.547 1.00 0.84 H new ATOM 0 HA ASN A 384 -5.980 -15.144 -7.515 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -8.873 -14.194 -7.526 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -7.840 -14.035 -8.933 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -9.158 -17.157 -9.934 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -9.099 -15.412 -10.205 1.00 1.70 H new ATOM 926 N MET A 385 -5.613 -12.731 -6.031 1.00 0.55 N ATOM 927 CA MET A 385 -5.107 -11.381 -5.884 1.00 0.42 C ATOM 928 C MET A 385 -3.641 -11.331 -6.273 1.00 0.53 C ATOM 929 O MET A 385 -2.819 -12.043 -5.701 1.00 0.94 O ATOM 930 CB MET A 385 -5.288 -10.901 -4.449 1.00 0.47 C ATOM 931 CG MET A 385 -4.847 -9.466 -4.224 1.00 0.92 C ATOM 932 SD MET A 385 -5.877 -8.289 -5.118 1.00 2.54 S ATOM 933 CE MET A 385 -7.522 -8.866 -4.700 1.00 3.18 C ATOM 0 H MET A 385 -5.387 -13.356 -5.257 1.00 0.55 H new ATOM 0 HA MET A 385 -5.670 -10.721 -6.544 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.338 -10.996 -4.173 1.00 0.47 H new ATOM 0 HB3 MET A 385 -4.723 -11.554 -3.783 1.00 0.47 H new ATOM 0 HG2 MET A 385 -4.881 -9.240 -3.158 1.00 0.92 H new ATOM 0 HG3 MET A 385 -3.810 -9.353 -4.541 1.00 0.92 H new ATOM 0 HE1 MET A 385 -8.217 -8.026 -4.714 1.00 3.18 H new ATOM 0 HE2 MET A 385 -7.841 -9.613 -5.427 1.00 3.18 H new ATOM 0 HE3 MET A 385 -7.510 -9.310 -3.705 1.00 3.18 H new ATOM 943 N THR A 386 -3.313 -10.492 -7.245 1.00 0.23 N ATOM 944 CA THR A 386 -1.953 -10.417 -7.732 1.00 0.24 C ATOM 945 C THR A 386 -1.373 -9.043 -7.470 1.00 0.16 C ATOM 946 O THR A 386 -2.081 -8.149 -6.995 1.00 0.18 O ATOM 947 CB THR A 386 -1.858 -10.733 -9.238 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.491 -9.704 -10.006 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.516 -12.063 -9.544 1.00 0.44 C ATOM 0 H THR A 386 -3.968 -9.860 -7.706 1.00 0.23 H new ATOM 0 HA THR A 386 -1.379 -11.170 -7.191 1.00 0.24 H new ATOM 0 HB THR A 386 -0.803 -10.785 -9.506 1.00 0.33 H new ATOM 0 HG1 THR A 386 -2.421 -9.918 -10.960 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.439 -12.270 -10.611 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.016 -12.854 -8.984 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.567 -12.024 -9.256 1.00 0.44 H new ATOM 957 N TYR A 387 -0.098 -8.861 -7.777 1.00 0.16 N ATOM 958 CA TYR A 387 0.523 -7.559 -7.616 1.00 0.13 C ATOM 959 C TYR A 387 -0.095 -6.576 -8.598 1.00 0.14 C ATOM 960 O TYR A 387 -0.139 -5.378 -8.343 1.00 0.17 O ATOM 961 CB TYR A 387 2.035 -7.615 -7.814 1.00 0.15 C ATOM 962 CG TYR A 387 2.661 -6.271 -7.560 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.566 -5.690 -6.305 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.293 -5.559 -8.572 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.089 -4.449 -6.061 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.817 -4.307 -8.334 1.00 0.14 C ATOM 967 CZ TYR A 387 3.711 -3.754 -7.079 1.00 0.12 C ATOM 968 OH TYR A 387 4.231 -2.505 -6.841 1.00 0.13 O ATOM 0 H TYR A 387 0.519 -9.590 -8.135 1.00 0.16 H new ATOM 0 HA TYR A 387 0.342 -7.228 -6.593 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.467 -8.355 -7.140 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.261 -7.939 -8.830 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.072 -6.225 -5.508 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.375 -5.992 -9.558 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.015 -4.015 -5.075 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.308 -3.763 -9.128 1.00 0.14 H new ATOM 0 HH TYR A 387 4.634 -2.156 -7.663 1.00 0.13 H new ATOM 978 N GLU A 388 -0.594 -7.096 -9.709 1.00 0.17 N ATOM 979 CA GLU A 388 -1.272 -6.269 -10.689 1.00 0.24 C ATOM 980 C GLU A 388 -2.528 -5.654 -10.073 1.00 0.25 C ATOM 981 O GLU A 388 -2.825 -4.476 -10.283 1.00 0.31 O ATOM 982 CB GLU A 388 -1.628 -7.085 -11.924 1.00 0.30 C ATOM 983 CG GLU A 388 -2.205 -6.238 -13.037 1.00 0.44 C ATOM 984 CD GLU A 388 -1.210 -5.241 -13.597 1.00 1.53 C ATOM 985 OE1 GLU A 388 -1.146 -4.103 -13.087 1.00 2.21 O ATOM 986 OE2 GLU A 388 -0.495 -5.584 -14.558 1.00 1.96 O ATOM 0 H GLU A 388 -0.541 -8.085 -9.952 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.601 -5.466 -10.994 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.736 -7.596 -12.287 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.347 -7.857 -11.650 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.550 -6.889 -13.840 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -3.078 -5.702 -12.664 1.00 0.44 H new ATOM 993 N LYS A 389 -3.261 -6.452 -9.301 1.00 0.23 N ATOM 994 CA LYS A 389 -4.417 -5.948 -8.571 1.00 0.28 C ATOM 995 C LYS A 389 -3.992 -4.905 -7.533 1.00 0.28 C ATOM 996 O LYS A 389 -4.682 -3.914 -7.312 1.00 0.40 O ATOM 997 CB LYS A 389 -5.172 -7.085 -7.887 1.00 0.32 C ATOM 998 CG LYS A 389 -6.070 -7.899 -8.812 1.00 0.45 C ATOM 999 CD LYS A 389 -5.279 -8.789 -9.758 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.193 -9.580 -10.687 1.00 0.46 C ATOM 1001 NZ LYS A 389 -7.142 -10.453 -9.942 1.00 1.39 N ATOM 0 H LYS A 389 -3.075 -7.446 -9.166 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.083 -5.475 -9.293 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.449 -7.755 -7.422 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.782 -6.668 -7.085 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.739 -8.516 -8.213 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.696 -7.222 -9.394 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.600 -8.176 -10.351 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.664 -9.478 -9.180 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.756 -8.888 -11.314 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -5.586 -10.193 -11.354 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.533 -11.169 -10.586 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -6.641 -10.925 -9.163 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -7.916 -9.875 -9.556 1.00 1.39 H new ATOM 1015 N MET A 390 -2.848 -5.137 -6.902 1.00 0.19 N ATOM 1016 CA MET A 390 -2.295 -4.200 -5.924 1.00 0.17 C ATOM 1017 C MET A 390 -1.852 -2.907 -6.597 1.00 0.16 C ATOM 1018 O MET A 390 -2.113 -1.811 -6.099 1.00 0.17 O ATOM 1019 CB MET A 390 -1.107 -4.838 -5.213 1.00 0.15 C ATOM 1020 CG MET A 390 -0.404 -3.904 -4.245 1.00 0.14 C ATOM 1021 SD MET A 390 0.901 -4.735 -3.334 1.00 0.18 S ATOM 1022 CE MET A 390 -0.039 -6.069 -2.608 1.00 1.57 C ATOM 0 H MET A 390 -2.279 -5.971 -7.049 1.00 0.19 H new ATOM 0 HA MET A 390 -3.074 -3.963 -5.199 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.450 -5.719 -4.670 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.390 -5.182 -5.959 1.00 0.15 H new ATOM 0 HG2 MET A 390 0.017 -3.062 -4.795 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.131 -3.495 -3.544 1.00 0.14 H new ATOM 0 HE1 MET A 390 0.609 -6.660 -1.961 1.00 1.57 H new ATOM 0 HE2 MET A 390 -0.861 -5.658 -2.022 1.00 1.57 H new ATOM 0 HE3 MET A 390 -0.439 -6.704 -3.398 1.00 1.57 H new ATOM 1032 N SER A 391 -1.176 -3.050 -7.725 1.00 0.15 N ATOM 1033 CA SER A 391 -0.695 -1.918 -8.497 1.00 0.17 C ATOM 1034 C SER A 391 -1.852 -0.996 -8.884 1.00 0.19 C ATOM 1035 O SER A 391 -1.694 0.220 -8.918 1.00 0.21 O ATOM 1036 CB SER A 391 0.033 -2.420 -9.750 1.00 0.23 C ATOM 1037 OG SER A 391 0.646 -1.361 -10.462 1.00 1.02 O ATOM 0 H SER A 391 -0.945 -3.957 -8.131 1.00 0.15 H new ATOM 0 HA SER A 391 0.002 -1.345 -7.885 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.789 -3.150 -9.463 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.675 -2.933 -10.401 1.00 0.23 H new ATOM 0 HG SER A 391 1.101 -1.719 -11.253 1.00 1.02 H new ATOM 1043 N ARG A 392 -3.026 -1.576 -9.139 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.195 -0.798 -9.518 1.00 0.26 C ATOM 1045 C ARG A 392 -4.604 0.117 -8.366 1.00 0.22 C ATOM 1046 O ARG A 392 -5.045 1.249 -8.578 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.325 -1.732 -9.951 1.00 0.38 C ATOM 1048 CG ARG A 392 -6.386 -1.966 -8.909 1.00 1.12 C ATOM 1049 CD ARG A 392 -7.437 -0.869 -8.919 1.00 2.05 C ATOM 1050 NE ARG A 392 -8.280 -0.923 -10.110 1.00 2.61 N ATOM 1051 CZ ARG A 392 -8.755 0.149 -10.737 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -8.459 1.367 -10.301 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -9.528 0.009 -11.802 1.00 4.06 N ATOM 0 H ARG A 392 -3.187 -2.582 -9.089 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.958 -0.161 -10.370 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.797 -1.319 -10.843 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -4.895 -2.693 -10.233 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -6.864 -2.929 -9.087 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.923 -2.017 -7.924 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -8.061 -0.958 -8.030 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -6.946 0.103 -8.867 1.00 2.05 H new ATOM 0 HE ARG A 392 -8.520 -1.841 -10.485 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -7.864 1.485 -9.481 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -8.826 2.186 -10.786 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -9.761 -0.923 -12.144 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -9.891 0.833 -12.281 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.439 -0.380 -7.145 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.704 0.412 -5.954 1.00 0.17 C ATOM 1069 C ALA A 393 -3.653 1.511 -5.819 1.00 0.12 C ATOM 1070 O ALA A 393 -3.984 2.677 -5.632 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.735 -0.474 -4.713 1.00 0.20 C ATOM 0 H ALA A 393 -4.122 -1.331 -6.956 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.684 0.879 -6.050 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.935 0.138 -3.834 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.520 -1.222 -4.820 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.772 -0.972 -4.597 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.385 1.129 -5.954 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.274 2.081 -5.906 1.00 0.10 C ATOM 1079 C LEU A 394 -1.447 3.191 -6.941 1.00 0.11 C ATOM 1080 O LEU A 394 -1.315 4.370 -6.623 1.00 0.12 O ATOM 1081 CB LEU A 394 0.048 1.350 -6.148 1.00 0.11 C ATOM 1082 CG LEU A 394 0.425 0.334 -5.077 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.572 -0.539 -5.555 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.808 1.048 -3.798 1.00 0.13 C ATOM 0 H LEU A 394 -2.099 0.161 -6.098 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.265 2.538 -4.917 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.007 0.839 -7.109 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.846 2.089 -6.224 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.437 -0.304 -4.881 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.829 -1.259 -4.778 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.273 -1.071 -6.458 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.439 0.085 -5.772 1.00 0.13 H new ATOM 0 HD21 LEU A 394 1.076 0.314 -3.038 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.659 1.702 -3.987 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.035 1.643 -3.447 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.757 2.808 -8.175 1.00 0.12 N ATOM 1097 CA ARG A 395 -1.967 3.772 -9.252 1.00 0.14 C ATOM 1098 C ARG A 395 -3.116 4.719 -8.923 1.00 0.14 C ATOM 1099 O ARG A 395 -3.135 5.868 -9.362 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.251 3.049 -10.570 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.078 2.230 -11.089 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.007 3.112 -11.706 1.00 0.52 C ATOM 1103 NE ARG A 395 -0.477 3.753 -12.932 1.00 1.30 N ATOM 1104 CZ ARG A 395 0.150 4.757 -13.545 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.287 5.241 -13.055 1.00 1.66 N ATOM 1106 NH2 ARG A 395 -0.364 5.271 -14.653 1.00 2.64 N ATOM 0 H ARG A 395 -1.869 1.834 -8.456 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.055 4.359 -9.357 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.109 2.391 -10.434 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.530 3.785 -11.324 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.647 1.652 -10.271 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.433 1.515 -11.831 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.294 3.875 -10.988 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.877 2.513 -11.924 1.00 0.52 H new ATOM 0 HE ARG A 395 -1.343 3.409 -13.347 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.686 4.844 -12.204 1.00 1.66 H new ATOM 0 HH12 ARG A 395 1.761 6.009 -13.530 1.00 1.66 H new ATOM 0 HH21 ARG A 395 -1.235 4.898 -15.032 1.00 2.64 H new ATOM 0 HH22 ARG A 395 0.111 6.039 -15.127 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.078 4.232 -8.156 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.203 5.052 -7.742 1.00 0.13 C ATOM 1122 C HIS A 396 -4.781 5.993 -6.623 1.00 0.11 C ATOM 1123 O HIS A 396 -5.192 7.155 -6.580 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.371 4.174 -7.309 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.698 4.757 -7.669 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -7.868 5.474 -8.828 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.874 4.700 -7.007 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.139 5.835 -8.844 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.791 5.386 -7.763 1.00 0.26 N ATOM 0 H HIS A 396 -4.102 3.273 -7.808 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.532 5.654 -8.589 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.273 3.192 -7.772 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.326 4.023 -6.230 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.058 4.208 -6.063 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.595 6.419 -9.630 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.777 5.527 -7.544 1.00 0.26 H new ATOM 1137 N TYR A 397 -3.918 5.487 -5.749 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.424 6.233 -4.597 1.00 0.10 C ATOM 1139 C TYR A 397 -2.761 7.538 -4.998 1.00 0.09 C ATOM 1140 O TYR A 397 -2.890 8.543 -4.302 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.427 5.388 -3.805 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.070 4.230 -3.107 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.443 4.179 -2.963 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.310 3.201 -2.578 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.047 3.137 -2.318 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -2.908 2.155 -1.918 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.278 2.127 -1.794 1.00 0.24 C ATOM 1148 OH TYR A 397 -4.870 1.114 -1.101 1.00 0.30 O ATOM 0 H TYR A 397 -3.539 4.543 -5.820 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.290 6.469 -3.979 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.656 5.016 -4.480 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -1.928 6.018 -3.069 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.049 4.976 -3.367 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.236 3.221 -2.685 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.122 3.108 -2.221 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.307 1.361 -1.500 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.800 1.352 -0.905 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.050 7.515 -6.114 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.285 8.674 -6.547 1.00 0.12 C ATOM 1160 C TYR A 398 -2.195 9.883 -6.741 1.00 0.14 C ATOM 1161 O TYR A 398 -1.912 10.974 -6.243 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.547 8.380 -7.854 1.00 0.14 C ATOM 1163 CG TYR A 398 0.296 7.114 -7.850 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.865 6.607 -6.678 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.525 6.428 -9.034 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.629 5.456 -6.698 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.285 5.283 -9.059 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.835 4.799 -7.895 1.00 0.14 C ATOM 1169 OH TYR A 398 2.593 3.656 -7.929 1.00 0.18 O ATOM 0 H TYR A 398 -1.986 6.709 -6.735 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.556 8.898 -5.768 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.279 8.307 -8.658 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.099 9.227 -8.087 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.705 7.123 -5.743 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.098 6.801 -9.953 1.00 0.15 H new ATOM 0 HE1 TYR A 398 2.061 5.073 -5.785 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.450 4.764 -9.992 1.00 0.16 H new ATOM 0 HH TYR A 398 3.218 3.655 -7.174 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.298 9.672 -7.453 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.250 10.743 -7.722 1.00 0.19 C ATOM 1181 C LYS A 399 -4.929 11.207 -6.447 1.00 0.19 C ATOM 1182 O LYS A 399 -5.149 12.399 -6.242 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.318 10.293 -8.708 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.816 10.112 -10.131 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.541 8.653 -10.442 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.813 7.831 -10.330 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.601 6.406 -10.692 1.00 0.71 N ATOM 0 H LYS A 399 -3.554 8.770 -7.854 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.684 11.569 -8.152 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.742 9.351 -8.362 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.126 11.025 -8.710 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.555 10.501 -10.831 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.905 10.693 -10.273 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.130 8.562 -11.448 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.790 8.265 -9.754 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.192 7.891 -9.310 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.577 8.258 -10.980 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.376 5.831 -10.305 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.582 6.310 -11.727 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.696 6.078 -10.297 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.246 10.261 -5.582 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.982 10.560 -4.366 1.00 0.18 C ATOM 1203 C LEU A 400 -5.048 11.093 -3.286 1.00 0.18 C ATOM 1204 O LEU A 400 -5.395 11.119 -2.107 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.734 9.306 -3.915 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.501 8.623 -5.047 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.085 7.305 -4.592 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.594 9.539 -5.580 1.00 0.21 C ATOM 0 H LEU A 400 -5.005 9.277 -5.699 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.712 11.346 -4.559 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.024 8.598 -3.488 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.432 9.575 -3.122 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.798 8.417 -5.854 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.625 6.842 -5.418 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.282 6.644 -4.267 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.770 7.478 -3.762 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.130 9.036 -6.385 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.290 9.781 -4.777 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.146 10.457 -5.960 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.865 11.535 -3.720 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.894 12.197 -2.848 1.00 0.20 C ATOM 1222 C ASN A 401 -2.430 11.278 -1.727 1.00 0.17 C ATOM 1223 O ASN A 401 -2.213 11.718 -0.599 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.486 13.473 -2.247 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.558 14.640 -3.209 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -3.358 15.789 -2.817 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.886 14.366 -4.452 1.00 1.21 N ATOM 0 H ASN A 401 -3.554 11.443 -4.687 1.00 0.18 H new ATOM 0 HA ASN A 401 -2.032 12.454 -3.464 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.490 13.257 -1.881 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.888 13.765 -1.384 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -3.983 15.120 -5.132 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.043 13.399 -4.737 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.291 10.003 -2.040 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.946 9.006 -1.049 1.00 0.10 C ATOM 1236 C ILE A 402 -0.484 8.597 -1.145 1.00 0.09 C ATOM 1237 O ILE A 402 0.322 8.923 -0.276 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.859 7.789 -1.244 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.305 8.230 -1.066 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.518 6.670 -0.278 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.302 7.243 -1.593 1.00 0.13 C ATOM 0 H ILE A 402 -2.414 9.633 -2.983 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.091 9.430 -0.055 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.711 7.395 -2.249 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.497 8.397 -0.006 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.450 9.185 -1.571 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.187 5.826 -0.448 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.487 6.354 -0.437 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.635 7.025 0.746 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.311 7.624 -1.432 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.137 7.093 -2.660 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.185 6.293 -1.071 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.143 7.890 -2.207 1.00 0.07 N ATOM 1254 CA ILE A 403 1.223 7.468 -2.429 1.00 0.07 C ATOM 1255 C ILE A 403 1.720 8.083 -3.726 1.00 0.08 C ATOM 1256 O ILE A 403 0.929 8.606 -4.506 1.00 0.10 O ATOM 1257 CB ILE A 403 1.339 5.925 -2.502 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.662 5.261 -1.306 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.795 5.485 -2.571 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.812 3.758 -1.315 1.00 0.11 C ATOM 0 H ILE A 403 -0.799 7.596 -2.931 1.00 0.07 H new ATOM 0 HA ILE A 403 1.832 7.804 -1.590 1.00 0.07 H new ATOM 0 HB ILE A 403 0.831 5.609 -3.413 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.087 5.659 -0.385 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.398 5.517 -1.305 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.844 4.397 -2.621 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.262 5.911 -3.459 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.322 5.831 -1.682 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.312 3.337 -0.443 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.362 3.353 -2.221 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.870 3.498 -1.287 1.00 0.11 H new ATOM 1272 N ARG A 404 3.018 8.060 -3.932 1.00 0.10 N ATOM 1273 CA ARG A 404 3.600 8.502 -5.181 1.00 0.13 C ATOM 1274 C ARG A 404 4.690 7.547 -5.608 1.00 0.14 C ATOM 1275 O ARG A 404 5.122 6.683 -4.840 1.00 0.16 O ATOM 1276 CB ARG A 404 4.182 9.901 -5.053 1.00 0.17 C ATOM 1277 CG ARG A 404 5.602 9.916 -4.537 1.00 0.25 C ATOM 1278 CD ARG A 404 6.211 11.298 -4.636 1.00 0.36 C ATOM 1279 NE ARG A 404 6.456 11.690 -6.028 1.00 1.14 N ATOM 1280 CZ ARG A 404 5.668 12.508 -6.724 1.00 1.56 C ATOM 1281 NH1 ARG A 404 4.585 13.035 -6.162 1.00 1.63 N ATOM 1282 NH2 ARG A 404 5.963 12.798 -7.984 1.00 2.39 N ATOM 0 H ARG A 404 3.697 7.736 -3.243 1.00 0.10 H new ATOM 0 HA ARG A 404 2.809 8.522 -5.930 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.152 10.389 -6.027 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.554 10.488 -4.383 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.617 9.584 -3.499 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.205 9.209 -5.107 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.545 12.022 -4.167 1.00 0.36 H new ATOM 0 HD3 ARG A 404 7.149 11.322 -4.082 1.00 0.36 H new ATOM 0 HE ARG A 404 7.282 11.312 -6.492 1.00 1.14 H new ATOM 0 HH11 ARG A 404 4.354 12.814 -5.193 1.00 1.63 H new ATOM 0 HH12 ARG A 404 3.985 13.661 -6.699 1.00 1.63 H new ATOM 0 HH21 ARG A 404 6.793 12.395 -8.419 1.00 2.39 H new ATOM 0 HH22 ARG A 404 5.360 13.424 -8.518 1.00 2.39 H new ATOM 1296 N LYS A 405 5.143 7.734 -6.821 1.00 0.17 N ATOM 1297 CA LYS A 405 6.165 6.899 -7.397 1.00 0.19 C ATOM 1298 C LYS A 405 7.443 7.711 -7.554 1.00 0.22 C ATOM 1299 O LYS A 405 7.407 8.847 -8.027 1.00 0.27 O ATOM 1300 CB LYS A 405 5.681 6.379 -8.739 1.00 0.22 C ATOM 1301 CG LYS A 405 6.526 5.246 -9.263 1.00 0.34 C ATOM 1302 CD LYS A 405 6.740 4.204 -8.214 1.00 0.29 C ATOM 1303 CE LYS A 405 7.461 3.024 -8.797 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.687 3.420 -9.543 1.00 1.08 N ATOM 0 H LYS A 405 4.811 8.474 -7.440 1.00 0.17 H new ATOM 0 HA LYS A 405 6.374 6.048 -6.749 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.649 6.043 -8.643 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.684 7.194 -9.463 1.00 0.22 H new ATOM 0 HG2 LYS A 405 6.042 4.798 -10.131 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.489 5.631 -9.599 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.317 4.621 -7.389 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.781 3.888 -7.804 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.732 2.336 -7.997 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.790 2.486 -9.466 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 9.230 2.570 -9.795 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 8.417 3.928 -10.409 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 9.272 4.039 -8.946 1.00 1.08 H new ATOM 1318 N GLU A 406 8.562 7.136 -7.144 1.00 0.23 N ATOM 1319 CA GLU A 406 9.834 7.838 -7.130 1.00 0.28 C ATOM 1320 C GLU A 406 10.485 7.882 -8.509 1.00 0.34 C ATOM 1321 O GLU A 406 10.101 7.160 -9.433 1.00 0.43 O ATOM 1322 CB GLU A 406 10.786 7.174 -6.131 1.00 0.29 C ATOM 1323 CG GLU A 406 10.617 5.684 -6.038 1.00 0.63 C ATOM 1324 CD GLU A 406 10.888 4.969 -7.343 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.720 5.452 -8.130 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.262 3.929 -7.587 1.00 2.42 O ATOM 0 H GLU A 406 8.614 6.173 -6.813 1.00 0.23 H new ATOM 0 HA GLU A 406 9.634 8.866 -6.828 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.814 7.397 -6.418 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.628 7.611 -5.145 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.289 5.296 -5.273 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.601 5.460 -5.713 1.00 0.63 H new ATOM 1333 N PRO A 407 11.422 8.809 -8.665 1.00 0.41 N ATOM 1334 CA PRO A 407 12.313 8.872 -9.807 1.00 0.51 C ATOM 1335 C PRO A 407 13.423 7.814 -9.763 1.00 0.52 C ATOM 1336 O PRO A 407 14.307 7.881 -8.907 1.00 0.54 O ATOM 1337 CB PRO A 407 12.905 10.279 -9.740 1.00 0.61 C ATOM 1338 CG PRO A 407 12.634 10.800 -8.369 1.00 0.58 C ATOM 1339 CD PRO A 407 11.708 9.840 -7.676 1.00 0.45 C ATOM 0 HA PRO A 407 11.778 8.670 -10.735 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.976 10.257 -9.940 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.454 10.924 -10.494 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.564 10.901 -7.810 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.184 11.791 -8.421 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.174 9.415 -6.787 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.795 10.338 -7.350 1.00 0.45 H new ATOM 1347 N GLY A 408 13.387 6.848 -10.670 1.00 0.54 N ATOM 1348 CA GLY A 408 14.571 6.038 -10.916 1.00 0.58 C ATOM 1349 C GLY A 408 14.592 4.663 -10.261 1.00 0.58 C ATOM 1350 O GLY A 408 15.414 3.823 -10.637 1.00 0.86 O ATOM 0 H GLY A 408 12.572 6.610 -11.235 1.00 0.54 H new ATOM 0 HA2 GLY A 408 14.679 5.906 -11.993 1.00 0.58 H new ATOM 0 HA3 GLY A 408 15.444 6.594 -10.574 1.00 0.58 H new ATOM 1354 N GLN A 409 13.737 4.413 -9.285 1.00 0.47 N ATOM 1355 CA GLN A 409 13.716 3.108 -8.636 1.00 0.51 C ATOM 1356 C GLN A 409 12.607 2.247 -9.245 1.00 0.48 C ATOM 1357 O GLN A 409 11.912 2.681 -10.165 1.00 0.61 O ATOM 1358 CB GLN A 409 13.540 3.233 -7.116 1.00 0.63 C ATOM 1359 CG GLN A 409 14.257 4.435 -6.505 1.00 0.45 C ATOM 1360 CD GLN A 409 14.581 4.260 -5.028 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.598 5.231 -4.268 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.874 3.032 -4.615 1.00 0.45 N ATOM 0 H GLN A 409 13.057 5.083 -8.926 1.00 0.47 H new ATOM 0 HA GLN A 409 14.678 2.625 -8.807 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.476 3.303 -6.888 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.908 2.323 -6.642 1.00 0.63 H new ATOM 0 HG2 GLN A 409 15.182 4.614 -7.053 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.635 5.322 -6.630 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.849 2.253 -5.273 1.00 0.45 H new ATOM 0 HE22 GLN A 409 15.124 2.868 -3.640 1.00 0.45 H new ATOM 1371 N ARG A 410 12.452 1.031 -8.748 1.00 0.41 N ATOM 1372 CA ARG A 410 11.488 0.086 -9.306 1.00 0.39 C ATOM 1373 C ARG A 410 10.237 -0.011 -8.453 1.00 0.31 C ATOM 1374 O ARG A 410 9.201 0.549 -8.791 1.00 0.42 O ATOM 1375 CB ARG A 410 12.139 -1.292 -9.462 1.00 0.47 C ATOM 1376 CG ARG A 410 13.206 -1.582 -8.420 1.00 0.86 C ATOM 1377 CD ARG A 410 14.563 -1.063 -8.865 1.00 1.11 C ATOM 1378 NE ARG A 410 15.557 -1.132 -7.797 1.00 1.27 N ATOM 1379 CZ ARG A 410 16.751 -1.710 -7.923 1.00 2.04 C ATOM 1380 NH1 ARG A 410 17.081 -2.328 -9.051 1.00 2.65 N ATOM 1381 NH2 ARG A 410 17.617 -1.666 -6.918 1.00 2.43 N ATOM 0 H ARG A 410 12.983 0.670 -7.955 1.00 0.41 H new ATOM 0 HA ARG A 410 11.185 0.454 -10.286 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.366 -2.059 -9.402 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.583 -1.364 -10.455 1.00 0.47 H new ATOM 0 HG2 ARG A 410 12.929 -1.119 -7.473 1.00 0.86 H new ATOM 0 HG3 ARG A 410 13.264 -2.656 -8.244 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.910 -1.644 -9.720 1.00 1.11 H new ATOM 0 HD3 ARG A 410 14.463 -0.031 -9.200 1.00 1.11 H new ATOM 0 HE ARG A 410 15.322 -0.711 -6.898 1.00 1.27 H new ATOM 0 HH11 ARG A 410 16.419 -2.362 -9.826 1.00 2.65 H new ATOM 0 HH12 ARG A 410 17.996 -2.769 -9.142 1.00 2.65 H new ATOM 0 HH21 ARG A 410 17.368 -1.190 -6.051 1.00 2.43 H new ATOM 0 HH22 ARG A 410 18.531 -2.108 -7.013 1.00 2.43 H new ATOM 1395 N LEU A 411 10.345 -0.712 -7.348 1.00 0.21 N ATOM 1396 CA LEU A 411 9.213 -0.943 -6.475 1.00 0.14 C ATOM 1397 C LEU A 411 9.254 -0.011 -5.286 1.00 0.11 C ATOM 1398 O LEU A 411 8.824 -0.354 -4.192 1.00 0.12 O ATOM 1399 CB LEU A 411 9.193 -2.400 -6.045 1.00 0.11 C ATOM 1400 CG LEU A 411 8.850 -3.357 -7.179 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.065 -4.793 -6.762 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.418 -3.132 -7.616 1.00 0.16 C ATOM 0 H LEU A 411 11.215 -1.137 -7.028 1.00 0.21 H new ATOM 0 HA LEU A 411 8.291 -0.731 -7.016 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.169 -2.665 -5.638 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.467 -2.525 -5.241 1.00 0.11 H new ATOM 0 HG LEU A 411 9.514 -3.158 -8.020 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.812 -5.454 -7.591 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.109 -4.939 -6.486 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.429 -5.023 -5.907 1.00 0.15 H new ATOM 0 HD21 LEU A 411 7.173 -3.817 -8.428 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.748 -3.312 -6.775 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.300 -2.105 -7.961 1.00 0.16 H new ATOM 1414 N LEU A 412 9.801 1.162 -5.508 1.00 0.13 N ATOM 1415 CA LEU A 412 9.909 2.159 -4.468 1.00 0.11 C ATOM 1416 C LEU A 412 8.691 3.067 -4.530 1.00 0.10 C ATOM 1417 O LEU A 412 8.272 3.481 -5.607 1.00 0.11 O ATOM 1418 CB LEU A 412 11.184 2.966 -4.678 1.00 0.13 C ATOM 1419 CG LEU A 412 11.785 3.647 -3.450 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.767 4.465 -2.694 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.410 2.621 -2.542 1.00 0.16 C ATOM 0 H LEU A 412 10.182 1.451 -6.409 1.00 0.13 H new ATOM 0 HA LEU A 412 9.951 1.683 -3.488 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.939 2.303 -5.101 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.980 3.733 -5.425 1.00 0.13 H new ATOM 0 HG LEU A 412 12.553 4.335 -3.803 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.242 4.929 -1.830 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.365 5.240 -3.347 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.957 3.818 -2.358 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.835 3.118 -1.670 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.650 1.909 -2.220 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.198 2.092 -3.078 1.00 0.16 H new ATOM 1433 N PHE A 413 8.114 3.371 -3.382 1.00 0.10 N ATOM 1434 CA PHE A 413 6.956 4.233 -3.334 1.00 0.11 C ATOM 1435 C PHE A 413 7.058 5.157 -2.136 1.00 0.12 C ATOM 1436 O PHE A 413 7.524 4.761 -1.067 1.00 0.19 O ATOM 1437 CB PHE A 413 5.668 3.414 -3.264 1.00 0.12 C ATOM 1438 CG PHE A 413 5.497 2.460 -4.411 1.00 0.10 C ATOM 1439 CD1 PHE A 413 6.025 1.184 -4.341 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.821 2.839 -5.559 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.884 0.298 -5.391 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.675 1.958 -6.610 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.207 0.685 -6.528 1.00 0.11 C ATOM 0 H PHE A 413 8.431 3.032 -2.473 1.00 0.10 H new ATOM 0 HA PHE A 413 6.926 4.828 -4.247 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.656 2.852 -2.330 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.816 4.094 -3.238 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.555 0.876 -3.452 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.405 3.833 -5.632 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.303 -0.695 -5.322 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.144 2.264 -7.499 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.093 -0.004 -7.352 1.00 0.11 H new ATOM 1453 N ARG A 414 6.637 6.390 -2.320 1.00 0.10 N ATOM 1454 CA ARG A 414 6.678 7.364 -1.258 1.00 0.12 C ATOM 1455 C ARG A 414 5.278 7.816 -0.929 1.00 0.11 C ATOM 1456 O ARG A 414 4.524 8.214 -1.809 1.00 0.15 O ATOM 1457 CB ARG A 414 7.549 8.555 -1.654 1.00 0.20 C ATOM 1458 CG ARG A 414 7.168 9.856 -0.969 1.00 0.35 C ATOM 1459 CD ARG A 414 8.311 10.429 -0.155 1.00 0.37 C ATOM 1460 NE ARG A 414 9.515 10.639 -0.960 1.00 1.21 N ATOM 1461 CZ ARG A 414 10.031 11.838 -1.226 1.00 1.46 C ATOM 1462 NH1 ARG A 414 9.384 12.936 -0.852 1.00 1.06 N ATOM 1463 NH2 ARG A 414 11.182 11.932 -1.886 1.00 2.58 N ATOM 0 H ARG A 414 6.261 6.740 -3.201 1.00 0.10 H new ATOM 0 HA ARG A 414 7.118 6.905 -0.373 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.589 8.325 -1.421 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.488 8.694 -2.733 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.858 10.583 -1.720 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.311 9.685 -0.318 1.00 0.35 H new ATOM 0 HD2 ARG A 414 8.001 11.377 0.285 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.541 9.754 0.670 1.00 0.37 H new ATOM 0 HE ARG A 414 9.987 9.819 -1.340 1.00 1.21 H new ATOM 0 HH11 ARG A 414 8.493 12.861 -0.362 1.00 1.06 H new ATOM 0 HH12 ARG A 414 9.778 13.854 -1.055 1.00 1.06 H new ATOM 0 HH21 ARG A 414 11.668 11.087 -2.187 1.00 2.58 H new ATOM 0 HH22 ARG A 414 11.579 12.849 -2.091 1.00 2.58 H new ATOM 1477 N PHE A 415 4.930 7.731 0.331 1.00 0.10 N ATOM 1478 CA PHE A 415 3.637 8.202 0.779 1.00 0.09 C ATOM 1479 C PHE A 415 3.592 9.719 0.697 1.00 0.11 C ATOM 1480 O PHE A 415 4.295 10.418 1.430 1.00 0.14 O ATOM 1481 CB PHE A 415 3.339 7.741 2.211 1.00 0.10 C ATOM 1482 CG PHE A 415 2.651 6.416 2.316 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.266 6.342 2.295 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.381 5.253 2.457 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.622 5.128 2.408 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.752 4.037 2.571 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.368 3.970 2.544 1.00 0.12 C ATOM 0 H PHE A 415 5.521 7.341 1.066 1.00 0.10 H new ATOM 0 HA PHE A 415 2.873 7.777 0.128 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.277 7.692 2.764 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.721 8.495 2.699 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.685 7.246 2.189 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.460 5.300 2.478 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.457 5.081 2.391 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.335 3.135 2.681 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.872 3.015 2.629 1.00 0.12 H new ATOM 1497 N MET A 416 2.793 10.211 -0.237 1.00 0.11 N ATOM 1498 CA MET A 416 2.557 11.641 -0.398 1.00 0.15 C ATOM 1499 C MET A 416 2.035 12.244 0.893 1.00 0.17 C ATOM 1500 O MET A 416 2.274 13.412 1.198 1.00 0.23 O ATOM 1501 CB MET A 416 1.521 11.876 -1.497 1.00 0.15 C ATOM 1502 CG MET A 416 2.025 11.615 -2.897 1.00 0.24 C ATOM 1503 SD MET A 416 3.378 12.713 -3.359 1.00 1.41 S ATOM 1504 CE MET A 416 2.610 14.316 -3.135 1.00 1.47 C ATOM 0 H MET A 416 2.288 9.631 -0.907 1.00 0.11 H new ATOM 0 HA MET A 416 3.503 12.113 -0.664 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.659 11.236 -1.309 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.172 12.907 -1.436 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.359 10.580 -2.972 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.204 11.737 -3.604 1.00 0.24 H new ATOM 0 HE1 MET A 416 3.153 15.064 -3.713 1.00 1.47 H new ATOM 0 HE2 MET A 416 1.575 14.275 -3.476 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.634 14.586 -2.079 1.00 1.47 H new ATOM 1514 N LYS A 417 1.310 11.432 1.633 1.00 0.16 N ATOM 1515 CA LYS A 417 0.632 11.869 2.815 1.00 0.21 C ATOM 1516 C LYS A 417 0.526 10.723 3.803 1.00 0.21 C ATOM 1517 O LYS A 417 0.729 9.565 3.441 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.741 12.347 2.383 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.662 12.729 3.459 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.527 13.820 2.916 1.00 0.54 C ATOM 1521 CE LYS A 417 -3.370 13.349 1.750 1.00 0.84 C ATOM 1522 NZ LYS A 417 -3.940 14.492 0.997 1.00 1.36 N ATOM 0 H LYS A 417 1.179 10.443 1.421 1.00 0.16 H new ATOM 0 HA LYS A 417 1.173 12.674 3.311 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -0.613 13.204 1.721 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.209 11.558 1.795 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -2.265 11.877 3.773 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -1.112 13.071 4.336 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.178 14.194 3.706 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -1.901 14.654 2.597 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -2.762 12.739 1.082 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -4.177 12.714 2.116 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -4.441 14.139 0.157 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -4.606 15.011 1.605 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -3.173 15.129 0.700 1.00 1.36 H new ATOM 1536 N THR A 418 0.213 11.040 5.043 1.00 0.24 N ATOM 1537 CA THR A 418 0.070 10.006 6.046 1.00 0.24 C ATOM 1538 C THR A 418 -1.404 9.715 6.307 1.00 0.26 C ATOM 1539 O THR A 418 -2.262 10.552 6.029 1.00 0.28 O ATOM 1540 CB THR A 418 0.794 10.355 7.357 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.288 11.573 7.916 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.289 10.466 7.113 1.00 0.22 C ATOM 0 H THR A 418 0.055 11.991 5.377 1.00 0.24 H new ATOM 0 HA THR A 418 0.545 9.108 5.650 1.00 0.24 H new ATOM 0 HB THR A 418 0.610 9.554 8.073 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.613 12.334 7.390 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.793 10.713 8.047 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.668 9.516 6.737 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.481 11.249 6.379 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.707 8.521 6.847 1.00 0.25 N ATOM 1551 CA PRO A 419 -3.080 8.017 6.996 1.00 0.28 C ATOM 1552 C PRO A 419 -4.060 9.023 7.594 1.00 0.31 C ATOM 1553 O PRO A 419 -5.140 9.226 7.050 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.898 6.807 7.910 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.537 6.316 7.567 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.722 7.555 7.370 1.00 0.25 C ATOM 0 HA PRO A 419 -3.527 7.789 6.029 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.972 7.083 8.962 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.657 6.047 7.726 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.128 5.696 8.364 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.553 5.705 6.664 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.277 7.898 8.304 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.096 7.393 6.668 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.672 9.676 8.680 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.565 10.618 9.366 1.00 0.42 C ATOM 1566 C ASP A 420 -4.992 11.737 8.420 1.00 0.43 C ATOM 1567 O ASP A 420 -6.151 12.160 8.408 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.878 11.221 10.594 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.789 12.158 11.371 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -4.828 13.362 11.045 1.00 0.72 O ATOM 1571 OD2 ASP A 420 -5.476 11.692 12.307 1.00 0.74 O ATOM 0 H ASP A 420 -2.752 9.577 9.108 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.448 10.067 9.690 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.544 10.417 11.250 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.988 11.765 10.278 1.00 0.49 H new ATOM 1576 N GLU A 421 -4.042 12.192 7.621 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.271 13.246 6.660 1.00 0.45 C ATOM 1578 C GLU A 421 -5.091 12.735 5.470 1.00 0.42 C ATOM 1579 O GLU A 421 -5.994 13.411 4.985 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.928 13.754 6.162 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.962 14.211 7.237 1.00 0.81 C ATOM 1582 CD GLU A 421 -0.614 14.569 6.646 1.00 1.60 C ATOM 1583 OE1 GLU A 421 0.207 13.658 6.426 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -0.359 15.774 6.423 1.00 2.17 O ATOM 0 H GLU A 421 -3.086 11.836 7.624 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.829 14.048 7.143 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.452 12.962 5.583 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -3.104 14.585 5.480 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.375 15.075 7.757 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.839 13.422 7.978 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.740 11.546 4.984 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.398 10.953 3.818 1.00 0.33 C ATOM 1593 C ILE A 422 -6.854 10.560 4.086 1.00 0.36 C ATOM 1594 O ILE A 422 -7.751 10.858 3.290 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.670 9.678 3.351 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -3.171 9.915 3.182 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.278 9.206 2.052 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.406 8.697 2.699 1.00 0.27 C ATOM 0 H ILE A 422 -3.998 10.970 5.382 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.365 11.730 3.054 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.792 8.911 4.116 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -3.020 10.731 2.475 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.755 10.239 4.136 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.766 8.304 1.717 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.335 8.988 2.203 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -5.172 9.985 1.297 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.349 8.945 2.604 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.525 7.885 3.416 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.794 8.385 1.729 1.00 0.27 H new ATOM 1610 N MET A 423 -7.067 9.877 5.202 1.00 0.42 N ATOM 1611 CA MET A 423 -8.337 9.219 5.519 1.00 0.51 C ATOM 1612 C MET A 423 -9.518 10.167 5.556 1.00 0.58 C ATOM 1613 O MET A 423 -10.670 9.758 5.423 1.00 0.71 O ATOM 1614 CB MET A 423 -8.212 8.527 6.862 1.00 0.58 C ATOM 1615 CG MET A 423 -7.354 7.294 6.794 1.00 0.58 C ATOM 1616 SD MET A 423 -7.290 6.388 8.352 1.00 0.90 S ATOM 1617 CE MET A 423 -9.032 6.245 8.736 1.00 2.01 C ATOM 0 H MET A 423 -6.357 9.760 5.925 1.00 0.42 H new ATOM 0 HA MET A 423 -8.533 8.506 4.718 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.788 9.222 7.587 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.205 8.256 7.222 1.00 0.58 H new ATOM 0 HG2 MET A 423 -7.736 6.636 6.014 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.342 7.578 6.504 1.00 0.58 H new ATOM 0 HE1 MET A 423 -9.198 5.358 9.348 1.00 2.01 H new ATOM 0 HE2 MET A 423 -9.358 7.130 9.283 1.00 2.01 H new ATOM 0 HE3 MET A 423 -9.603 6.160 7.811 1.00 2.01 H new ATOM 1627 N SER A 424 -9.216 11.423 5.716 1.00 0.59 N ATOM 1628 CA SER A 424 -10.236 12.453 5.884 1.00 0.72 C ATOM 1629 C SER A 424 -10.871 12.867 4.549 1.00 0.67 C ATOM 1630 O SER A 424 -11.145 14.047 4.316 1.00 1.09 O ATOM 1631 CB SER A 424 -9.641 13.665 6.601 1.00 0.92 C ATOM 1632 OG SER A 424 -8.398 14.030 6.034 1.00 1.57 O ATOM 0 H SER A 424 -8.259 11.776 5.736 1.00 0.59 H new ATOM 0 HA SER A 424 -11.034 12.031 6.494 1.00 0.72 H new ATOM 0 HB2 SER A 424 -10.333 14.505 6.539 1.00 0.92 H new ATOM 0 HB3 SER A 424 -9.509 13.438 7.659 1.00 0.92 H new ATOM 0 HG SER A 424 -8.038 14.808 6.509 1.00 1.57 H new ATOM 1638 N GLY A 425 -11.094 11.896 3.669 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.772 12.176 2.418 1.00 0.42 C ATOM 1640 C GLY A 425 -11.104 11.535 1.222 1.00 0.37 C ATOM 1641 O GLY A 425 -11.767 10.879 0.417 1.00 0.50 O ATOM 0 H GLY A 425 -10.818 10.923 3.800 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.801 11.824 2.483 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.813 13.255 2.268 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.790 11.696 1.126 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.038 11.266 -0.049 1.00 0.36 C ATOM 1647 C ARG A 426 -9.233 9.779 -0.344 1.00 0.33 C ATOM 1648 O ARG A 426 -9.507 9.395 -1.477 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.553 11.574 0.145 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.250 13.046 0.269 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.277 13.712 -1.087 1.00 0.92 C ATOM 1652 NE ARG A 426 -6.904 15.124 -1.022 1.00 1.37 N ATOM 1653 CZ ARG A 426 -7.338 16.049 -1.873 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -8.206 15.730 -2.824 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -6.911 17.296 -1.760 1.00 2.67 N ATOM 0 H ARG A 426 -9.218 12.125 1.854 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.419 11.820 -0.907 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.199 11.063 1.040 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -6.994 11.167 -0.697 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.980 13.519 0.927 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.271 13.184 0.728 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.596 13.190 -1.759 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -8.276 13.622 -1.513 1.00 0.92 H new ATOM 0 HE ARG A 426 -6.272 15.418 -0.278 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -8.544 14.771 -2.905 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -8.536 16.444 -3.474 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -6.252 17.544 -1.022 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -7.241 18.009 -2.410 1.00 2.67 H new ATOM 1669 N THR A 427 -9.103 8.950 0.678 1.00 0.33 N ATOM 1670 CA THR A 427 -9.257 7.511 0.507 1.00 0.37 C ATOM 1671 C THR A 427 -10.527 7.002 1.188 1.00 0.43 C ATOM 1672 O THR A 427 -10.740 5.799 1.304 1.00 0.58 O ATOM 1673 CB THR A 427 -8.018 6.748 1.035 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.204 5.337 0.965 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.702 7.126 2.462 1.00 0.41 C ATOM 0 H THR A 427 -8.892 9.245 1.632 1.00 0.33 H new ATOM 0 HA THR A 427 -9.346 7.320 -0.562 1.00 0.37 H new ATOM 0 HB THR A 427 -7.184 7.033 0.394 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.127 5.116 1.210 1.00 1.24 H new ATOM 0 HG21 THR A 427 -6.827 6.571 2.800 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.498 8.195 2.519 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.553 6.885 3.099 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.386 7.922 1.604 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.642 7.547 2.253 1.00 0.62 C ATOM 1685 C ASP A 428 -13.558 6.830 1.269 1.00 0.61 C ATOM 1686 O ASP A 428 -14.207 5.842 1.603 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.347 8.782 2.811 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.691 8.447 3.426 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -14.721 8.000 4.591 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -15.726 8.635 2.750 1.00 1.75 O ATOM 0 H ASP A 428 -11.241 8.927 1.506 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.410 6.871 3.076 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -12.713 9.251 3.563 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.487 9.510 2.012 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.587 7.333 0.045 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.394 6.740 -1.016 1.00 0.65 C ATOM 1697 C ARG A 429 -13.692 5.505 -1.552 1.00 0.55 C ATOM 1698 O ARG A 429 -14.315 4.551 -2.018 1.00 0.66 O ATOM 1699 CB ARG A 429 -14.593 7.750 -2.142 1.00 0.81 C ATOM 1700 CG ARG A 429 -14.703 9.169 -1.633 1.00 0.98 C ATOM 1701 CD ARG A 429 -14.990 10.160 -2.751 1.00 1.12 C ATOM 1702 NE ARG A 429 -16.307 9.948 -3.349 1.00 1.64 N ATOM 1703 CZ ARG A 429 -17.437 10.450 -2.854 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -17.410 11.209 -1.765 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -18.590 10.202 -3.459 1.00 3.05 N ATOM 0 H ARG A 429 -13.058 8.156 -0.242 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.368 6.459 -0.616 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -13.758 7.681 -2.839 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -15.495 7.496 -2.699 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -15.496 9.225 -0.887 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.775 9.447 -1.133 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -14.929 11.175 -2.359 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -14.224 10.069 -3.521 1.00 1.12 H new ATOM 0 HE ARG A 429 -16.364 9.382 -4.196 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -16.522 11.409 -1.305 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -18.277 11.592 -1.389 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -18.611 9.628 -4.302 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -19.457 10.585 -3.082 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.383 5.547 -1.432 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.494 4.538 -1.931 1.00 0.36 C ATOM 1721 C LEU A 430 -11.640 3.222 -1.166 1.00 0.39 C ATOM 1722 O LEU A 430 -11.531 2.136 -1.739 1.00 0.45 O ATOM 1723 CB LEU A 430 -10.120 5.131 -1.783 1.00 0.31 C ATOM 1724 CG LEU A 430 -8.960 4.299 -2.236 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -9.076 3.929 -3.700 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -7.721 5.099 -1.983 1.00 0.56 C ATOM 0 H LEU A 430 -11.898 6.314 -0.967 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.711 4.278 -2.967 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.097 6.071 -2.335 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.970 5.375 -0.731 1.00 0.31 H new ATOM 0 HG LEU A 430 -8.934 3.359 -1.686 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -8.216 3.326 -3.992 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -9.991 3.358 -3.860 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -9.104 4.836 -4.303 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -6.848 4.528 -2.300 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -7.769 6.031 -2.546 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -7.642 5.321 -0.919 1.00 0.56 H new ATOM 1738 N GLU A 431 -11.923 3.341 0.123 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.141 2.181 0.999 1.00 0.53 C ATOM 1740 C GLU A 431 -13.212 1.229 0.457 1.00 0.59 C ATOM 1741 O GLU A 431 -13.236 0.046 0.793 1.00 0.72 O ATOM 1742 CB GLU A 431 -12.563 2.632 2.401 1.00 0.61 C ATOM 1743 CG GLU A 431 -11.497 3.388 3.168 1.00 0.73 C ATOM 1744 CD GLU A 431 -11.942 3.740 4.573 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -11.785 2.894 5.482 1.00 1.31 O ATOM 1746 OE2 GLU A 431 -12.465 4.855 4.779 1.00 1.25 O ATOM 0 H GLU A 431 -12.010 4.239 0.598 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.190 1.649 1.039 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -13.447 3.264 2.314 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -12.854 1.755 2.978 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -10.590 2.785 3.217 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -11.244 4.301 2.630 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.097 1.743 -0.384 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.260 0.979 -0.823 1.00 0.66 C ATOM 1755 C HIS A 432 -14.931 0.075 -2.004 1.00 0.60 C ATOM 1756 O HIS A 432 -15.347 -1.082 -2.041 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.411 1.921 -1.174 1.00 0.76 C ATOM 1758 CG HIS A 432 -16.855 2.758 -0.018 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -17.954 2.462 0.756 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -16.326 3.881 0.503 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -18.077 3.371 1.702 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -17.101 4.242 1.573 1.00 3.38 N ATOM 0 H HIS A 432 -14.034 2.683 -0.776 1.00 0.58 H new ATOM 0 HA HIS A 432 -15.565 0.337 0.004 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -16.103 2.574 -1.991 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -17.255 1.335 -1.536 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -15.451 4.402 0.143 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -18.850 3.396 2.456 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -16.946 5.053 2.171 1.00 3.38 H new ATOM 1771 N LEU A 433 -14.174 0.590 -2.965 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.827 -0.187 -4.151 1.00 0.53 C ATOM 1773 C LEU A 433 -12.786 -1.246 -3.821 1.00 0.54 C ATOM 1774 O LEU A 433 -12.771 -2.330 -4.405 1.00 0.67 O ATOM 1775 CB LEU A 433 -13.317 0.712 -5.277 1.00 0.60 C ATOM 1776 CG LEU A 433 -12.144 1.612 -4.921 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -11.123 1.638 -6.049 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.642 3.015 -4.630 1.00 0.88 C ATOM 0 H LEU A 433 -13.791 1.535 -2.948 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.736 -0.682 -4.492 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -13.026 0.081 -6.117 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -14.141 1.338 -5.619 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.657 1.214 -4.031 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -10.292 2.288 -5.773 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.751 0.629 -6.226 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -11.593 2.016 -6.957 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.797 3.655 -4.376 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -13.146 3.412 -5.511 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.341 2.987 -3.794 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.925 -0.924 -2.870 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.877 -1.843 -2.437 1.00 0.60 C ATOM 1792 C GLU A 434 -11.420 -2.984 -1.586 1.00 0.76 C ATOM 1793 O GLU A 434 -10.659 -3.853 -1.152 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.793 -1.101 -1.673 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.909 -0.275 -2.558 1.00 0.63 C ATOM 1796 CD GLU A 434 -7.624 0.109 -1.883 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -6.798 -0.789 -1.629 1.00 1.36 O ATOM 1798 OE2 GLU A 434 -7.426 1.305 -1.615 1.00 1.90 O ATOM 0 H GLU A 434 -11.929 -0.030 -2.379 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.450 -2.279 -3.340 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -10.259 -0.454 -0.930 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -9.182 -1.822 -1.130 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -8.686 -0.833 -3.467 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -9.442 0.627 -2.860 1.00 0.63 H new ATOM 1805 N SER A 435 -12.725 -2.989 -1.351 1.00 0.72 N ATOM 1806 CA SER A 435 -13.357 -4.093 -0.647 1.00 0.89 C ATOM 1807 C SER A 435 -13.181 -5.376 -1.454 1.00 1.03 C ATOM 1808 O SER A 435 -13.053 -6.465 -0.896 1.00 1.20 O ATOM 1809 CB SER A 435 -14.843 -3.808 -0.417 1.00 0.97 C ATOM 1810 OG SER A 435 -15.471 -4.868 0.293 1.00 1.47 O ATOM 0 H SER A 435 -13.362 -2.245 -1.636 1.00 0.72 H new ATOM 0 HA SER A 435 -12.882 -4.211 0.327 1.00 0.89 H new ATOM 0 HB2 SER A 435 -14.955 -2.878 0.141 1.00 0.97 H new ATOM 0 HB3 SER A 435 -15.340 -3.666 -1.376 1.00 0.97 H new ATOM 0 HG SER A 435 -16.419 -4.656 0.426 1.00 1.47 H new ATOM 1816 N GLN A 436 -13.157 -5.226 -2.772 1.00 1.04 N ATOM 1817 CA GLN A 436 -12.964 -6.347 -3.669 1.00 1.24 C ATOM 1818 C GLN A 436 -11.478 -6.635 -3.824 1.00 1.47 C ATOM 1819 O GLN A 436 -11.052 -7.770 -3.548 1.00 1.78 O ATOM 1820 CB GLN A 436 -13.584 -6.043 -5.030 1.00 1.17 C ATOM 1821 CG GLN A 436 -15.034 -5.589 -4.958 1.00 1.30 C ATOM 1822 CD GLN A 436 -15.938 -6.568 -4.227 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -15.691 -7.772 -4.198 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -17.001 -6.052 -3.632 1.00 2.60 N ATOM 1825 OXT GLN A 436 -10.732 -5.697 -4.178 1.00 2.10 O ATOM 0 H GLN A 436 -13.270 -4.328 -3.242 1.00 1.04 H new ATOM 0 HA GLN A 436 -13.454 -7.226 -3.249 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -12.995 -5.269 -5.522 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -13.523 -6.935 -5.654 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -15.080 -4.621 -4.458 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -15.412 -5.443 -5.970 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -17.174 -5.048 -3.677 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -17.648 -6.658 -3.128 1.00 2.60 H new TER 1834 GLN A 436