USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 715 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 514 ASN :FLIP amide:sc= 1.08 F(o=-0.17,f=2.3) USER MOD Set 1.2: A 534 THR OG1 : rot -61:sc= 1.25 USER MOD Single : A 441 THR OG1 : rot 180:sc= -0.0106 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.0158 X(o=-0.016,f=-0.029) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -158:sc= 0.936 USER MOD Single : A 461 HIS : no HD1:sc= -0.294 K(o=-0.29,f=-1.7!) USER MOD Single : A 463 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -3.43! C(o=-3.4!,f=-16!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot 94:sc= 0.297 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 TYR OH : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= 0.632 K(o=0.63,f=-4.1!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 49:sc= -0.512 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -0.0999 K(o=-0.1,f=-0.81) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot -46:sc= 0.561 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= -0.518 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 510 MET CE :methyl -166:sc= -0.0146 (180deg=-0.281) USER MOD Single : A 511 TYR OH : rot 20:sc= 0.848 USER MOD Single : A 516 THR OG1 : rot 180:sc= 0 USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N PRO A 438 -5.633 -16.721 -6.412 1.00 0.00 N ATOM 56 CA PRO A 438 -5.772 -15.334 -6.837 1.00 0.00 C ATOM 57 C PRO A 438 -4.425 -14.739 -7.228 1.00 0.00 C ATOM 58 O PRO A 438 -3.375 -15.313 -6.939 1.00 0.00 O ATOM 59 CB PRO A 438 -6.381 -14.629 -5.620 1.00 0.00 C ATOM 60 CG PRO A 438 -5.908 -15.428 -4.453 1.00 0.00 C ATOM 61 CD PRO A 438 -5.859 -16.851 -4.939 1.00 0.00 C ATOM 0 HA PRO A 438 -6.395 -15.226 -7.725 1.00 0.00 H new ATOM 0 HB2 PRO A 438 -6.048 -13.593 -5.553 1.00 0.00 H new ATOM 0 HB3 PRO A 438 -7.469 -14.611 -5.675 1.00 0.00 H new ATOM 0 HG2 PRO A 438 -4.926 -15.093 -4.119 1.00 0.00 H new ATOM 0 HG3 PRO A 438 -6.586 -15.325 -3.605 1.00 0.00 H new ATOM 0 HD2 PRO A 438 -5.055 -17.409 -4.459 1.00 0.00 H new ATOM 0 HD3 PRO A 438 -6.788 -17.379 -4.722 1.00 0.00 H new ATOM 69 N ASP A 439 -4.461 -13.587 -7.888 1.00 0.00 N ATOM 70 CA ASP A 439 -3.250 -12.829 -8.175 1.00 0.00 C ATOM 71 C ASP A 439 -3.347 -11.408 -7.633 1.00 0.00 C ATOM 72 O ASP A 439 -3.563 -10.460 -8.387 1.00 0.00 O ATOM 73 CB ASP A 439 -2.978 -12.800 -9.680 1.00 0.00 C ATOM 74 CG ASP A 439 -1.659 -12.145 -10.069 1.00 0.00 C ATOM 75 OD1 ASP A 439 -0.921 -11.773 -9.188 1.00 0.00 O ATOM 76 OD2 ASP A 439 -1.329 -12.163 -11.231 1.00 0.00 O ATOM 0 H ASP A 439 -5.318 -13.157 -8.235 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.420 -13.328 -7.676 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.987 -13.822 -10.058 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -3.792 -12.270 -10.174 1.00 0.00 H new ATOM 81 N LEU A 440 -3.189 -11.269 -6.322 1.00 0.00 N ATOM 82 CA LEU A 440 -3.366 -9.981 -5.661 1.00 0.00 C ATOM 83 C LEU A 440 -2.118 -9.118 -5.791 1.00 0.00 C ATOM 84 O LEU A 440 -1.005 -9.575 -5.528 1.00 0.00 O ATOM 85 CB LEU A 440 -3.720 -10.186 -4.184 1.00 0.00 C ATOM 86 CG LEU A 440 -5.026 -10.950 -3.925 1.00 0.00 C ATOM 87 CD1 LEU A 440 -5.122 -11.340 -2.456 1.00 0.00 C ATOM 88 CD2 LEU A 440 -6.209 -10.085 -4.332 1.00 0.00 C ATOM 0 H LEU A 440 -2.938 -12.033 -5.695 1.00 0.00 H new ATOM 0 HA LEU A 440 -4.187 -9.460 -6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.902 -10.722 -3.702 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -3.788 -9.210 -3.704 1.00 0.00 H new ATOM 0 HG LEU A 440 -5.037 -11.863 -4.520 1.00 0.00 H new ATOM 0 HD11 LEU A 440 -6.052 -11.881 -2.283 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -4.277 -11.977 -2.193 1.00 0.00 H new ATOM 0 HD13 LEU A 440 -5.105 -10.441 -1.839 1.00 0.00 H new ATOM 0 HD21 LEU A 440 -7.137 -10.627 -4.148 1.00 0.00 H new ATOM 0 HD22 LEU A 440 -6.205 -9.165 -3.748 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -6.135 -9.842 -5.392 1.00 0.00 H new ATOM 100 N THR A 441 -2.308 -7.868 -6.199 1.00 0.00 N ATOM 101 CA THR A 441 -1.202 -6.925 -6.323 1.00 0.00 C ATOM 102 C THR A 441 -1.592 -5.547 -5.805 1.00 0.00 C ATOM 103 O THR A 441 -2.771 -5.190 -5.788 1.00 0.00 O ATOM 104 CB THR A 441 -0.729 -6.799 -7.782 1.00 0.00 C ATOM 105 OG1 THR A 441 0.431 -5.959 -7.840 1.00 0.00 O ATOM 106 CG2 THR A 441 -1.827 -6.200 -8.649 1.00 0.00 C ATOM 0 H THR A 441 -3.219 -7.484 -6.450 1.00 0.00 H new ATOM 0 HA THR A 441 -0.385 -7.318 -5.718 1.00 0.00 H new ATOM 0 HB THR A 441 -0.486 -7.793 -8.156 1.00 0.00 H new ATOM 0 HG1 THR A 441 0.732 -5.881 -8.769 1.00 0.00 H new ATOM 0 HG21 THR A 441 -1.475 -6.118 -9.677 1.00 0.00 H new ATOM 0 HG22 THR A 441 -2.707 -6.842 -8.617 1.00 0.00 H new ATOM 0 HG23 THR A 441 -2.087 -5.210 -8.275 1.00 0.00 H new ATOM 114 N VAL A 442 -0.597 -4.775 -5.384 1.00 0.00 N ATOM 115 CA VAL A 442 -0.839 -3.458 -4.807 1.00 0.00 C ATOM 116 C VAL A 442 0.071 -2.408 -5.431 1.00 0.00 C ATOM 117 O VAL A 442 1.148 -2.728 -5.935 1.00 0.00 O ATOM 118 CB VAL A 442 -0.634 -3.461 -3.281 1.00 0.00 C ATOM 119 CG1 VAL A 442 -1.583 -4.449 -2.619 1.00 0.00 C ATOM 120 CG2 VAL A 442 0.809 -3.800 -2.938 1.00 0.00 C ATOM 0 H VAL A 442 0.387 -5.039 -5.432 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.878 -3.208 -5.022 1.00 0.00 H new ATOM 0 HB VAL A 442 -0.854 -2.463 -2.902 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -1.425 -4.439 -1.541 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.613 -4.167 -2.838 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.392 -5.451 -3.004 1.00 0.00 H new ATOM 0 HG21 VAL A 442 0.936 -3.798 -1.855 1.00 0.00 H new ATOM 0 HG22 VAL A 442 1.054 -4.787 -3.330 1.00 0.00 H new ATOM 0 HG23 VAL A 442 1.473 -3.058 -3.383 1.00 0.00 H new ATOM 130 N GLU A 443 -0.365 -1.154 -5.392 1.00 0.00 N ATOM 131 CA GLU A 443 0.404 -0.056 -5.965 1.00 0.00 C ATOM 132 C GLU A 443 0.347 1.179 -5.076 1.00 0.00 C ATOM 133 O GLU A 443 -0.714 1.544 -4.572 1.00 0.00 O ATOM 134 CB GLU A 443 -0.105 0.281 -7.367 1.00 0.00 C ATOM 135 CG GLU A 443 0.257 -0.746 -8.432 1.00 0.00 C ATOM 136 CD GLU A 443 -0.255 -0.335 -9.783 1.00 0.00 C ATOM 137 OE1 GLU A 443 -0.877 0.696 -9.874 1.00 0.00 O ATOM 138 OE2 GLU A 443 0.069 -0.992 -10.745 1.00 0.00 O ATOM 0 H GLU A 443 -1.249 -0.872 -4.968 1.00 0.00 H new ATOM 0 HA GLU A 443 1.443 -0.378 -6.034 1.00 0.00 H new ATOM 0 HB2 GLU A 443 -1.190 0.383 -7.332 1.00 0.00 H new ATOM 0 HB3 GLU A 443 0.297 1.250 -7.663 1.00 0.00 H new ATOM 0 HG2 GLU A 443 1.340 -0.865 -8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 443 -0.161 -1.716 -8.162 1.00 0.00 H new ATOM 145 N ILE A 444 1.495 1.821 -4.888 1.00 0.00 N ATOM 146 CA ILE A 444 1.563 3.065 -4.133 1.00 0.00 C ATOM 147 C ILE A 444 1.774 4.258 -5.056 1.00 0.00 C ATOM 148 O ILE A 444 2.698 4.270 -5.870 1.00 0.00 O ATOM 149 CB ILE A 444 2.692 3.032 -3.087 1.00 0.00 C ATOM 150 CG1 ILE A 444 2.461 1.894 -2.089 1.00 0.00 C ATOM 151 CG2 ILE A 444 2.787 4.366 -2.363 1.00 0.00 C ATOM 152 CD1 ILE A 444 3.628 1.654 -1.158 1.00 0.00 C ATOM 0 H ILE A 444 2.393 1.499 -5.249 1.00 0.00 H new ATOM 0 HA ILE A 444 0.608 3.172 -3.618 1.00 0.00 H new ATOM 0 HB ILE A 444 3.636 2.854 -3.602 1.00 0.00 H new ATOM 0 HG12 ILE A 444 1.575 2.118 -1.495 1.00 0.00 H new ATOM 0 HG13 ILE A 444 2.253 0.977 -2.640 1.00 0.00 H new ATOM 0 HG21 ILE A 444 3.590 4.324 -1.627 1.00 0.00 H new ATOM 0 HG22 ILE A 444 2.995 5.157 -3.083 1.00 0.00 H new ATOM 0 HG23 ILE A 444 1.843 4.574 -1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 444 3.390 0.834 -0.481 1.00 0.00 H new ATOM 0 HD12 ILE A 444 4.512 1.398 -1.742 1.00 0.00 H new ATOM 0 HD13 ILE A 444 3.824 2.557 -0.580 1.00 0.00 H new ATOM 164 N LYS A 445 0.912 5.260 -4.926 1.00 0.00 N ATOM 165 CA LYS A 445 1.019 6.472 -5.728 1.00 0.00 C ATOM 166 C LYS A 445 0.809 7.718 -4.876 1.00 0.00 C ATOM 167 O LYS A 445 0.053 7.697 -3.905 1.00 0.00 O ATOM 168 CB LYS A 445 0.011 6.446 -6.877 1.00 0.00 C ATOM 169 CG LYS A 445 0.281 5.376 -7.927 1.00 0.00 C ATOM 170 CD LYS A 445 -0.720 5.456 -9.070 1.00 0.00 C ATOM 171 CE LYS A 445 -0.472 4.368 -10.103 1.00 0.00 C ATOM 172 NZ LYS A 445 -1.460 4.417 -11.215 1.00 0.00 N ATOM 0 H LYS A 445 0.130 5.256 -4.271 1.00 0.00 H new ATOM 0 HA LYS A 445 2.027 6.508 -6.142 1.00 0.00 H new ATOM 0 HB2 LYS A 445 -0.986 6.291 -6.466 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.007 7.422 -7.363 1.00 0.00 H new ATOM 0 HG2 LYS A 445 1.292 5.494 -8.317 1.00 0.00 H new ATOM 0 HG3 LYS A 445 0.231 4.390 -7.465 1.00 0.00 H new ATOM 0 HD2 LYS A 445 -1.732 5.362 -8.676 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.653 6.434 -9.546 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.534 4.475 -10.508 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.519 3.392 -9.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -1.254 3.658 -11.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -2.419 4.289 -10.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -1.398 5.338 -11.694 1.00 0.00 H new ATOM 186 N GLY A 446 1.484 8.801 -5.245 1.00 0.00 N ATOM 187 CA GLY A 446 1.353 10.066 -4.530 1.00 0.00 C ATOM 188 C GLY A 446 2.573 10.950 -4.748 1.00 0.00 C ATOM 189 O GLY A 446 3.415 10.665 -5.599 1.00 0.00 O ATOM 0 H GLY A 446 2.128 8.829 -6.036 1.00 0.00 H new ATOM 0 HA2 GLY A 446 0.458 10.587 -4.869 1.00 0.00 H new ATOM 0 HA3 GLY A 446 1.226 9.873 -3.465 1.00 0.00 H new ATOM 193 N PRO A 447 2.664 12.027 -3.973 1.00 0.00 N ATOM 194 CA PRO A 447 3.766 12.972 -4.101 1.00 0.00 C ATOM 195 C PRO A 447 5.084 12.343 -3.668 1.00 0.00 C ATOM 196 O PRO A 447 5.138 11.608 -2.683 1.00 0.00 O ATOM 197 CB PRO A 447 3.363 14.142 -3.198 1.00 0.00 C ATOM 198 CG PRO A 447 2.410 13.544 -2.220 1.00 0.00 C ATOM 199 CD PRO A 447 1.665 12.482 -2.984 1.00 0.00 C ATOM 0 HA PRO A 447 3.931 13.291 -5.130 1.00 0.00 H new ATOM 0 HB2 PRO A 447 4.229 14.573 -2.696 1.00 0.00 H new ATOM 0 HB3 PRO A 447 2.895 14.943 -3.770 1.00 0.00 H new ATOM 0 HG2 PRO A 447 2.938 13.117 -1.368 1.00 0.00 H new ATOM 0 HG3 PRO A 447 1.727 14.297 -1.827 1.00 0.00 H new ATOM 0 HD2 PRO A 447 1.340 11.669 -2.334 1.00 0.00 H new ATOM 0 HD3 PRO A 447 0.772 12.881 -3.465 1.00 0.00 H new ATOM 207 N ASP A 448 6.146 12.635 -4.412 1.00 0.00 N ATOM 208 CA ASP A 448 7.458 12.067 -4.131 1.00 0.00 C ATOM 209 C ASP A 448 8.224 12.920 -3.128 1.00 0.00 C ATOM 210 O ASP A 448 8.956 12.400 -2.287 1.00 0.00 O ATOM 211 CB ASP A 448 8.267 11.920 -5.422 1.00 0.00 C ATOM 212 CG ASP A 448 7.678 10.938 -6.424 1.00 0.00 C ATOM 213 OD1 ASP A 448 7.465 9.805 -6.062 1.00 0.00 O ATOM 214 OD2 ASP A 448 7.301 11.363 -7.491 1.00 0.00 O ATOM 0 H ASP A 448 6.123 13.263 -5.215 1.00 0.00 H new ATOM 0 HA ASP A 448 7.307 11.080 -3.694 1.00 0.00 H new ATOM 0 HB2 ASP A 448 8.352 12.898 -5.897 1.00 0.00 H new ATOM 0 HB3 ASP A 448 9.278 11.600 -5.169 1.00 0.00 H new ATOM 219 N VAL A 449 8.052 14.235 -3.222 1.00 0.00 N ATOM 220 CA VAL A 449 8.671 15.159 -2.280 1.00 0.00 C ATOM 221 C VAL A 449 7.620 15.988 -1.552 1.00 0.00 C ATOM 222 O VAL A 449 6.735 16.572 -2.175 1.00 0.00 O ATOM 223 CB VAL A 449 9.661 16.106 -2.984 1.00 0.00 C ATOM 224 CG1 VAL A 449 10.277 17.073 -1.983 1.00 0.00 C ATOM 225 CG2 VAL A 449 10.746 15.312 -3.693 1.00 0.00 C ATOM 0 H VAL A 449 7.488 14.685 -3.943 1.00 0.00 H new ATOM 0 HA VAL A 449 9.216 14.552 -1.557 1.00 0.00 H new ATOM 0 HB VAL A 449 9.114 16.683 -3.729 1.00 0.00 H new ATOM 0 HG11 VAL A 449 10.974 17.735 -2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 449 9.489 17.666 -1.518 1.00 0.00 H new ATOM 0 HG13 VAL A 449 10.809 16.512 -1.215 1.00 0.00 H new ATOM 0 HG21 VAL A 449 11.436 15.998 -4.185 1.00 0.00 H new ATOM 0 HG22 VAL A 449 11.290 14.709 -2.966 1.00 0.00 H new ATOM 0 HG23 VAL A 449 10.291 14.659 -4.438 1.00 0.00 H new ATOM 235 N VAL A 450 7.725 16.036 -0.229 1.00 0.00 N ATOM 236 CA VAL A 450 6.773 16.777 0.589 1.00 0.00 C ATOM 237 C VAL A 450 7.489 17.692 1.575 1.00 0.00 C ATOM 238 O VAL A 450 8.619 17.421 1.979 1.00 0.00 O ATOM 239 CB VAL A 450 5.839 15.831 1.365 1.00 0.00 C ATOM 240 CG1 VAL A 450 5.045 14.959 0.406 1.00 0.00 C ATOM 241 CG2 VAL A 450 6.637 14.970 2.332 1.00 0.00 C ATOM 0 H VAL A 450 8.461 15.570 0.301 1.00 0.00 H new ATOM 0 HA VAL A 450 6.176 17.382 -0.094 1.00 0.00 H new ATOM 0 HB VAL A 450 5.138 16.436 1.940 1.00 0.00 H new ATOM 0 HG11 VAL A 450 4.391 14.297 0.973 1.00 0.00 H new ATOM 0 HG12 VAL A 450 4.444 15.591 -0.248 1.00 0.00 H new ATOM 0 HG13 VAL A 450 5.731 14.363 -0.196 1.00 0.00 H new ATOM 0 HG21 VAL A 450 5.961 14.307 2.872 1.00 0.00 H new ATOM 0 HG22 VAL A 450 7.362 14.375 1.776 1.00 0.00 H new ATOM 0 HG23 VAL A 450 7.161 15.610 3.042 1.00 0.00 H new ATOM 251 N GLY A 451 6.823 18.776 1.958 1.00 0.00 N ATOM 252 CA GLY A 451 7.405 19.746 2.878 1.00 0.00 C ATOM 253 C GLY A 451 7.214 19.316 4.327 1.00 0.00 C ATOM 254 O GLY A 451 6.340 18.506 4.633 1.00 0.00 O ATOM 0 H GLY A 451 5.879 19.005 1.645 1.00 0.00 H new ATOM 0 HA2 GLY A 451 8.468 19.859 2.667 1.00 0.00 H new ATOM 0 HA3 GLY A 451 6.944 20.721 2.722 1.00 0.00 H new ATOM 258 N VAL A 452 8.039 19.861 5.214 1.00 0.00 N ATOM 259 CA VAL A 452 7.952 19.546 6.635 1.00 0.00 C ATOM 260 C VAL A 452 6.747 20.225 7.276 1.00 0.00 C ATOM 261 O VAL A 452 6.456 21.388 6.997 1.00 0.00 O ATOM 262 CB VAL A 452 9.227 19.970 7.387 1.00 0.00 C ATOM 263 CG1 VAL A 452 9.247 21.476 7.598 1.00 0.00 C ATOM 264 CG2 VAL A 452 9.324 19.244 8.721 1.00 0.00 C ATOM 0 H VAL A 452 8.776 20.524 4.974 1.00 0.00 H new ATOM 0 HA VAL A 452 7.840 18.464 6.711 1.00 0.00 H new ATOM 0 HB VAL A 452 10.091 19.697 6.781 1.00 0.00 H new ATOM 0 HG11 VAL A 452 10.155 21.757 8.131 1.00 0.00 H new ATOM 0 HG12 VAL A 452 9.223 21.979 6.631 1.00 0.00 H new ATOM 0 HG13 VAL A 452 8.377 21.773 8.183 1.00 0.00 H new ATOM 0 HG21 VAL A 452 10.231 19.555 9.240 1.00 0.00 H new ATOM 0 HG22 VAL A 452 8.455 19.488 9.332 1.00 0.00 H new ATOM 0 HG23 VAL A 452 9.356 18.168 8.548 1.00 0.00 H new ATOM 274 N ASN A 453 6.051 19.492 8.138 1.00 0.00 N ATOM 275 CA ASN A 453 4.858 20.010 8.794 1.00 0.00 C ATOM 276 C ASN A 453 3.769 20.338 7.779 1.00 0.00 C ATOM 277 O ASN A 453 2.895 21.165 8.037 1.00 0.00 O ATOM 278 CB ASN A 453 5.173 21.230 9.638 1.00 0.00 C ATOM 279 CG ASN A 453 5.964 20.921 10.877 1.00 0.00 C ATOM 280 OD1 ASN A 453 5.544 20.123 11.724 1.00 0.00 O ATOM 281 ND2 ASN A 453 7.067 21.608 11.031 1.00 0.00 N ATOM 0 H ASN A 453 6.294 18.536 8.398 1.00 0.00 H new ATOM 0 HA ASN A 453 4.489 19.226 9.455 1.00 0.00 H new ATOM 0 HB2 ASN A 453 5.729 21.946 9.032 1.00 0.00 H new ATOM 0 HB3 ASN A 453 4.239 21.713 9.925 1.00 0.00 H new ATOM 0 HD21 ASN A 453 7.622 21.497 11.879 1.00 0.00 H new ATOM 0 HD22 ASN A 453 7.371 22.254 10.303 1.00 0.00 H new ATOM 288 N LYS A 454 3.829 19.683 6.624 1.00 0.00 N ATOM 289 CA LYS A 454 2.803 19.844 5.600 1.00 0.00 C ATOM 290 C LYS A 454 2.045 18.541 5.372 1.00 0.00 C ATOM 291 O LYS A 454 2.585 17.454 5.575 1.00 0.00 O ATOM 292 CB LYS A 454 3.424 20.326 4.289 1.00 0.00 C ATOM 293 CG LYS A 454 3.983 21.742 4.341 1.00 0.00 C ATOM 294 CD LYS A 454 2.904 22.750 4.707 1.00 0.00 C ATOM 295 CE LYS A 454 1.788 22.767 3.670 1.00 0.00 C ATOM 296 NZ LYS A 454 0.726 23.751 4.012 1.00 0.00 N ATOM 0 H LYS A 454 4.577 19.036 6.374 1.00 0.00 H new ATOM 0 HA LYS A 454 2.095 20.595 5.952 1.00 0.00 H new ATOM 0 HB2 LYS A 454 4.225 19.642 4.007 1.00 0.00 H new ATOM 0 HB3 LYS A 454 2.670 20.275 3.503 1.00 0.00 H new ATOM 0 HG2 LYS A 454 4.791 21.790 5.071 1.00 0.00 H new ATOM 0 HG3 LYS A 454 4.413 22.001 3.373 1.00 0.00 H new ATOM 0 HD2 LYS A 454 2.491 22.504 5.685 1.00 0.00 H new ATOM 0 HD3 LYS A 454 3.344 23.744 4.787 1.00 0.00 H new ATOM 0 HE2 LYS A 454 2.205 23.008 2.692 1.00 0.00 H new ATOM 0 HE3 LYS A 454 1.349 21.772 3.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -0.014 23.731 3.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 0.310 23.507 4.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 1.139 24.704 4.061 1.00 0.00 H new ATOM 310 N LEU A 455 0.791 18.657 4.948 1.00 0.00 N ATOM 311 CA LEU A 455 -0.076 17.497 4.792 1.00 0.00 C ATOM 312 C LEU A 455 0.056 16.893 3.400 1.00 0.00 C ATOM 313 O LEU A 455 -0.053 17.596 2.396 1.00 0.00 O ATOM 314 CB LEU A 455 -1.535 17.883 5.070 1.00 0.00 C ATOM 315 CG LEU A 455 -2.535 16.722 5.034 1.00 0.00 C ATOM 316 CD1 LEU A 455 -2.271 15.769 6.191 1.00 0.00 C ATOM 317 CD2 LEU A 455 -3.953 17.270 5.097 1.00 0.00 C ATOM 0 H LEU A 455 0.352 19.546 4.706 1.00 0.00 H new ATOM 0 HA LEU A 455 0.235 16.744 5.516 1.00 0.00 H new ATOM 0 HB2 LEU A 455 -1.588 18.357 6.050 1.00 0.00 H new ATOM 0 HB3 LEU A 455 -1.843 18.629 4.338 1.00 0.00 H new ATOM 0 HG LEU A 455 -2.415 16.168 4.103 1.00 0.00 H new ATOM 0 HD11 LEU A 455 -2.987 14.948 6.156 1.00 0.00 H new ATOM 0 HD12 LEU A 455 -1.259 15.372 6.112 1.00 0.00 H new ATOM 0 HD13 LEU A 455 -2.378 16.304 7.135 1.00 0.00 H new ATOM 0 HD21 LEU A 455 -4.664 16.444 5.071 1.00 0.00 H new ATOM 0 HD22 LEU A 455 -4.085 17.833 6.021 1.00 0.00 H new ATOM 0 HD23 LEU A 455 -4.128 17.926 4.244 1.00 0.00 H new ATOM 329 N ALA A 456 0.296 15.587 3.348 1.00 0.00 N ATOM 330 CA ALA A 456 0.313 14.861 2.084 1.00 0.00 C ATOM 331 C ALA A 456 -0.696 13.720 2.088 1.00 0.00 C ATOM 332 O ALA A 456 -0.950 13.110 3.125 1.00 0.00 O ATOM 333 CB ALA A 456 1.711 14.336 1.794 1.00 0.00 C ATOM 0 H ALA A 456 0.482 15.009 4.168 1.00 0.00 H new ATOM 0 HA ALA A 456 0.028 15.555 1.293 1.00 0.00 H new ATOM 0 HB1 ALA A 456 1.708 13.796 0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 456 2.408 15.172 1.733 1.00 0.00 H new ATOM 0 HB3 ALA A 456 2.020 13.663 2.594 1.00 0.00 H new ATOM 339 N GLU A 457 -1.267 13.438 0.923 1.00 0.00 N ATOM 340 CA GLU A 457 -2.204 12.331 0.776 1.00 0.00 C ATOM 341 C GLU A 457 -1.682 11.294 -0.211 1.00 0.00 C ATOM 342 O GLU A 457 -1.139 11.642 -1.259 1.00 0.00 O ATOM 343 CB GLU A 457 -3.574 12.843 0.329 1.00 0.00 C ATOM 344 CG GLU A 457 -4.506 13.225 1.469 1.00 0.00 C ATOM 345 CD GLU A 457 -4.522 14.712 1.686 1.00 0.00 C ATOM 346 OE1 GLU A 457 -4.799 15.427 0.754 1.00 0.00 O ATOM 347 OE2 GLU A 457 -4.367 15.130 2.809 1.00 0.00 O ATOM 0 H GLU A 457 -1.097 13.962 0.065 1.00 0.00 H new ATOM 0 HA GLU A 457 -2.308 11.851 1.749 1.00 0.00 H new ATOM 0 HB2 GLU A 457 -3.431 13.712 -0.314 1.00 0.00 H new ATOM 0 HB3 GLU A 457 -4.056 12.075 -0.276 1.00 0.00 H new ATOM 0 HG2 GLU A 457 -5.515 12.877 1.249 1.00 0.00 H new ATOM 0 HG3 GLU A 457 -4.189 12.725 2.384 1.00 0.00 H new ATOM 354 N TYR A 458 -1.851 10.021 0.130 1.00 0.00 N ATOM 355 CA TYR A 458 -1.367 8.933 -0.712 1.00 0.00 C ATOM 356 C TYR A 458 -2.465 7.911 -0.976 1.00 0.00 C ATOM 357 O TYR A 458 -3.431 7.813 -0.216 1.00 0.00 O ATOM 358 CB TYR A 458 -0.162 8.251 -0.063 1.00 0.00 C ATOM 359 CG TYR A 458 1.083 9.111 -0.027 1.00 0.00 C ATOM 360 CD1 TYR A 458 1.340 9.946 1.050 1.00 0.00 C ATOM 361 CD2 TYR A 458 1.996 9.083 -1.069 1.00 0.00 C ATOM 362 CE1 TYR A 458 2.475 10.734 1.087 1.00 0.00 C ATOM 363 CE2 TYR A 458 3.134 9.866 -1.042 1.00 0.00 C ATOM 364 CZ TYR A 458 3.370 10.690 0.038 1.00 0.00 C ATOM 365 OH TYR A 458 4.503 11.471 0.071 1.00 0.00 O ATOM 0 H TYR A 458 -2.319 9.717 0.984 1.00 0.00 H new ATOM 0 HA TYR A 458 -1.062 9.361 -1.667 1.00 0.00 H new ATOM 0 HB2 TYR A 458 -0.424 7.965 0.956 1.00 0.00 H new ATOM 0 HB3 TYR A 458 0.059 7.332 -0.606 1.00 0.00 H new ATOM 0 HD1 TYR A 458 0.642 9.981 1.873 1.00 0.00 H new ATOM 0 HD2 TYR A 458 1.815 8.438 -1.916 1.00 0.00 H new ATOM 0 HE1 TYR A 458 2.660 11.380 1.932 1.00 0.00 H new ATOM 0 HE2 TYR A 458 3.835 9.833 -1.863 1.00 0.00 H new ATOM 0 HH TYR A 458 4.838 11.601 -0.841 1.00 0.00 H new ATOM 375 N GLU A 459 -2.313 7.151 -2.054 1.00 0.00 N ATOM 376 CA GLU A 459 -3.321 6.176 -2.453 1.00 0.00 C ATOM 377 C GLU A 459 -2.700 4.805 -2.683 1.00 0.00 C ATOM 378 O GLU A 459 -1.608 4.692 -3.241 1.00 0.00 O ATOM 379 CB GLU A 459 -4.047 6.643 -3.717 1.00 0.00 C ATOM 380 CG GLU A 459 -4.767 7.977 -3.572 1.00 0.00 C ATOM 381 CD GLU A 459 -5.468 8.360 -4.844 1.00 0.00 C ATOM 382 OE1 GLU A 459 -5.378 7.622 -5.796 1.00 0.00 O ATOM 383 OE2 GLU A 459 -6.187 9.332 -4.834 1.00 0.00 O ATOM 0 H GLU A 459 -1.500 7.191 -2.669 1.00 0.00 H new ATOM 0 HA GLU A 459 -4.043 6.091 -1.641 1.00 0.00 H new ATOM 0 HB2 GLU A 459 -3.324 6.721 -4.529 1.00 0.00 H new ATOM 0 HB3 GLU A 459 -4.772 5.882 -4.007 1.00 0.00 H new ATOM 0 HG2 GLU A 459 -5.491 7.915 -2.760 1.00 0.00 H new ATOM 0 HG3 GLU A 459 -4.050 8.752 -3.302 1.00 0.00 H new ATOM 390 N VAL A 460 -3.402 3.763 -2.250 1.00 0.00 N ATOM 391 CA VAL A 460 -2.991 2.393 -2.533 1.00 0.00 C ATOM 392 C VAL A 460 -3.977 1.705 -3.468 1.00 0.00 C ATOM 393 O VAL A 460 -5.163 1.585 -3.158 1.00 0.00 O ATOM 394 CB VAL A 460 -2.862 1.564 -1.241 1.00 0.00 C ATOM 395 CG1 VAL A 460 -2.341 0.170 -1.552 1.00 0.00 C ATOM 396 CG2 VAL A 460 -1.947 2.265 -0.248 1.00 0.00 C ATOM 0 H VAL A 460 -4.258 3.841 -1.702 1.00 0.00 H new ATOM 0 HA VAL A 460 -2.016 2.451 -3.016 1.00 0.00 H new ATOM 0 HB VAL A 460 -3.851 1.470 -0.792 1.00 0.00 H new ATOM 0 HG11 VAL A 460 -2.256 -0.401 -0.628 1.00 0.00 H new ATOM 0 HG12 VAL A 460 -3.032 -0.334 -2.228 1.00 0.00 H new ATOM 0 HG13 VAL A 460 -1.361 0.245 -2.024 1.00 0.00 H new ATOM 0 HG21 VAL A 460 -1.867 1.666 0.659 1.00 0.00 H new ATOM 0 HG22 VAL A 460 -0.958 2.389 -0.689 1.00 0.00 H new ATOM 0 HG23 VAL A 460 -2.359 3.243 -0.001 1.00 0.00 H new ATOM 406 N HIS A 461 -3.480 1.256 -4.616 1.00 0.00 N ATOM 407 CA HIS A 461 -4.328 0.635 -5.627 1.00 0.00 C ATOM 408 C HIS A 461 -4.183 -0.881 -5.611 1.00 0.00 C ATOM 409 O HIS A 461 -3.159 -1.421 -6.031 1.00 0.00 O ATOM 410 CB HIS A 461 -3.995 1.179 -7.020 1.00 0.00 C ATOM 411 CG HIS A 461 -4.199 2.655 -7.154 1.00 0.00 C ATOM 412 ND1 HIS A 461 -5.450 3.225 -7.263 1.00 0.00 N ATOM 413 CD2 HIS A 461 -3.314 3.677 -7.199 1.00 0.00 C ATOM 414 CE1 HIS A 461 -5.324 4.538 -7.366 1.00 0.00 C ATOM 415 NE2 HIS A 461 -4.038 4.836 -7.331 1.00 0.00 N ATOM 0 H HIS A 461 -2.494 1.311 -4.869 1.00 0.00 H new ATOM 0 HA HIS A 461 -5.362 0.883 -5.389 1.00 0.00 H new ATOM 0 HB2 HIS A 461 -2.957 0.942 -7.254 1.00 0.00 H new ATOM 0 HB3 HIS A 461 -4.613 0.667 -7.758 1.00 0.00 H new ATOM 0 HD2 HIS A 461 -2.239 3.596 -7.142 1.00 0.00 H new ATOM 0 HE1 HIS A 461 -6.134 5.245 -7.462 1.00 0.00 H new ATOM 0 HE2 HIS A 461 -3.646 5.776 -7.392 1.00 0.00 H new ATOM 423 N VAL A 462 -5.215 -1.565 -5.127 1.00 0.00 N ATOM 424 CA VAL A 462 -5.149 -3.005 -4.916 1.00 0.00 C ATOM 425 C VAL A 462 -6.182 -3.735 -5.764 1.00 0.00 C ATOM 426 O VAL A 462 -7.360 -3.374 -5.773 1.00 0.00 O ATOM 427 CB VAL A 462 -5.364 -3.369 -3.435 1.00 0.00 C ATOM 428 CG1 VAL A 462 -4.638 -2.383 -2.532 1.00 0.00 C ATOM 429 CG2 VAL A 462 -6.848 -3.400 -3.104 1.00 0.00 C ATOM 0 H VAL A 462 -6.108 -1.143 -4.873 1.00 0.00 H new ATOM 0 HA VAL A 462 -4.150 -3.321 -5.217 1.00 0.00 H new ATOM 0 HB VAL A 462 -4.951 -4.363 -3.262 1.00 0.00 H new ATOM 0 HG11 VAL A 462 -4.801 -2.656 -1.489 1.00 0.00 H new ATOM 0 HG12 VAL A 462 -3.570 -2.407 -2.751 1.00 0.00 H new ATOM 0 HG13 VAL A 462 -5.021 -1.378 -2.708 1.00 0.00 H new ATOM 0 HG21 VAL A 462 -6.981 -3.659 -2.054 1.00 0.00 H new ATOM 0 HG22 VAL A 462 -7.284 -2.419 -3.294 1.00 0.00 H new ATOM 0 HG23 VAL A 462 -7.344 -4.144 -3.727 1.00 0.00 H new ATOM 439 N LYS A 463 -5.736 -4.763 -6.477 1.00 0.00 N ATOM 440 CA LYS A 463 -6.583 -5.450 -7.445 1.00 0.00 C ATOM 441 C LYS A 463 -6.299 -6.947 -7.462 1.00 0.00 C ATOM 442 O LYS A 463 -5.199 -7.383 -7.124 1.00 0.00 O ATOM 443 CB LYS A 463 -6.386 -4.861 -8.842 1.00 0.00 C ATOM 444 CG LYS A 463 -4.944 -4.879 -9.335 1.00 0.00 C ATOM 445 CD LYS A 463 -4.857 -4.496 -10.805 1.00 0.00 C ATOM 446 CE LYS A 463 -5.100 -3.007 -11.004 1.00 0.00 C ATOM 447 NZ LYS A 463 -4.884 -2.592 -12.417 1.00 0.00 N ATOM 0 H LYS A 463 -4.791 -5.140 -6.403 1.00 0.00 H new ATOM 0 HA LYS A 463 -7.620 -5.304 -7.143 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -7.005 -5.415 -9.547 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.745 -3.832 -8.843 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -4.346 -4.188 -8.741 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.520 -5.873 -9.190 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -3.874 -4.761 -11.195 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -5.591 -5.066 -11.375 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -6.120 -2.763 -10.706 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -4.434 -2.441 -10.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -5.060 -1.571 -12.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -3.904 -2.801 -12.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -5.537 -3.113 -13.036 1.00 0.00 H new ATOM 461 N ASN A 464 -7.298 -7.728 -7.859 1.00 0.00 N ATOM 462 CA ASN A 464 -7.104 -9.154 -8.095 1.00 0.00 C ATOM 463 C ASN A 464 -7.117 -9.472 -9.586 1.00 0.00 C ATOM 464 O ASN A 464 -7.885 -8.885 -10.348 1.00 0.00 O ATOM 465 CB ASN A 464 -8.152 -9.982 -7.374 1.00 0.00 C ATOM 466 CG ASN A 464 -7.800 -11.440 -7.263 1.00 0.00 C ATOM 467 OD1 ASN A 464 -6.962 -11.955 -8.011 1.00 0.00 O ATOM 468 ND2 ASN A 464 -8.495 -12.124 -6.390 1.00 0.00 N ATOM 0 H ASN A 464 -8.249 -7.398 -8.024 1.00 0.00 H new ATOM 0 HA ASN A 464 -6.125 -9.417 -7.694 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -8.298 -9.575 -6.373 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -9.102 -9.886 -7.899 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -8.356 -13.131 -6.304 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -9.175 -11.650 -5.796 1.00 0.00 H new ATOM 475 N LEU A 465 -6.262 -10.403 -9.994 1.00 0.00 N ATOM 476 CA LEU A 465 -6.025 -10.658 -11.410 1.00 0.00 C ATOM 477 C LEU A 465 -6.087 -12.149 -11.719 1.00 0.00 C ATOM 478 O LEU A 465 -5.843 -12.568 -12.851 1.00 0.00 O ATOM 479 CB LEU A 465 -4.670 -10.081 -11.833 1.00 0.00 C ATOM 480 CG LEU A 465 -4.487 -8.580 -11.567 1.00 0.00 C ATOM 481 CD1 LEU A 465 -3.038 -8.179 -11.812 1.00 0.00 C ATOM 482 CD2 LEU A 465 -5.426 -7.787 -12.464 1.00 0.00 C ATOM 0 H LEU A 465 -5.721 -10.994 -9.363 1.00 0.00 H new ATOM 0 HA LEU A 465 -6.813 -10.164 -11.979 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -3.883 -10.625 -11.311 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -4.532 -10.264 -12.899 1.00 0.00 H new ATOM 0 HG LEU A 465 -4.729 -8.362 -10.527 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -2.918 -7.113 -11.621 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -2.387 -8.743 -11.144 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -2.771 -8.394 -12.847 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -5.296 -6.721 -12.275 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.199 -8.001 -13.508 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -6.457 -8.070 -12.252 1.00 0.00 H new ATOM 494 N GLY A 466 -6.413 -12.944 -10.706 1.00 0.00 N ATOM 495 CA GLY A 466 -6.397 -14.397 -10.837 1.00 0.00 C ATOM 496 C GLY A 466 -7.766 -14.929 -11.244 1.00 0.00 C ATOM 497 O GLY A 466 -7.957 -16.136 -11.382 1.00 0.00 O ATOM 0 H GLY A 466 -6.692 -12.607 -9.785 1.00 0.00 H new ATOM 0 HA2 GLY A 466 -5.655 -14.690 -11.580 1.00 0.00 H new ATOM 0 HA3 GLY A 466 -6.096 -14.847 -9.891 1.00 0.00 H new ATOM 501 N GLY A 467 -8.715 -14.017 -11.434 1.00 0.00 N ATOM 502 CA GLY A 467 -10.058 -14.389 -11.864 1.00 0.00 C ATOM 503 C GLY A 467 -10.823 -15.082 -10.742 1.00 0.00 C ATOM 504 O GLY A 467 -11.827 -15.752 -10.986 1.00 0.00 O ATOM 0 H GLY A 467 -8.578 -13.016 -11.297 1.00 0.00 H new ATOM 0 HA2 GLY A 467 -10.601 -13.499 -12.182 1.00 0.00 H new ATOM 0 HA3 GLY A 467 -9.996 -15.050 -12.728 1.00 0.00 H new ATOM 508 N ILE A 468 -10.342 -14.918 -9.515 1.00 0.00 N ATOM 509 CA ILE A 468 -11.069 -15.378 -8.340 1.00 0.00 C ATOM 510 C ILE A 468 -11.236 -14.258 -7.321 1.00 0.00 C ATOM 511 O ILE A 468 -10.398 -13.359 -7.229 1.00 0.00 O ATOM 512 CB ILE A 468 -10.361 -16.568 -7.667 1.00 0.00 C ATOM 513 CG1 ILE A 468 -10.929 -16.806 -6.265 1.00 0.00 C ATOM 514 CG2 ILE A 468 -8.861 -16.329 -7.603 1.00 0.00 C ATOM 515 CD1 ILE A 468 -10.491 -18.110 -5.641 1.00 0.00 C ATOM 0 H ILE A 468 -9.450 -14.469 -9.309 1.00 0.00 H new ATOM 0 HA ILE A 468 -12.051 -15.700 -8.686 1.00 0.00 H new ATOM 0 HB ILE A 468 -10.541 -17.460 -8.267 1.00 0.00 H new ATOM 0 HG12 ILE A 468 -10.626 -15.984 -5.616 1.00 0.00 H new ATOM 0 HG13 ILE A 468 -12.018 -16.787 -6.316 1.00 0.00 H new ATOM 0 HG21 ILE A 468 -8.377 -17.180 -7.124 1.00 0.00 H new ATOM 0 HG22 ILE A 468 -8.468 -16.209 -8.613 1.00 0.00 H new ATOM 0 HG23 ILE A 468 -8.661 -15.426 -7.026 1.00 0.00 H new ATOM 0 HD11 ILE A 468 -10.934 -18.206 -4.650 1.00 0.00 H new ATOM 0 HD12 ILE A 468 -10.818 -18.941 -6.267 1.00 0.00 H new ATOM 0 HD13 ILE A 468 -9.404 -18.126 -5.556 1.00 0.00 H new ATOM 527 N GLY A 469 -12.321 -14.315 -6.557 1.00 0.00 N ATOM 528 CA GLY A 469 -12.602 -13.303 -5.546 1.00 0.00 C ATOM 529 C GLY A 469 -12.110 -13.742 -4.174 1.00 0.00 C ATOM 530 O GLY A 469 -12.364 -14.868 -3.744 1.00 0.00 O ATOM 0 H GLY A 469 -13.022 -15.053 -6.619 1.00 0.00 H new ATOM 0 HA2 GLY A 469 -12.122 -12.365 -5.824 1.00 0.00 H new ATOM 0 HA3 GLY A 469 -13.675 -13.113 -5.507 1.00 0.00 H new ATOM 534 N VAL A 470 -11.403 -12.849 -3.489 1.00 0.00 N ATOM 535 CA VAL A 470 -10.959 -13.106 -2.125 1.00 0.00 C ATOM 536 C VAL A 470 -11.587 -12.121 -1.147 1.00 0.00 C ATOM 537 O VAL A 470 -11.370 -10.913 -1.241 1.00 0.00 O ATOM 538 CB VAL A 470 -9.426 -13.026 -2.005 1.00 0.00 C ATOM 539 CG1 VAL A 470 -8.990 -13.271 -0.568 1.00 0.00 C ATOM 540 CG2 VAL A 470 -8.765 -14.027 -2.939 1.00 0.00 C ATOM 0 H VAL A 470 -11.125 -11.939 -3.858 1.00 0.00 H new ATOM 0 HA VAL A 470 -11.281 -14.117 -1.875 1.00 0.00 H new ATOM 0 HB VAL A 470 -9.111 -12.024 -2.295 1.00 0.00 H new ATOM 0 HG11 VAL A 470 -7.904 -13.211 -0.502 1.00 0.00 H new ATOM 0 HG12 VAL A 470 -9.435 -12.517 0.081 1.00 0.00 H new ATOM 0 HG13 VAL A 470 -9.318 -14.261 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 470 -7.682 -13.956 -2.841 1.00 0.00 H new ATOM 0 HG22 VAL A 470 -9.088 -15.035 -2.679 1.00 0.00 H new ATOM 0 HG23 VAL A 470 -9.051 -13.808 -3.968 1.00 0.00 H new ATOM 550 N PRO A 471 -12.367 -12.644 -0.207 1.00 0.00 N ATOM 551 CA PRO A 471 -13.065 -11.809 0.761 1.00 0.00 C ATOM 552 C PRO A 471 -12.141 -11.397 1.901 1.00 0.00 C ATOM 553 O PRO A 471 -12.414 -10.434 2.617 1.00 0.00 O ATOM 554 CB PRO A 471 -14.223 -12.686 1.247 1.00 0.00 C ATOM 555 CG PRO A 471 -13.695 -14.077 1.163 1.00 0.00 C ATOM 556 CD PRO A 471 -12.788 -14.087 -0.038 1.00 0.00 C ATOM 0 HA PRO A 471 -13.418 -10.871 0.332 1.00 0.00 H new ATOM 0 HB2 PRO A 471 -14.513 -12.432 2.267 1.00 0.00 H new ATOM 0 HB3 PRO A 471 -15.107 -12.558 0.623 1.00 0.00 H new ATOM 0 HG2 PRO A 471 -13.151 -14.346 2.068 1.00 0.00 H new ATOM 0 HG3 PRO A 471 -14.504 -14.799 1.051 1.00 0.00 H new ATOM 0 HD2 PRO A 471 -11.927 -14.736 0.121 1.00 0.00 H new ATOM 0 HD3 PRO A 471 -13.306 -14.456 -0.923 1.00 0.00 H new ATOM 564 N SER A 472 -11.046 -12.133 2.063 1.00 0.00 N ATOM 565 CA SER A 472 -10.245 -12.056 3.279 1.00 0.00 C ATOM 566 C SER A 472 -9.102 -11.061 3.123 1.00 0.00 C ATOM 567 O SER A 472 -8.179 -11.031 3.935 1.00 0.00 O ATOM 568 CB SER A 472 -9.707 -13.427 3.637 1.00 0.00 C ATOM 569 OG SER A 472 -8.833 -13.920 2.660 1.00 0.00 O ATOM 0 H SER A 472 -10.693 -12.790 1.367 1.00 0.00 H new ATOM 0 HA SER A 472 -10.887 -11.705 4.087 1.00 0.00 H new ATOM 0 HB2 SER A 472 -9.188 -13.374 4.594 1.00 0.00 H new ATOM 0 HB3 SER A 472 -10.538 -14.121 3.763 1.00 0.00 H new ATOM 0 HG SER A 472 -8.507 -14.804 2.929 1.00 0.00 H new ATOM 575 N THR A 473 -9.173 -10.246 2.076 1.00 0.00 N ATOM 576 CA THR A 473 -8.000 -9.537 1.576 1.00 0.00 C ATOM 577 C THR A 473 -7.667 -8.338 2.454 1.00 0.00 C ATOM 578 O THR A 473 -8.425 -7.368 2.510 1.00 0.00 O ATOM 579 CB THR A 473 -8.203 -9.059 0.128 1.00 0.00 C ATOM 580 OG1 THR A 473 -8.445 -10.189 -0.721 1.00 0.00 O ATOM 581 CG2 THR A 473 -6.973 -8.315 -0.365 1.00 0.00 C ATOM 0 H THR A 473 -10.031 -10.060 1.557 1.00 0.00 H new ATOM 0 HA THR A 473 -7.171 -10.244 1.602 1.00 0.00 H new ATOM 0 HB THR A 473 -9.059 -8.384 0.101 1.00 0.00 H new ATOM 0 HG1 THR A 473 -9.411 -10.327 -0.814 1.00 0.00 H new ATOM 0 HG21 THR A 473 -7.135 -7.984 -1.391 1.00 0.00 H new ATOM 0 HG22 THR A 473 -6.792 -7.449 0.271 1.00 0.00 H new ATOM 0 HG23 THR A 473 -6.108 -8.978 -0.329 1.00 0.00 H new ATOM 589 N LYS A 474 -6.532 -8.409 3.140 1.00 0.00 N ATOM 590 CA LYS A 474 -6.107 -7.337 4.032 1.00 0.00 C ATOM 591 C LYS A 474 -4.875 -6.625 3.489 1.00 0.00 C ATOM 592 O LYS A 474 -3.865 -7.258 3.180 1.00 0.00 O ATOM 593 CB LYS A 474 -5.822 -7.886 5.432 1.00 0.00 C ATOM 594 CG LYS A 474 -7.041 -8.462 6.140 1.00 0.00 C ATOM 595 CD LYS A 474 -6.662 -9.076 7.480 1.00 0.00 C ATOM 596 CE LYS A 474 -7.857 -9.756 8.134 1.00 0.00 C ATOM 597 NZ LYS A 474 -7.482 -10.433 9.407 1.00 0.00 N ATOM 0 H LYS A 474 -5.889 -9.199 3.095 1.00 0.00 H new ATOM 0 HA LYS A 474 -6.920 -6.613 4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 474 -5.060 -8.662 5.357 1.00 0.00 H new ATOM 0 HB3 LYS A 474 -5.404 -7.087 6.045 1.00 0.00 H new ATOM 0 HG2 LYS A 474 -7.780 -7.676 6.294 1.00 0.00 H new ATOM 0 HG3 LYS A 474 -7.507 -9.219 5.509 1.00 0.00 H new ATOM 0 HD2 LYS A 474 -5.861 -9.802 7.337 1.00 0.00 H new ATOM 0 HD3 LYS A 474 -6.275 -8.301 8.141 1.00 0.00 H new ATOM 0 HE2 LYS A 474 -8.633 -9.016 8.331 1.00 0.00 H new ATOM 0 HE3 LYS A 474 -8.281 -10.487 7.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 -8.323 -10.884 9.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 -6.760 -11.157 9.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 -7.101 -9.732 10.074 1.00 0.00 H new ATOM 611 N VAL A 475 -4.964 -5.304 3.373 1.00 0.00 N ATOM 612 CA VAL A 475 -3.856 -4.504 2.864 1.00 0.00 C ATOM 613 C VAL A 475 -3.371 -3.507 3.909 1.00 0.00 C ATOM 614 O VAL A 475 -4.159 -2.739 4.463 1.00 0.00 O ATOM 615 CB VAL A 475 -4.254 -3.739 1.587 1.00 0.00 C ATOM 616 CG1 VAL A 475 -3.081 -2.918 1.073 1.00 0.00 C ATOM 617 CG2 VAL A 475 -4.734 -4.706 0.516 1.00 0.00 C ATOM 0 H VAL A 475 -5.792 -4.765 3.625 1.00 0.00 H new ATOM 0 HA VAL A 475 -3.050 -5.198 2.626 1.00 0.00 H new ATOM 0 HB VAL A 475 -5.071 -3.060 1.831 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -3.378 -2.384 0.171 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -2.777 -2.201 1.836 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -2.246 -3.580 0.844 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -5.011 -4.149 -0.379 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -3.935 -5.407 0.274 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.600 -5.256 0.884 1.00 0.00 H new ATOM 627 N ARG A 476 -2.069 -3.523 4.175 1.00 0.00 N ATOM 628 CA ARG A 476 -1.495 -2.716 5.244 1.00 0.00 C ATOM 629 C ARG A 476 -0.227 -2.012 4.782 1.00 0.00 C ATOM 630 O ARG A 476 0.430 -2.452 3.839 1.00 0.00 O ATOM 631 CB ARG A 476 -1.255 -3.526 6.510 1.00 0.00 C ATOM 632 CG ARG A 476 -0.309 -4.704 6.343 1.00 0.00 C ATOM 633 CD ARG A 476 -0.258 -5.617 7.514 1.00 0.00 C ATOM 634 NE ARG A 476 -1.458 -6.410 7.715 1.00 0.00 N ATOM 635 CZ ARG A 476 -1.583 -7.393 8.627 1.00 0.00 C ATOM 636 NH1 ARG A 476 -0.575 -7.734 9.398 1.00 0.00 N ATOM 637 NH2 ARG A 476 -2.742 -8.024 8.710 1.00 0.00 N ATOM 0 H ARG A 476 -1.391 -4.087 3.663 1.00 0.00 H new ATOM 0 HA ARG A 476 -2.228 -1.950 5.496 1.00 0.00 H new ATOM 0 HB2 ARG A 476 -0.856 -2.864 7.278 1.00 0.00 H new ATOM 0 HB3 ARG A 476 -2.213 -3.896 6.875 1.00 0.00 H new ATOM 0 HG2 ARG A 476 -0.610 -5.275 5.465 1.00 0.00 H new ATOM 0 HG3 ARG A 476 0.694 -4.325 6.149 1.00 0.00 H new ATOM 0 HD2 ARG A 476 0.591 -6.290 7.396 1.00 0.00 H new ATOM 0 HD3 ARG A 476 -0.074 -5.026 8.411 1.00 0.00 H new ATOM 0 HE ARG A 476 -2.264 -6.208 7.123 1.00 0.00 H new ATOM 0 HH11 ARG A 476 0.320 -7.252 9.311 1.00 0.00 H new ATOM 0 HH12 ARG A 476 -0.687 -8.481 10.084 1.00 0.00 H new ATOM 0 HH21 ARG A 476 -3.511 -7.762 8.093 1.00 0.00 H new ATOM 0 HH22 ARG A 476 -2.867 -8.773 9.391 1.00 0.00 H new ATOM 651 N VAL A 477 0.112 -0.916 5.452 1.00 0.00 N ATOM 652 CA VAL A 477 1.178 -0.034 4.988 1.00 0.00 C ATOM 653 C VAL A 477 2.180 0.249 6.100 1.00 0.00 C ATOM 654 O VAL A 477 1.799 0.498 7.245 1.00 0.00 O ATOM 655 CB VAL A 477 0.620 1.301 4.460 1.00 0.00 C ATOM 656 CG1 VAL A 477 1.754 2.255 4.121 1.00 0.00 C ATOM 657 CG2 VAL A 477 -0.260 1.065 3.243 1.00 0.00 C ATOM 0 H VAL A 477 -0.336 -0.617 6.318 1.00 0.00 H new ATOM 0 HA VAL A 477 1.681 -0.553 4.172 1.00 0.00 H new ATOM 0 HB VAL A 477 0.011 1.754 5.242 1.00 0.00 H new ATOM 0 HG11 VAL A 477 1.342 3.193 3.749 1.00 0.00 H new ATOM 0 HG12 VAL A 477 2.347 2.448 5.015 1.00 0.00 H new ATOM 0 HG13 VAL A 477 2.388 1.809 3.355 1.00 0.00 H new ATOM 0 HG21 VAL A 477 -0.646 2.019 2.883 1.00 0.00 H new ATOM 0 HG22 VAL A 477 0.327 0.590 2.456 1.00 0.00 H new ATOM 0 HG23 VAL A 477 -1.092 0.417 3.516 1.00 0.00 H new ATOM 667 N TYR A 478 3.464 0.211 5.758 1.00 0.00 N ATOM 668 CA TYR A 478 4.522 0.505 6.717 1.00 0.00 C ATOM 669 C TYR A 478 5.314 1.738 6.302 1.00 0.00 C ATOM 670 O TYR A 478 5.478 2.011 5.113 1.00 0.00 O ATOM 671 CB TYR A 478 5.459 -0.695 6.865 1.00 0.00 C ATOM 672 CG TYR A 478 4.773 -1.949 7.358 1.00 0.00 C ATOM 673 CD1 TYR A 478 4.130 -2.804 6.476 1.00 0.00 C ATOM 674 CD2 TYR A 478 4.774 -2.277 8.706 1.00 0.00 C ATOM 675 CE1 TYR A 478 3.503 -3.953 6.920 1.00 0.00 C ATOM 676 CE2 TYR A 478 4.151 -3.422 9.162 1.00 0.00 C ATOM 677 CZ TYR A 478 3.516 -4.258 8.267 1.00 0.00 C ATOM 678 OH TYR A 478 2.894 -5.400 8.716 1.00 0.00 O ATOM 0 H TYR A 478 3.797 -0.021 4.822 1.00 0.00 H new ATOM 0 HA TYR A 478 4.052 0.709 7.679 1.00 0.00 H new ATOM 0 HB2 TYR A 478 5.924 -0.902 5.901 1.00 0.00 H new ATOM 0 HB3 TYR A 478 6.260 -0.435 7.556 1.00 0.00 H new ATOM 0 HD1 TYR A 478 4.119 -2.568 5.422 1.00 0.00 H new ATOM 0 HD2 TYR A 478 5.270 -1.626 9.411 1.00 0.00 H new ATOM 0 HE1 TYR A 478 3.007 -4.607 6.219 1.00 0.00 H new ATOM 0 HE2 TYR A 478 4.161 -3.662 10.215 1.00 0.00 H new ATOM 0 HH TYR A 478 2.997 -5.468 9.688 1.00 0.00 H new ATOM 688 N ILE A 479 5.802 2.481 7.290 1.00 0.00 N ATOM 689 CA ILE A 479 6.789 3.526 7.046 1.00 0.00 C ATOM 690 C ILE A 479 8.080 3.254 7.808 1.00 0.00 C ATOM 691 O ILE A 479 8.094 3.241 9.038 1.00 0.00 O ATOM 692 CB ILE A 479 6.253 4.913 7.441 1.00 0.00 C ATOM 693 CG1 ILE A 479 5.001 5.254 6.627 1.00 0.00 C ATOM 694 CG2 ILE A 479 7.323 5.974 7.243 1.00 0.00 C ATOM 695 CD1 ILE A 479 4.335 6.547 7.042 1.00 0.00 C ATOM 0 H ILE A 479 5.530 2.379 8.268 1.00 0.00 H new ATOM 0 HA ILE A 479 6.995 3.519 5.976 1.00 0.00 H new ATOM 0 HB ILE A 479 5.983 4.891 8.497 1.00 0.00 H new ATOM 0 HG12 ILE A 479 5.271 5.317 5.573 1.00 0.00 H new ATOM 0 HG13 ILE A 479 4.283 4.439 6.724 1.00 0.00 H new ATOM 0 HG21 ILE A 479 6.926 6.949 7.527 1.00 0.00 H new ATOM 0 HG22 ILE A 479 8.188 5.739 7.864 1.00 0.00 H new ATOM 0 HG23 ILE A 479 7.624 5.996 6.196 1.00 0.00 H new ATOM 0 HD11 ILE A 479 3.457 6.720 6.420 1.00 0.00 H new ATOM 0 HD12 ILE A 479 4.033 6.481 8.087 1.00 0.00 H new ATOM 0 HD13 ILE A 479 5.035 7.373 6.918 1.00 0.00 H new ATOM 707 N ASN A 480 9.163 3.037 7.069 1.00 0.00 N ATOM 708 CA ASN A 480 10.451 2.718 7.674 1.00 0.00 C ATOM 709 C ASN A 480 10.340 1.522 8.610 1.00 0.00 C ATOM 710 O ASN A 480 10.924 1.512 9.692 1.00 0.00 O ATOM 711 CB ASN A 480 11.026 3.911 8.414 1.00 0.00 C ATOM 712 CG ASN A 480 11.437 5.042 7.514 1.00 0.00 C ATOM 713 OD1 ASN A 480 11.754 4.841 6.336 1.00 0.00 O ATOM 714 ND2 ASN A 480 11.511 6.218 8.082 1.00 0.00 N ATOM 0 H ASN A 480 9.174 3.076 6.050 1.00 0.00 H new ATOM 0 HA ASN A 480 11.132 2.459 6.863 1.00 0.00 H new ATOM 0 HB2 ASN A 480 10.286 4.276 9.126 1.00 0.00 H new ATOM 0 HB3 ASN A 480 11.891 3.586 8.992 1.00 0.00 H new ATOM 0 HD21 ASN A 480 11.843 7.022 7.549 1.00 0.00 H new ATOM 0 HD22 ASN A 480 11.237 6.331 9.058 1.00 0.00 H new ATOM 721 N GLY A 481 9.585 0.515 8.184 1.00 0.00 N ATOM 722 CA GLY A 481 9.519 -0.751 8.907 1.00 0.00 C ATOM 723 C GLY A 481 8.425 -0.723 9.968 1.00 0.00 C ATOM 724 O GLY A 481 8.073 -1.756 10.537 1.00 0.00 O ATOM 0 H GLY A 481 9.010 0.550 7.342 1.00 0.00 H new ATOM 0 HA2 GLY A 481 9.329 -1.564 8.206 1.00 0.00 H new ATOM 0 HA3 GLY A 481 10.481 -0.955 9.378 1.00 0.00 H new ATOM 728 N THR A 482 7.892 0.465 10.229 1.00 0.00 N ATOM 729 CA THR A 482 6.871 0.637 11.256 1.00 0.00 C ATOM 730 C THR A 482 5.476 0.671 10.645 1.00 0.00 C ATOM 731 O THR A 482 5.249 1.321 9.625 1.00 0.00 O ATOM 732 CB THR A 482 7.096 1.927 12.065 1.00 0.00 C ATOM 733 OG1 THR A 482 8.365 1.864 12.728 1.00 0.00 O ATOM 734 CG2 THR A 482 5.996 2.107 13.101 1.00 0.00 C ATOM 0 H THR A 482 8.150 1.324 9.743 1.00 0.00 H new ATOM 0 HA THR A 482 6.951 -0.220 11.925 1.00 0.00 H new ATOM 0 HB THR A 482 7.078 2.774 11.380 1.00 0.00 H new ATOM 0 HG1 THR A 482 8.507 2.687 13.241 1.00 0.00 H new ATOM 0 HG21 THR A 482 6.172 3.024 13.663 1.00 0.00 H new ATOM 0 HG22 THR A 482 5.030 2.169 12.599 1.00 0.00 H new ATOM 0 HG23 THR A 482 5.997 1.257 13.784 1.00 0.00 H new ATOM 742 N LEU A 483 4.543 -0.037 11.276 1.00 0.00 N ATOM 743 CA LEU A 483 3.170 -0.098 10.790 1.00 0.00 C ATOM 744 C LEU A 483 2.465 1.241 10.961 1.00 0.00 C ATOM 745 O LEU A 483 2.338 1.749 12.075 1.00 0.00 O ATOM 746 CB LEU A 483 2.398 -1.205 11.520 1.00 0.00 C ATOM 747 CG LEU A 483 0.935 -1.374 11.090 1.00 0.00 C ATOM 748 CD1 LEU A 483 0.868 -1.808 9.631 1.00 0.00 C ATOM 749 CD2 LEU A 483 0.256 -2.396 11.989 1.00 0.00 C ATOM 0 H LEU A 483 4.714 -0.576 12.125 1.00 0.00 H new ATOM 0 HA LEU A 483 3.198 -0.329 9.725 1.00 0.00 H new ATOM 0 HB2 LEU A 483 2.917 -2.151 11.365 1.00 0.00 H new ATOM 0 HB3 LEU A 483 2.424 -0.999 12.590 1.00 0.00 H new ATOM 0 HG LEU A 483 0.414 -0.422 11.187 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -0.174 -1.926 9.334 1.00 0.00 H new ATOM 0 HD12 LEU A 483 1.341 -1.052 9.004 1.00 0.00 H new ATOM 0 HD13 LEU A 483 1.389 -2.758 9.510 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -0.783 -2.516 11.683 1.00 0.00 H new ATOM 0 HD22 LEU A 483 0.771 -3.353 11.906 1.00 0.00 H new ATOM 0 HD23 LEU A 483 0.293 -2.053 13.023 1.00 0.00 H new ATOM 761 N TYR A 484 2.007 1.809 9.850 1.00 0.00 N ATOM 762 CA TYR A 484 1.369 3.118 9.866 1.00 0.00 C ATOM 763 C TYR A 484 -0.149 2.990 9.874 1.00 0.00 C ATOM 764 O TYR A 484 -0.841 3.736 10.567 1.00 0.00 O ATOM 765 CB TYR A 484 1.820 3.949 8.664 1.00 0.00 C ATOM 766 CG TYR A 484 0.981 5.183 8.422 1.00 0.00 C ATOM 767 CD1 TYR A 484 1.210 6.353 9.133 1.00 0.00 C ATOM 768 CD2 TYR A 484 -0.039 5.177 7.482 1.00 0.00 C ATOM 769 CE1 TYR A 484 0.445 7.483 8.916 1.00 0.00 C ATOM 770 CE2 TYR A 484 -0.808 6.302 7.255 1.00 0.00 C ATOM 771 CZ TYR A 484 -0.564 7.453 7.975 1.00 0.00 C ATOM 772 OH TYR A 484 -1.327 8.575 7.754 1.00 0.00 O ATOM 0 H TYR A 484 2.067 1.381 8.926 1.00 0.00 H new ATOM 0 HA TYR A 484 1.673 3.626 10.781 1.00 0.00 H new ATOM 0 HB2 TYR A 484 2.857 4.250 8.812 1.00 0.00 H new ATOM 0 HB3 TYR A 484 1.794 3.323 7.772 1.00 0.00 H new ATOM 0 HD1 TYR A 484 2.000 6.381 9.869 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -0.235 4.277 6.918 1.00 0.00 H new ATOM 0 HE1 TYR A 484 0.636 8.384 9.480 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -1.596 6.280 6.517 1.00 0.00 H new ATOM 0 HH TYR A 484 -0.740 9.350 7.631 1.00 0.00 H new ATOM 782 N LYS A 485 -0.661 2.042 9.098 1.00 0.00 N ATOM 783 CA LYS A 485 -2.100 1.897 8.913 1.00 0.00 C ATOM 784 C LYS A 485 -2.437 0.584 8.219 1.00 0.00 C ATOM 785 O LYS A 485 -1.593 -0.009 7.548 1.00 0.00 O ATOM 786 CB LYS A 485 -2.658 3.073 8.111 1.00 0.00 C ATOM 787 CG LYS A 485 -4.176 3.196 8.145 1.00 0.00 C ATOM 788 CD LYS A 485 -4.669 3.564 9.537 1.00 0.00 C ATOM 789 CE LYS A 485 -6.180 3.737 9.561 1.00 0.00 C ATOM 790 NZ LYS A 485 -6.680 4.082 10.920 1.00 0.00 N ATOM 0 H LYS A 485 -0.100 1.361 8.586 1.00 0.00 H new ATOM 0 HA LYS A 485 -2.563 1.890 9.900 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -2.222 3.996 8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -2.337 2.974 7.074 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -4.498 3.954 7.431 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -4.627 2.253 7.835 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -4.379 2.788 10.245 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -4.190 4.487 9.862 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -6.466 4.521 8.860 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -6.656 2.817 9.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -7.714 4.191 10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -6.430 3.323 11.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -6.246 4.974 11.233 1.00 0.00 H new ATOM 804 N ASN A 486 -3.677 0.133 8.385 1.00 0.00 N ATOM 805 CA ASN A 486 -4.135 -1.098 7.754 1.00 0.00 C ATOM 806 C ASN A 486 -5.590 -0.983 7.318 1.00 0.00 C ATOM 807 O ASN A 486 -6.360 -0.211 7.886 1.00 0.00 O ATOM 808 CB ASN A 486 -3.955 -2.291 8.674 1.00 0.00 C ATOM 809 CG ASN A 486 -4.802 -2.234 9.914 1.00 0.00 C ATOM 810 OD1 ASN A 486 -6.023 -2.421 9.865 1.00 0.00 O ATOM 811 ND2 ASN A 486 -4.173 -1.896 11.011 1.00 0.00 N ATOM 0 H ASN A 486 -4.382 0.603 8.952 1.00 0.00 H new ATOM 0 HA ASN A 486 -3.520 -1.256 6.868 1.00 0.00 H new ATOM 0 HB2 ASN A 486 -4.193 -3.201 8.124 1.00 0.00 H new ATOM 0 HB3 ASN A 486 -2.907 -2.359 8.964 1.00 0.00 H new ATOM 0 HD21 ASN A 486 -4.693 -1.775 11.880 1.00 0.00 H new ATOM 0 HD22 ASN A 486 -3.163 -1.754 10.997 1.00 0.00 H new ATOM 818 N TRP A 487 -5.960 -1.759 6.303 1.00 0.00 N ATOM 819 CA TRP A 487 -7.345 -1.821 5.853 1.00 0.00 C ATOM 820 C TRP A 487 -7.768 -3.256 5.568 1.00 0.00 C ATOM 821 O TRP A 487 -6.979 -4.057 5.066 1.00 0.00 O ATOM 822 CB TRP A 487 -7.539 -0.960 4.603 1.00 0.00 C ATOM 823 CG TRP A 487 -7.270 0.497 4.833 1.00 0.00 C ATOM 824 CD1 TRP A 487 -8.186 1.452 5.157 1.00 0.00 C ATOM 825 CD2 TRP A 487 -6.004 1.162 4.759 1.00 0.00 C ATOM 826 NE1 TRP A 487 -7.570 2.672 5.288 1.00 0.00 N ATOM 827 CE2 TRP A 487 -6.228 2.519 5.049 1.00 0.00 C ATOM 828 CE3 TRP A 487 -4.700 0.739 4.475 1.00 0.00 C ATOM 829 CZ2 TRP A 487 -5.206 3.454 5.062 1.00 0.00 C ATOM 830 CZ3 TRP A 487 -3.675 1.677 4.489 1.00 0.00 C ATOM 831 CH2 TRP A 487 -3.920 2.995 4.774 1.00 0.00 C ATOM 0 H TRP A 487 -5.319 -2.353 5.777 1.00 0.00 H new ATOM 0 HA TRP A 487 -7.974 -1.433 6.654 1.00 0.00 H new ATOM 0 HB2 TRP A 487 -6.879 -1.323 3.815 1.00 0.00 H new ATOM 0 HB3 TRP A 487 -8.561 -1.080 4.243 1.00 0.00 H new ATOM 0 HD1 TRP A 487 -9.243 1.275 5.291 1.00 0.00 H new ATOM 0 HE1 TRP A 487 -8.034 3.549 5.524 1.00 0.00 H new ATOM 0 HE3 TRP A 487 -4.495 -0.297 4.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 487 -5.396 4.493 5.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 487 -2.665 1.361 4.271 1.00 0.00 H new ATOM 0 HH2 TRP A 487 -3.098 3.695 4.776 1.00 0.00 H new ATOM 842 N THR A 488 -9.017 -3.576 5.891 1.00 0.00 N ATOM 843 CA THR A 488 -9.619 -4.834 5.469 1.00 0.00 C ATOM 844 C THR A 488 -10.634 -4.613 4.356 1.00 0.00 C ATOM 845 O THR A 488 -11.568 -3.823 4.501 1.00 0.00 O ATOM 846 CB THR A 488 -10.309 -5.552 6.644 1.00 0.00 C ATOM 847 OG1 THR A 488 -9.343 -5.838 7.665 1.00 0.00 O ATOM 848 CG2 THR A 488 -10.945 -6.852 6.176 1.00 0.00 C ATOM 0 H THR A 488 -9.632 -2.980 6.445 1.00 0.00 H new ATOM 0 HA THR A 488 -8.808 -5.461 5.098 1.00 0.00 H new ATOM 0 HB THR A 488 -11.088 -4.901 7.041 1.00 0.00 H new ATOM 0 HG1 THR A 488 -9.783 -6.293 8.413 1.00 0.00 H new ATOM 0 HG21 THR A 488 -11.428 -7.345 7.020 1.00 0.00 H new ATOM 0 HG22 THR A 488 -11.688 -6.638 5.408 1.00 0.00 H new ATOM 0 HG23 THR A 488 -10.176 -7.506 5.765 1.00 0.00 H new ATOM 856 N VAL A 489 -10.449 -5.316 3.243 1.00 0.00 N ATOM 857 CA VAL A 489 -11.334 -5.178 2.092 1.00 0.00 C ATOM 858 C VAL A 489 -11.626 -6.530 1.457 1.00 0.00 C ATOM 859 O VAL A 489 -10.981 -7.530 1.776 1.00 0.00 O ATOM 860 CB VAL A 489 -10.734 -4.240 1.028 1.00 0.00 C ATOM 861 CG1 VAL A 489 -10.516 -2.849 1.606 1.00 0.00 C ATOM 862 CG2 VAL A 489 -9.426 -4.804 0.497 1.00 0.00 C ATOM 0 H VAL A 489 -9.693 -5.988 3.114 1.00 0.00 H new ATOM 0 HA VAL A 489 -12.264 -4.746 2.461 1.00 0.00 H new ATOM 0 HB VAL A 489 -11.439 -4.164 0.200 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -10.092 -2.199 0.841 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -11.470 -2.441 1.941 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -9.831 -2.910 2.451 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -9.016 -4.128 -0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -8.716 -4.909 1.317 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -9.607 -5.780 0.046 1.00 0.00 H new ATOM 872 N SER A 490 -12.601 -6.556 0.555 1.00 0.00 N ATOM 873 CA SER A 490 -12.874 -7.745 -0.243 1.00 0.00 C ATOM 874 C SER A 490 -12.723 -7.456 -1.730 1.00 0.00 C ATOM 875 O SER A 490 -13.087 -6.379 -2.203 1.00 0.00 O ATOM 876 CB SER A 490 -14.267 -8.265 0.056 1.00 0.00 C ATOM 877 OG SER A 490 -14.410 -8.652 1.394 1.00 0.00 O ATOM 0 H SER A 490 -13.216 -5.766 0.358 1.00 0.00 H new ATOM 0 HA SER A 490 -12.145 -8.510 0.025 1.00 0.00 H new ATOM 0 HB2 SER A 490 -15.000 -7.492 -0.177 1.00 0.00 H new ATOM 0 HB3 SER A 490 -14.483 -9.115 -0.592 1.00 0.00 H new ATOM 0 HG SER A 490 -13.636 -9.190 1.663 1.00 0.00 H new ATOM 883 N LEU A 491 -12.185 -8.423 -2.465 1.00 0.00 N ATOM 884 CA LEU A 491 -11.979 -8.272 -3.900 1.00 0.00 C ATOM 885 C LEU A 491 -12.571 -9.445 -4.669 1.00 0.00 C ATOM 886 O LEU A 491 -12.331 -10.604 -4.334 1.00 0.00 O ATOM 887 CB LEU A 491 -10.482 -8.134 -4.209 1.00 0.00 C ATOM 888 CG LEU A 491 -9.806 -6.890 -3.618 1.00 0.00 C ATOM 889 CD1 LEU A 491 -8.299 -6.968 -3.821 1.00 0.00 C ATOM 890 CD2 LEU A 491 -10.374 -5.640 -4.276 1.00 0.00 C ATOM 0 H LEU A 491 -11.883 -9.322 -2.089 1.00 0.00 H new ATOM 0 HA LEU A 491 -12.493 -7.366 -4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -9.967 -9.019 -3.836 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -10.350 -8.120 -5.291 1.00 0.00 H new ATOM 0 HG LEU A 491 -10.004 -6.844 -2.547 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -7.828 -6.080 -3.398 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -7.910 -7.857 -3.324 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -8.078 -7.023 -4.887 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -9.893 -4.757 -3.855 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -10.189 -5.678 -5.349 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -11.448 -5.589 -4.095 1.00 0.00 H new ATOM 902 N GLY A 492 -13.349 -9.136 -5.702 1.00 0.00 N ATOM 903 CA GLY A 492 -13.874 -10.159 -6.599 1.00 0.00 C ATOM 904 C GLY A 492 -12.931 -10.400 -7.771 1.00 0.00 C ATOM 905 O GLY A 492 -11.808 -9.896 -7.790 1.00 0.00 O ATOM 0 H GLY A 492 -13.630 -8.184 -5.938 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -14.020 -11.089 -6.049 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -14.851 -9.853 -6.972 1.00 0.00 H new ATOM 909 N PRO A 493 -13.394 -11.176 -8.745 1.00 0.00 N ATOM 910 CA PRO A 493 -12.617 -11.433 -9.952 1.00 0.00 C ATOM 911 C PRO A 493 -12.371 -10.148 -10.733 1.00 0.00 C ATOM 912 O PRO A 493 -13.304 -9.544 -11.267 1.00 0.00 O ATOM 913 CB PRO A 493 -13.471 -12.430 -10.741 1.00 0.00 C ATOM 914 CG PRO A 493 -14.856 -12.223 -10.226 1.00 0.00 C ATOM 915 CD PRO A 493 -14.692 -11.878 -8.770 1.00 0.00 C ATOM 0 HA PRO A 493 -11.624 -11.827 -9.738 1.00 0.00 H new ATOM 0 HB2 PRO A 493 -13.414 -12.241 -11.813 1.00 0.00 H new ATOM 0 HB3 PRO A 493 -13.136 -13.455 -10.580 1.00 0.00 H new ATOM 0 HG2 PRO A 493 -15.360 -11.421 -10.766 1.00 0.00 H new ATOM 0 HG3 PRO A 493 -15.461 -13.121 -10.352 1.00 0.00 H new ATOM 0 HD2 PRO A 493 -15.502 -11.243 -8.411 1.00 0.00 H new ATOM 0 HD3 PRO A 493 -14.682 -12.769 -8.142 1.00 0.00 H new ATOM 923 N LYS A 494 -11.111 -9.732 -10.798 1.00 0.00 N ATOM 924 CA LYS A 494 -10.731 -8.551 -11.563 1.00 0.00 C ATOM 925 C LYS A 494 -11.341 -7.289 -10.967 1.00 0.00 C ATOM 926 O LYS A 494 -11.712 -6.366 -11.693 1.00 0.00 O ATOM 927 CB LYS A 494 -11.156 -8.701 -13.025 1.00 0.00 C ATOM 928 CG LYS A 494 -10.578 -9.923 -13.726 1.00 0.00 C ATOM 929 CD LYS A 494 -10.977 -9.960 -15.193 1.00 0.00 C ATOM 930 CE LYS A 494 -10.476 -11.228 -15.873 1.00 0.00 C ATOM 931 NZ LYS A 494 -10.839 -11.267 -17.315 1.00 0.00 N ATOM 0 H LYS A 494 -10.334 -10.197 -10.329 1.00 0.00 H new ATOM 0 HA LYS A 494 -9.646 -8.459 -11.517 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -12.244 -8.752 -13.071 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -10.855 -7.807 -13.572 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -9.491 -9.912 -13.643 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -10.927 -10.828 -13.229 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -12.062 -9.904 -15.278 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -10.572 -9.087 -15.704 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -9.393 -11.291 -15.770 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -10.895 -12.099 -15.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -10.480 -12.146 -17.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -11.874 -11.233 -17.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -10.418 -10.450 -17.801 1.00 0.00 H new ATOM 945 N GLU A 495 -11.444 -7.255 -9.643 1.00 0.00 N ATOM 946 CA GLU A 495 -11.927 -6.071 -8.941 1.00 0.00 C ATOM 947 C GLU A 495 -10.774 -5.282 -8.335 1.00 0.00 C ATOM 948 O GLU A 495 -9.797 -5.858 -7.857 1.00 0.00 O ATOM 949 CB GLU A 495 -12.925 -6.466 -7.850 1.00 0.00 C ATOM 950 CG GLU A 495 -13.550 -5.289 -7.116 1.00 0.00 C ATOM 951 CD GLU A 495 -14.639 -5.743 -6.185 1.00 0.00 C ATOM 952 OE1 GLU A 495 -14.944 -6.912 -6.182 1.00 0.00 O ATOM 953 OE2 GLU A 495 -15.090 -4.946 -5.397 1.00 0.00 O ATOM 0 H GLU A 495 -11.199 -8.035 -9.033 1.00 0.00 H new ATOM 0 HA GLU A 495 -12.431 -5.434 -9.668 1.00 0.00 H new ATOM 0 HB2 GLU A 495 -13.719 -7.062 -8.299 1.00 0.00 H new ATOM 0 HB3 GLU A 495 -12.419 -7.104 -7.125 1.00 0.00 H new ATOM 0 HG2 GLU A 495 -12.782 -4.761 -6.551 1.00 0.00 H new ATOM 0 HG3 GLU A 495 -13.957 -4.582 -7.838 1.00 0.00 H new ATOM 960 N GLU A 496 -10.894 -3.959 -8.359 1.00 0.00 N ATOM 961 CA GLU A 496 -9.880 -3.087 -7.778 1.00 0.00 C ATOM 962 C GLU A 496 -10.481 -2.173 -6.718 1.00 0.00 C ATOM 963 O GLU A 496 -11.597 -1.677 -6.873 1.00 0.00 O ATOM 964 CB GLU A 496 -9.201 -2.254 -8.867 1.00 0.00 C ATOM 965 CG GLU A 496 -8.122 -1.310 -8.356 1.00 0.00 C ATOM 966 CD GLU A 496 -7.497 -0.533 -9.482 1.00 0.00 C ATOM 967 OE1 GLU A 496 -7.950 -0.667 -10.594 1.00 0.00 O ATOM 968 OE2 GLU A 496 -6.642 0.277 -9.215 1.00 0.00 O ATOM 0 H GLU A 496 -11.684 -3.467 -8.775 1.00 0.00 H new ATOM 0 HA GLU A 496 -9.133 -3.719 -7.299 1.00 0.00 H new ATOM 0 HB2 GLU A 496 -8.759 -2.928 -9.600 1.00 0.00 H new ATOM 0 HB3 GLU A 496 -9.960 -1.670 -9.387 1.00 0.00 H new ATOM 0 HG2 GLU A 496 -8.553 -0.620 -7.631 1.00 0.00 H new ATOM 0 HG3 GLU A 496 -7.353 -1.881 -7.835 1.00 0.00 H new ATOM 975 N LYS A 497 -9.735 -1.953 -5.641 1.00 0.00 N ATOM 976 CA LYS A 497 -10.156 -1.032 -4.592 1.00 0.00 C ATOM 977 C LYS A 497 -9.072 -0.002 -4.297 1.00 0.00 C ATOM 978 O LYS A 497 -7.881 -0.299 -4.379 1.00 0.00 O ATOM 979 CB LYS A 497 -10.515 -1.798 -3.318 1.00 0.00 C ATOM 980 CG LYS A 497 -11.790 -2.626 -3.420 1.00 0.00 C ATOM 981 CD LYS A 497 -13.024 -1.738 -3.469 1.00 0.00 C ATOM 982 CE LYS A 497 -13.266 -1.052 -2.133 1.00 0.00 C ATOM 983 NZ LYS A 497 -14.391 -0.080 -2.201 1.00 0.00 N ATOM 0 H LYS A 497 -8.834 -2.401 -5.472 1.00 0.00 H new ATOM 0 HA LYS A 497 -11.041 -0.504 -4.947 1.00 0.00 H new ATOM 0 HB2 LYS A 497 -9.687 -2.458 -3.060 1.00 0.00 H new ATOM 0 HB3 LYS A 497 -10.623 -1.087 -2.499 1.00 0.00 H new ATOM 0 HG2 LYS A 497 -11.751 -3.248 -4.314 1.00 0.00 H new ATOM 0 HG3 LYS A 497 -11.858 -3.300 -2.566 1.00 0.00 H new ATOM 0 HD2 LYS A 497 -12.903 -0.987 -4.249 1.00 0.00 H new ATOM 0 HD3 LYS A 497 -13.895 -2.337 -3.736 1.00 0.00 H new ATOM 0 HE2 LYS A 497 -13.482 -1.803 -1.373 1.00 0.00 H new ATOM 0 HE3 LYS A 497 -12.358 -0.535 -1.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 -14.522 0.365 -1.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 -14.175 0.652 -2.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 -15.263 -0.577 -2.473 1.00 0.00 H new ATOM 997 N VAL A 498 -9.495 1.211 -3.952 1.00 0.00 N ATOM 998 CA VAL A 498 -8.561 2.299 -3.688 1.00 0.00 C ATOM 999 C VAL A 498 -8.579 2.695 -2.217 1.00 0.00 C ATOM 1000 O VAL A 498 -9.612 3.105 -1.688 1.00 0.00 O ATOM 1001 CB VAL A 498 -8.880 3.537 -4.547 1.00 0.00 C ATOM 1002 CG1 VAL A 498 -7.914 4.668 -4.231 1.00 0.00 C ATOM 1003 CG2 VAL A 498 -8.824 3.188 -6.027 1.00 0.00 C ATOM 0 H VAL A 498 -10.478 1.464 -3.849 1.00 0.00 H new ATOM 0 HA VAL A 498 -7.568 1.932 -3.950 1.00 0.00 H new ATOM 0 HB VAL A 498 -9.890 3.870 -4.309 1.00 0.00 H new ATOM 0 HG11 VAL A 498 -8.154 5.534 -4.847 1.00 0.00 H new ATOM 0 HG12 VAL A 498 -8.000 4.936 -3.178 1.00 0.00 H new ATOM 0 HG13 VAL A 498 -6.894 4.345 -4.441 1.00 0.00 H new ATOM 0 HG21 VAL A 498 -9.052 4.075 -6.619 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -7.826 2.830 -6.279 1.00 0.00 H new ATOM 0 HG23 VAL A 498 -9.554 2.409 -6.245 1.00 0.00 H new ATOM 1013 N LEU A 499 -7.430 2.571 -1.563 1.00 0.00 N ATOM 1014 CA LEU A 499 -7.288 3.001 -0.177 1.00 0.00 C ATOM 1015 C LEU A 499 -6.551 4.331 -0.085 1.00 0.00 C ATOM 1016 O LEU A 499 -5.613 4.585 -0.841 1.00 0.00 O ATOM 1017 CB LEU A 499 -6.554 1.929 0.637 1.00 0.00 C ATOM 1018 CG LEU A 499 -7.130 0.511 0.521 1.00 0.00 C ATOM 1019 CD1 LEU A 499 -6.215 -0.483 1.221 1.00 0.00 C ATOM 1020 CD2 LEU A 499 -8.526 0.479 1.123 1.00 0.00 C ATOM 0 H LEU A 499 -6.583 2.176 -1.971 1.00 0.00 H new ATOM 0 HA LEU A 499 -8.286 3.141 0.238 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -5.511 1.907 0.321 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -6.563 2.223 1.687 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.196 0.229 -0.530 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -6.632 -1.486 1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -5.229 -0.458 0.758 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -6.128 -0.217 2.275 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -8.935 -0.528 1.040 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -8.476 0.765 2.174 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -9.169 1.177 0.587 1.00 0.00 H new ATOM 1032 N THR A 500 -6.982 5.177 0.842 1.00 0.00 N ATOM 1033 CA THR A 500 -6.354 6.477 1.046 1.00 0.00 C ATOM 1034 C THR A 500 -5.854 6.629 2.478 1.00 0.00 C ATOM 1035 O THR A 500 -6.392 6.019 3.401 1.00 0.00 O ATOM 1036 CB THR A 500 -7.323 7.630 0.726 1.00 0.00 C ATOM 1037 OG1 THR A 500 -8.500 7.506 1.535 1.00 0.00 O ATOM 1038 CG2 THR A 500 -7.716 7.604 -0.742 1.00 0.00 C ATOM 0 H THR A 500 -7.766 4.986 1.466 1.00 0.00 H new ATOM 0 HA THR A 500 -5.507 6.527 0.362 1.00 0.00 H new ATOM 0 HB THR A 500 -6.824 8.575 0.941 1.00 0.00 H new ATOM 0 HG1 THR A 500 -9.115 8.241 1.332 1.00 0.00 H new ATOM 0 HG21 THR A 500 -8.401 8.426 -0.950 1.00 0.00 H new ATOM 0 HG22 THR A 500 -6.824 7.710 -1.359 1.00 0.00 H new ATOM 0 HG23 THR A 500 -8.205 6.657 -0.971 1.00 0.00 H new ATOM 1046 N PHE A 501 -4.822 7.446 2.655 1.00 0.00 N ATOM 1047 CA PHE A 501 -4.393 7.863 3.985 1.00 0.00 C ATOM 1048 C PHE A 501 -3.654 9.193 3.935 1.00 0.00 C ATOM 1049 O PHE A 501 -3.117 9.577 2.896 1.00 0.00 O ATOM 1050 CB PHE A 501 -3.505 6.791 4.619 1.00 0.00 C ATOM 1051 CG PHE A 501 -2.236 6.527 3.859 1.00 0.00 C ATOM 1052 CD1 PHE A 501 -1.085 7.252 4.132 1.00 0.00 C ATOM 1053 CD2 PHE A 501 -2.191 5.556 2.870 1.00 0.00 C ATOM 1054 CE1 PHE A 501 0.082 7.012 3.433 1.00 0.00 C ATOM 1055 CE2 PHE A 501 -1.024 5.312 2.172 1.00 0.00 C ATOM 1056 CZ PHE A 501 0.113 6.041 2.454 1.00 0.00 C ATOM 0 H PHE A 501 -4.266 7.833 1.893 1.00 0.00 H new ATOM 0 HA PHE A 501 -5.285 7.994 4.598 1.00 0.00 H new ATOM 0 HB2 PHE A 501 -3.252 7.096 5.635 1.00 0.00 H new ATOM 0 HB3 PHE A 501 -4.071 5.863 4.696 1.00 0.00 H new ATOM 0 HD1 PHE A 501 -1.102 8.012 4.899 1.00 0.00 H new ATOM 0 HD2 PHE A 501 -3.078 4.984 2.643 1.00 0.00 H new ATOM 0 HE1 PHE A 501 0.971 7.585 3.653 1.00 0.00 H new ATOM 0 HE2 PHE A 501 -1.002 4.551 1.406 1.00 0.00 H new ATOM 0 HZ PHE A 501 1.026 5.852 1.909 1.00 0.00 H new ATOM 1066 N SER A 502 -3.629 9.894 5.063 1.00 0.00 N ATOM 1067 CA SER A 502 -3.045 11.228 5.124 1.00 0.00 C ATOM 1068 C SER A 502 -1.896 11.281 6.124 1.00 0.00 C ATOM 1069 O SER A 502 -2.042 10.867 7.274 1.00 0.00 O ATOM 1070 CB SER A 502 -4.108 12.247 5.487 1.00 0.00 C ATOM 1071 OG SER A 502 -5.095 12.354 4.498 1.00 0.00 O ATOM 0 H SER A 502 -4.007 9.559 5.949 1.00 0.00 H new ATOM 0 HA SER A 502 -2.644 11.469 4.139 1.00 0.00 H new ATOM 0 HB2 SER A 502 -4.572 11.965 6.432 1.00 0.00 H new ATOM 0 HB3 SER A 502 -3.640 13.220 5.639 1.00 0.00 H new ATOM 0 HG SER A 502 -5.761 13.019 4.771 1.00 0.00 H new ATOM 1077 N TRP A 503 -0.754 11.792 5.676 1.00 0.00 N ATOM 1078 CA TRP A 503 0.462 11.766 6.479 1.00 0.00 C ATOM 1079 C TRP A 503 1.118 13.139 6.531 1.00 0.00 C ATOM 1080 O TRP A 503 1.328 13.776 5.498 1.00 0.00 O ATOM 1081 CB TRP A 503 1.445 10.734 5.922 1.00 0.00 C ATOM 1082 CG TRP A 503 2.772 10.735 6.621 1.00 0.00 C ATOM 1083 CD1 TRP A 503 2.985 10.807 7.965 1.00 0.00 C ATOM 1084 CD2 TRP A 503 4.066 10.661 6.010 1.00 0.00 C ATOM 1085 NE1 TRP A 503 4.332 10.783 8.230 1.00 0.00 N ATOM 1086 CE2 TRP A 503 5.018 10.693 7.045 1.00 0.00 C ATOM 1087 CE3 TRP A 503 4.512 10.570 4.685 1.00 0.00 C ATOM 1088 CZ2 TRP A 503 6.381 10.639 6.803 1.00 0.00 C ATOM 1089 CZ3 TRP A 503 5.879 10.513 4.443 1.00 0.00 C ATOM 1090 CH2 TRP A 503 6.787 10.546 5.471 1.00 0.00 C ATOM 0 H TRP A 503 -0.646 12.229 4.761 1.00 0.00 H new ATOM 0 HA TRP A 503 0.186 11.483 7.495 1.00 0.00 H new ATOM 0 HB2 TRP A 503 1.002 9.741 6.002 1.00 0.00 H new ATOM 0 HB3 TRP A 503 1.602 10.929 4.861 1.00 0.00 H new ATOM 0 HD1 TRP A 503 2.208 10.873 8.712 1.00 0.00 H new ATOM 0 HE1 TRP A 503 4.754 10.825 9.157 1.00 0.00 H new ATOM 0 HE3 TRP A 503 3.807 10.545 3.867 1.00 0.00 H new ATOM 0 HZ2 TRP A 503 7.098 10.668 7.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 503 6.234 10.441 3.425 1.00 0.00 H new ATOM 0 HH2 TRP A 503 7.842 10.499 5.244 1.00 0.00 H new ATOM 1101 N THR A 504 1.439 13.592 7.737 1.00 0.00 N ATOM 1102 CA THR A 504 2.211 14.815 7.916 1.00 0.00 C ATOM 1103 C THR A 504 3.544 14.532 8.596 1.00 0.00 C ATOM 1104 O THR A 504 3.589 14.211 9.786 1.00 0.00 O ATOM 1105 CB THR A 504 1.436 15.856 8.744 1.00 0.00 C ATOM 1106 OG1 THR A 504 0.225 16.209 8.060 1.00 0.00 O ATOM 1107 CG2 THR A 504 2.276 17.107 8.952 1.00 0.00 C ATOM 0 H THR A 504 1.176 13.129 8.607 1.00 0.00 H new ATOM 0 HA THR A 504 2.394 15.218 6.920 1.00 0.00 H new ATOM 0 HB THR A 504 1.202 15.422 9.716 1.00 0.00 H new ATOM 0 HG1 THR A 504 -0.268 16.870 8.589 1.00 0.00 H new ATOM 0 HG21 THR A 504 1.711 17.831 9.539 1.00 0.00 H new ATOM 0 HG22 THR A 504 3.192 16.846 9.481 1.00 0.00 H new ATOM 0 HG23 THR A 504 2.527 17.542 7.984 1.00 0.00 H new ATOM 1115 N PRO A 505 4.628 14.651 7.838 1.00 0.00 N ATOM 1116 CA PRO A 505 5.970 14.512 8.392 1.00 0.00 C ATOM 1117 C PRO A 505 6.364 15.743 9.198 1.00 0.00 C ATOM 1118 O PRO A 505 5.847 16.837 8.970 1.00 0.00 O ATOM 1119 CB PRO A 505 6.864 14.317 7.163 1.00 0.00 C ATOM 1120 CG PRO A 505 6.181 15.085 6.082 1.00 0.00 C ATOM 1121 CD PRO A 505 4.708 14.931 6.352 1.00 0.00 C ATOM 0 HA PRO A 505 6.054 13.680 9.092 1.00 0.00 H new ATOM 0 HB2 PRO A 505 7.872 14.692 7.341 1.00 0.00 H new ATOM 0 HB3 PRO A 505 6.958 13.263 6.903 1.00 0.00 H new ATOM 0 HG2 PRO A 505 6.476 16.134 6.099 1.00 0.00 H new ATOM 0 HG3 PRO A 505 6.443 14.696 5.098 1.00 0.00 H new ATOM 0 HD2 PRO A 505 4.158 15.834 6.087 1.00 0.00 H new ATOM 0 HD3 PRO A 505 4.280 14.115 5.770 1.00 0.00 H new ATOM 1129 N THR A 506 7.281 15.557 10.141 1.00 0.00 N ATOM 1130 CA THR A 506 7.726 16.648 11.002 1.00 0.00 C ATOM 1131 C THR A 506 9.240 16.803 10.955 1.00 0.00 C ATOM 1132 O THR A 506 9.789 17.779 11.466 1.00 0.00 O ATOM 1133 CB THR A 506 7.287 16.429 12.461 1.00 0.00 C ATOM 1134 OG1 THR A 506 7.810 15.183 12.939 1.00 0.00 O ATOM 1135 CG2 THR A 506 5.769 16.409 12.564 1.00 0.00 C ATOM 0 H THR A 506 7.731 14.661 10.329 1.00 0.00 H new ATOM 0 HA THR A 506 7.259 17.558 10.624 1.00 0.00 H new ATOM 0 HB THR A 506 7.672 17.249 13.067 1.00 0.00 H new ATOM 0 HG1 THR A 506 7.531 15.046 13.868 1.00 0.00 H new ATOM 0 HG21 THR A 506 5.477 16.253 13.602 1.00 0.00 H new ATOM 0 HG22 THR A 506 5.368 17.360 12.213 1.00 0.00 H new ATOM 0 HG23 THR A 506 5.373 15.600 11.950 1.00 0.00 H new ATOM 1143 N GLN A 507 9.912 15.834 10.341 1.00 0.00 N ATOM 1144 CA GLN A 507 11.362 15.875 10.203 1.00 0.00 C ATOM 1145 C GLN A 507 11.787 15.620 8.763 1.00 0.00 C ATOM 1146 O GLN A 507 11.266 14.721 8.102 1.00 0.00 O ATOM 1147 CB GLN A 507 12.018 14.844 11.126 1.00 0.00 C ATOM 1148 CG GLN A 507 13.537 14.850 11.086 1.00 0.00 C ATOM 1149 CD GLN A 507 14.146 13.886 12.087 1.00 0.00 C ATOM 1150 OE1 GLN A 507 13.430 13.195 12.818 1.00 0.00 O ATOM 1151 NE2 GLN A 507 15.471 13.836 12.127 1.00 0.00 N ATOM 0 H GLN A 507 9.474 15.010 9.931 1.00 0.00 H new ATOM 0 HA GLN A 507 11.693 16.874 10.488 1.00 0.00 H new ATOM 0 HB2 GLN A 507 11.692 15.030 12.149 1.00 0.00 H new ATOM 0 HB3 GLN A 507 11.662 13.850 10.853 1.00 0.00 H new ATOM 0 HG2 GLN A 507 13.872 14.587 10.083 1.00 0.00 H new ATOM 0 HG3 GLN A 507 13.899 15.858 11.290 1.00 0.00 H new ATOM 0 HE21 GLN A 507 16.023 14.426 11.504 1.00 0.00 H new ATOM 0 HE22 GLN A 507 15.938 13.208 12.781 1.00 0.00 H new ATOM 1160 N GLU A 508 12.736 16.414 8.281 1.00 0.00 N ATOM 1161 CA GLU A 508 13.303 16.214 6.953 1.00 0.00 C ATOM 1162 C GLU A 508 14.183 14.970 6.911 1.00 0.00 C ATOM 1163 O GLU A 508 14.888 14.667 7.873 1.00 0.00 O ATOM 1164 CB GLU A 508 14.107 17.442 6.522 1.00 0.00 C ATOM 1165 CG GLU A 508 15.296 17.762 7.418 1.00 0.00 C ATOM 1166 CD GLU A 508 16.203 18.778 6.781 1.00 0.00 C ATOM 1167 OE1 GLU A 508 15.948 19.155 5.663 1.00 0.00 O ATOM 1168 OE2 GLU A 508 17.084 19.260 7.453 1.00 0.00 O ATOM 0 H GLU A 508 13.130 17.204 8.792 1.00 0.00 H new ATOM 0 HA GLU A 508 12.477 16.071 6.257 1.00 0.00 H new ATOM 0 HB2 GLU A 508 14.466 17.287 5.504 1.00 0.00 H new ATOM 0 HB3 GLU A 508 13.443 18.306 6.498 1.00 0.00 H new ATOM 0 HG2 GLU A 508 14.940 18.139 8.377 1.00 0.00 H new ATOM 0 HG3 GLU A 508 15.856 16.849 7.623 1.00 0.00 H new ATOM 1175 N GLY A 509 14.134 14.256 5.793 1.00 0.00 N ATOM 1176 CA GLY A 509 14.886 13.015 5.645 1.00 0.00 C ATOM 1177 C GLY A 509 14.238 12.099 4.614 1.00 0.00 C ATOM 1178 O GLY A 509 13.161 12.394 4.097 1.00 0.00 O ATOM 0 H GLY A 509 13.582 14.515 4.975 1.00 0.00 H new ATOM 0 HA2 GLY A 509 15.909 13.240 5.344 1.00 0.00 H new ATOM 0 HA3 GLY A 509 14.942 12.504 6.606 1.00 0.00 H new ATOM 1182 N MET A 510 14.902 10.987 4.318 1.00 0.00 N ATOM 1183 CA MET A 510 14.346 9.979 3.424 1.00 0.00 C ATOM 1184 C MET A 510 13.421 9.028 4.173 1.00 0.00 C ATOM 1185 O MET A 510 13.809 8.431 5.178 1.00 0.00 O ATOM 1186 CB MET A 510 15.470 9.195 2.747 1.00 0.00 C ATOM 1187 CG MET A 510 16.321 10.018 1.788 1.00 0.00 C ATOM 1188 SD MET A 510 15.355 10.735 0.445 1.00 0.00 S ATOM 1189 CE MET A 510 14.898 9.263 -0.465 1.00 0.00 C ATOM 0 H MET A 510 15.827 10.761 4.685 1.00 0.00 H new ATOM 0 HA MET A 510 13.759 10.492 2.662 1.00 0.00 H new ATOM 0 HB2 MET A 510 16.116 8.772 3.516 1.00 0.00 H new ATOM 0 HB3 MET A 510 15.035 8.358 2.201 1.00 0.00 H new ATOM 0 HG2 MET A 510 16.816 10.816 2.341 1.00 0.00 H new ATOM 0 HG3 MET A 510 17.105 9.386 1.370 1.00 0.00 H new ATOM 0 HE1 MET A 510 14.516 9.546 -1.446 1.00 0.00 H new ATOM 0 HE2 MET A 510 15.773 8.624 -0.586 1.00 0.00 H new ATOM 0 HE3 MET A 510 14.126 8.722 0.082 1.00 0.00 H new ATOM 1199 N TYR A 511 12.195 8.891 3.680 1.00 0.00 N ATOM 1200 CA TYR A 511 11.234 7.961 4.259 1.00 0.00 C ATOM 1201 C TYR A 511 10.800 6.914 3.243 1.00 0.00 C ATOM 1202 O TYR A 511 10.454 7.242 2.108 1.00 0.00 O ATOM 1203 CB TYR A 511 10.013 8.715 4.792 1.00 0.00 C ATOM 1204 CG TYR A 511 10.314 9.619 5.966 1.00 0.00 C ATOM 1205 CD1 TYR A 511 10.837 10.889 5.771 1.00 0.00 C ATOM 1206 CD2 TYR A 511 10.073 9.200 7.266 1.00 0.00 C ATOM 1207 CE1 TYR A 511 11.115 11.719 6.841 1.00 0.00 C ATOM 1208 CE2 TYR A 511 10.346 10.023 8.342 1.00 0.00 C ATOM 1209 CZ TYR A 511 10.867 11.281 8.125 1.00 0.00 C ATOM 1210 OH TYR A 511 11.139 12.104 9.194 1.00 0.00 O ATOM 0 H TYR A 511 11.843 9.414 2.878 1.00 0.00 H new ATOM 0 HA TYR A 511 11.723 7.449 5.088 1.00 0.00 H new ATOM 0 HB2 TYR A 511 9.587 9.313 3.986 1.00 0.00 H new ATOM 0 HB3 TYR A 511 9.253 7.992 5.088 1.00 0.00 H new ATOM 0 HD1 TYR A 511 11.030 11.235 4.766 1.00 0.00 H new ATOM 0 HD2 TYR A 511 9.666 8.215 7.440 1.00 0.00 H new ATOM 0 HE1 TYR A 511 11.524 12.704 6.672 1.00 0.00 H new ATOM 0 HE2 TYR A 511 10.152 9.682 9.348 1.00 0.00 H new ATOM 0 HH TYR A 511 11.198 13.032 8.885 1.00 0.00 H new ATOM 1220 N ARG A 512 10.819 5.652 3.657 1.00 0.00 N ATOM 1221 CA ARG A 512 10.436 4.550 2.780 1.00 0.00 C ATOM 1222 C ARG A 512 9.058 4.014 3.139 1.00 0.00 C ATOM 1223 O ARG A 512 8.839 3.528 4.250 1.00 0.00 O ATOM 1224 CB ARG A 512 11.478 3.443 2.762 1.00 0.00 C ATOM 1225 CG ARG A 512 11.225 2.343 1.742 1.00 0.00 C ATOM 1226 CD ARG A 512 12.321 1.348 1.631 1.00 0.00 C ATOM 1227 NE ARG A 512 12.466 0.479 2.789 1.00 0.00 N ATOM 1228 CZ ARG A 512 13.470 -0.402 2.962 1.00 0.00 C ATOM 1229 NH1 ARG A 512 14.396 -0.565 2.045 1.00 0.00 N ATOM 1230 NH2 ARG A 512 13.485 -1.118 4.073 1.00 0.00 N ATOM 0 H ARG A 512 11.096 5.366 4.596 1.00 0.00 H new ATOM 0 HA ARG A 512 10.384 4.949 1.767 1.00 0.00 H new ATOM 0 HB2 ARG A 512 12.454 3.886 2.563 1.00 0.00 H new ATOM 0 HB3 ARG A 512 11.528 2.994 3.754 1.00 0.00 H new ATOM 0 HG2 ARG A 512 10.304 1.823 2.006 1.00 0.00 H new ATOM 0 HG3 ARG A 512 11.064 2.799 0.765 1.00 0.00 H new ATOM 0 HD2 ARG A 512 12.147 0.731 0.749 1.00 0.00 H new ATOM 0 HD3 ARG A 512 13.260 1.877 1.470 1.00 0.00 H new ATOM 0 HE ARG A 512 11.758 0.541 3.521 1.00 0.00 H new ATOM 0 HH11 ARG A 512 14.363 -0.019 1.184 1.00 0.00 H new ATOM 0 HH12 ARG A 512 15.149 -1.237 2.194 1.00 0.00 H new ATOM 0 HH21 ARG A 512 12.750 -0.995 4.769 1.00 0.00 H new ATOM 0 HH22 ARG A 512 14.232 -1.794 4.234 1.00 0.00 H new ATOM 1244 N ILE A 513 8.128 4.101 2.194 1.00 0.00 N ATOM 1245 CA ILE A 513 6.773 3.609 2.403 1.00 0.00 C ATOM 1246 C ILE A 513 6.547 2.293 1.673 1.00 0.00 C ATOM 1247 O ILE A 513 6.742 2.202 0.462 1.00 0.00 O ATOM 1248 CB ILE A 513 5.721 4.631 1.935 1.00 0.00 C ATOM 1249 CG1 ILE A 513 5.877 5.947 2.702 1.00 0.00 C ATOM 1250 CG2 ILE A 513 4.317 4.072 2.115 1.00 0.00 C ATOM 1251 CD1 ILE A 513 5.003 7.065 2.182 1.00 0.00 C ATOM 0 H ILE A 513 8.290 4.509 1.273 1.00 0.00 H new ATOM 0 HA ILE A 513 6.659 3.451 3.475 1.00 0.00 H new ATOM 0 HB ILE A 513 5.879 4.828 0.875 1.00 0.00 H new ATOM 0 HG12 ILE A 513 5.643 5.774 3.752 1.00 0.00 H new ATOM 0 HG13 ILE A 513 6.919 6.262 2.656 1.00 0.00 H new ATOM 0 HG21 ILE A 513 3.587 4.808 1.779 1.00 0.00 H new ATOM 0 HG22 ILE A 513 4.210 3.160 1.527 1.00 0.00 H new ATOM 0 HG23 ILE A 513 4.147 3.847 3.168 1.00 0.00 H new ATOM 0 HD11 ILE A 513 5.170 7.964 2.776 1.00 0.00 H new ATOM 0 HD12 ILE A 513 5.252 7.267 1.140 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.956 6.772 2.254 1.00 0.00 H new ATOM 1263 N ASN A 514 6.131 1.272 2.417 1.00 0.00 N ATOM 1264 CA ASN A 514 5.859 -0.038 1.838 1.00 0.00 C ATOM 1265 C ASN A 514 4.399 -0.430 2.026 1.00 0.00 C ATOM 1266 O ASN A 514 3.790 -0.120 3.050 1.00 0.00 O ATOM 1267 CB ASN A 514 6.768 -1.103 2.422 1.00 0.00 C ATOM 1268 CG ASN A 514 8.173 -1.059 1.888 1.00 0.00 C ATOM 1269 OD1 ASN A 514 8.331 -1.533 0.678 1.00 0.00 O flip ATOM 1270 ND2 ASN A 514 9.087 -0.536 2.534 1.00 0.00 N flip ATOM 0 H ASN A 514 5.975 1.328 3.423 1.00 0.00 H new ATOM 0 HA ASN A 514 6.063 0.034 0.770 1.00 0.00 H new ATOM 0 HB2 ASN A 514 6.797 -0.989 3.506 1.00 0.00 H new ATOM 0 HB3 ASN A 514 6.341 -2.085 2.216 1.00 0.00 H new ATOM 0 HD21 ASN A 514 8.910 -0.182 3.474 1.00 0.00 H new ATOM 0 HD22 ASN A 514 10.019 -0.458 2.127 1.00 0.00 H new ATOM 1277 N ALA A 515 3.842 -1.114 1.032 1.00 0.00 N ATOM 1278 CA ALA A 515 2.505 -1.681 1.148 1.00 0.00 C ATOM 1279 C ALA A 515 2.519 -3.182 0.891 1.00 0.00 C ATOM 1280 O ALA A 515 3.209 -3.662 -0.009 1.00 0.00 O ATOM 1281 CB ALA A 515 1.550 -0.985 0.189 1.00 0.00 C ATOM 0 H ALA A 515 4.297 -1.289 0.136 1.00 0.00 H new ATOM 0 HA ALA A 515 2.157 -1.519 2.168 1.00 0.00 H new ATOM 0 HB1 ALA A 515 0.555 -1.419 0.287 1.00 0.00 H new ATOM 0 HB2 ALA A 515 1.507 0.078 0.426 1.00 0.00 H new ATOM 0 HB3 ALA A 515 1.903 -1.114 -0.834 1.00 0.00 H new ATOM 1287 N THR A 516 1.753 -3.920 1.686 1.00 0.00 N ATOM 1288 CA THR A 516 1.631 -5.363 1.509 1.00 0.00 C ATOM 1289 C THR A 516 0.171 -5.797 1.505 1.00 0.00 C ATOM 1290 O THR A 516 -0.674 -5.170 2.144 1.00 0.00 O ATOM 1291 CB THR A 516 2.381 -6.133 2.613 1.00 0.00 C ATOM 1292 OG1 THR A 516 1.794 -5.839 3.887 1.00 0.00 O ATOM 1293 CG2 THR A 516 3.850 -5.743 2.632 1.00 0.00 C ATOM 0 H THR A 516 1.206 -3.543 2.460 1.00 0.00 H new ATOM 0 HA THR A 516 2.079 -5.599 0.544 1.00 0.00 H new ATOM 0 HB THR A 516 2.303 -7.201 2.408 1.00 0.00 H new ATOM 0 HG1 THR A 516 2.271 -6.331 4.588 1.00 0.00 H new ATOM 0 HG21 THR A 516 4.363 -6.297 3.418 1.00 0.00 H new ATOM 0 HG22 THR A 516 4.301 -5.978 1.668 1.00 0.00 H new ATOM 0 HG23 THR A 516 3.940 -4.674 2.824 1.00 0.00 H new ATOM 1301 N VAL A 517 -0.120 -6.872 0.781 1.00 0.00 N ATOM 1302 CA VAL A 517 -1.408 -7.543 0.890 1.00 0.00 C ATOM 1303 C VAL A 517 -1.236 -9.020 1.219 1.00 0.00 C ATOM 1304 O VAL A 517 -0.334 -9.680 0.702 1.00 0.00 O ATOM 1305 CB VAL A 517 -2.228 -7.408 -0.406 1.00 0.00 C ATOM 1306 CG1 VAL A 517 -1.471 -8.016 -1.579 1.00 0.00 C ATOM 1307 CG2 VAL A 517 -3.587 -8.073 -0.249 1.00 0.00 C ATOM 0 H VAL A 517 0.521 -7.297 0.111 1.00 0.00 H new ATOM 0 HA VAL A 517 -1.947 -7.055 1.702 1.00 0.00 H new ATOM 0 HB VAL A 517 -2.384 -6.348 -0.606 1.00 0.00 H new ATOM 0 HG11 VAL A 517 -2.064 -7.913 -2.488 1.00 0.00 H new ATOM 0 HG12 VAL A 517 -0.520 -7.499 -1.706 1.00 0.00 H new ATOM 0 HG13 VAL A 517 -1.286 -9.073 -1.385 1.00 0.00 H new ATOM 0 HG21 VAL A 517 -4.153 -7.968 -1.175 1.00 0.00 H new ATOM 0 HG22 VAL A 517 -3.451 -9.131 -0.025 1.00 0.00 H new ATOM 0 HG23 VAL A 517 -4.133 -7.597 0.566 1.00 0.00 H new ATOM 1524 N VAL A 532 3.778 -6.875 -3.290 1.00 0.00 N ATOM 1525 CA VAL A 532 4.372 -5.866 -2.423 1.00 0.00 C ATOM 1526 C VAL A 532 4.830 -4.653 -3.221 1.00 0.00 C ATOM 1527 O VAL A 532 5.318 -4.784 -4.344 1.00 0.00 O ATOM 1528 CB VAL A 532 5.570 -6.430 -1.635 1.00 0.00 C ATOM 1529 CG1 VAL A 532 6.205 -5.346 -0.779 1.00 0.00 C ATOM 1530 CG2 VAL A 532 5.133 -7.603 -0.769 1.00 0.00 C ATOM 0 HA VAL A 532 3.596 -5.563 -1.720 1.00 0.00 H new ATOM 0 HB VAL A 532 6.314 -6.785 -2.349 1.00 0.00 H new ATOM 0 HG11 VAL A 532 7.049 -5.764 -0.230 1.00 0.00 H new ATOM 0 HG12 VAL A 532 6.553 -4.535 -1.418 1.00 0.00 H new ATOM 0 HG13 VAL A 532 5.468 -4.961 -0.074 1.00 0.00 H new ATOM 0 HG21 VAL A 532 5.991 -7.989 -0.219 1.00 0.00 H new ATOM 0 HG22 VAL A 532 4.371 -7.271 -0.064 1.00 0.00 H new ATOM 0 HG23 VAL A 532 4.724 -8.390 -1.402 1.00 0.00 H new ATOM 1540 N ALA A 533 4.671 -3.470 -2.636 1.00 0.00 N ATOM 1541 CA ALA A 533 5.006 -2.226 -3.320 1.00 0.00 C ATOM 1542 C ALA A 533 5.925 -1.360 -2.468 1.00 0.00 C ATOM 1543 O ALA A 533 5.684 -1.168 -1.275 1.00 0.00 O ATOM 1544 CB ALA A 533 3.740 -1.464 -3.682 1.00 0.00 C ATOM 0 H ALA A 533 4.312 -3.347 -1.689 1.00 0.00 H new ATOM 0 HA ALA A 533 5.538 -2.477 -4.237 1.00 0.00 H new ATOM 0 HB1 ALA A 533 4.006 -0.538 -4.192 1.00 0.00 H new ATOM 0 HB2 ALA A 533 3.123 -2.076 -4.340 1.00 0.00 H new ATOM 0 HB3 ALA A 533 3.183 -1.231 -2.774 1.00 0.00 H new ATOM 1550 N THR A 534 6.979 -0.838 -3.086 1.00 0.00 N ATOM 1551 CA THR A 534 7.919 0.033 -2.393 1.00 0.00 C ATOM 1552 C THR A 534 7.920 1.433 -2.996 1.00 0.00 C ATOM 1553 O THR A 534 8.095 1.599 -4.203 1.00 0.00 O ATOM 1554 CB THR A 534 9.351 -0.533 -2.435 1.00 0.00 C ATOM 1555 OG1 THR A 534 9.380 -1.813 -1.792 1.00 0.00 O ATOM 1556 CG2 THR A 534 10.317 0.406 -1.729 1.00 0.00 C ATOM 0 H THR A 534 7.203 -1.004 -4.067 1.00 0.00 H new ATOM 0 HA THR A 534 7.590 0.087 -1.355 1.00 0.00 H new ATOM 0 HB THR A 534 9.655 -0.634 -3.477 1.00 0.00 H new ATOM 0 HG1 THR A 534 9.109 -1.715 -0.855 1.00 0.00 H new ATOM 0 HG21 THR A 534 11.324 -0.010 -1.769 1.00 0.00 H new ATOM 0 HG22 THR A 534 10.306 1.378 -2.223 1.00 0.00 H new ATOM 0 HG23 THR A 534 10.014 0.525 -0.689 1.00 0.00 H new ATOM 1564 N PHE A 535 7.723 2.435 -2.148 1.00 0.00 N ATOM 1565 CA PHE A 535 7.631 3.817 -2.604 1.00 0.00 C ATOM 1566 C PHE A 535 8.517 4.733 -1.768 1.00 0.00 C ATOM 1567 O PHE A 535 8.490 4.686 -0.539 1.00 0.00 O ATOM 1568 CB PHE A 535 6.181 4.301 -2.555 1.00 0.00 C ATOM 1569 CG PHE A 535 5.980 5.671 -3.136 1.00 0.00 C ATOM 1570 CD1 PHE A 535 5.951 5.861 -4.511 1.00 0.00 C ATOM 1571 CD2 PHE A 535 5.820 6.774 -2.312 1.00 0.00 C ATOM 1572 CE1 PHE A 535 5.765 7.122 -5.046 1.00 0.00 C ATOM 1573 CE2 PHE A 535 5.633 8.035 -2.843 1.00 0.00 C ATOM 1574 CZ PHE A 535 5.606 8.209 -4.213 1.00 0.00 C ATOM 0 H PHE A 535 7.624 2.317 -1.140 1.00 0.00 H new ATOM 0 HA PHE A 535 7.982 3.852 -3.635 1.00 0.00 H new ATOM 0 HB2 PHE A 535 5.553 3.592 -3.094 1.00 0.00 H new ATOM 0 HB3 PHE A 535 5.843 4.303 -1.519 1.00 0.00 H new ATOM 0 HD1 PHE A 535 6.075 5.014 -5.170 1.00 0.00 H new ATOM 0 HD2 PHE A 535 5.842 6.645 -1.240 1.00 0.00 H new ATOM 0 HE1 PHE A 535 5.744 7.256 -6.117 1.00 0.00 H new ATOM 0 HE2 PHE A 535 5.508 8.884 -2.188 1.00 0.00 H new ATOM 0 HZ PHE A 535 5.461 9.194 -4.631 1.00 0.00 H new ATOM 1584 N ASP A 536 9.301 5.565 -2.444 1.00 0.00 N ATOM 1585 CA ASP A 536 10.293 6.397 -1.773 1.00 0.00 C ATOM 1586 C ASP A 536 9.817 7.839 -1.659 1.00 0.00 C ATOM 1587 O ASP A 536 9.396 8.444 -2.645 1.00 0.00 O ATOM 1588 CB ASP A 536 11.631 6.344 -2.518 1.00 0.00 C ATOM 1589 CG ASP A 536 12.356 5.009 -2.412 1.00 0.00 C ATOM 1590 OD1 ASP A 536 11.975 4.212 -1.587 1.00 0.00 O ATOM 1591 OD2 ASP A 536 13.177 4.733 -3.255 1.00 0.00 O ATOM 0 H ASP A 536 9.269 5.681 -3.457 1.00 0.00 H new ATOM 0 HA ASP A 536 10.431 6.002 -0.766 1.00 0.00 H new ATOM 0 HB2 ASP A 536 11.456 6.566 -3.571 1.00 0.00 H new ATOM 0 HB3 ASP A 536 12.281 7.129 -2.130 1.00 0.00 H new ATOM 1596 N VAL A 537 9.887 8.386 -0.449 1.00 0.00 N ATOM 1597 CA VAL A 537 9.497 9.771 -0.210 1.00 0.00 C ATOM 1598 C VAL A 537 10.654 10.576 0.366 1.00 0.00 C ATOM 1599 O VAL A 537 11.373 10.104 1.246 1.00 0.00 O ATOM 1600 CB VAL A 537 8.295 9.861 0.746 1.00 0.00 C ATOM 1601 CG1 VAL A 537 7.938 11.316 1.017 1.00 0.00 C ATOM 1602 CG2 VAL A 537 7.097 9.120 0.171 1.00 0.00 C ATOM 0 H VAL A 537 10.211 7.890 0.382 1.00 0.00 H new ATOM 0 HA VAL A 537 9.213 10.190 -1.175 1.00 0.00 H new ATOM 0 HB VAL A 537 8.571 9.390 1.689 1.00 0.00 H new ATOM 0 HG11 VAL A 537 7.086 11.361 1.695 1.00 0.00 H new ATOM 0 HG12 VAL A 537 8.790 11.821 1.471 1.00 0.00 H new ATOM 0 HG13 VAL A 537 7.682 11.809 0.079 1.00 0.00 H new ATOM 0 HG21 VAL A 537 6.257 9.195 0.862 1.00 0.00 H new ATOM 0 HG22 VAL A 537 6.821 9.562 -0.786 1.00 0.00 H new ATOM 0 HG23 VAL A 537 7.354 8.071 0.025 1.00 0.00 H new ATOM 1612 N SER A 538 10.827 11.795 -0.135 1.00 0.00 N ATOM 1613 CA SER A 538 11.764 12.741 0.460 1.00 0.00 C ATOM 1614 C SER A 538 11.028 13.863 1.180 1.00 0.00 C ATOM 1615 O SER A 538 10.184 14.542 0.596 1.00 0.00 O ATOM 1616 CB SER A 538 12.678 13.311 -0.607 1.00 0.00 C ATOM 1617 OG SER A 538 13.537 14.292 -0.095 1.00 0.00 O ATOM 0 H SER A 538 10.330 12.151 -0.952 1.00 0.00 H new ATOM 0 HA SER A 538 12.366 12.207 1.195 1.00 0.00 H new ATOM 0 HB2 SER A 538 13.268 12.506 -1.046 1.00 0.00 H new ATOM 0 HB3 SER A 538 12.076 13.739 -1.409 1.00 0.00 H new ATOM 0 HG SER A 538 14.110 14.632 -0.813 1.00 0.00 H new ATOM 1623 N VAL A 539 11.352 14.053 2.454 1.00 0.00 N ATOM 1624 CA VAL A 539 10.799 15.156 3.230 1.00 0.00 C ATOM 1625 C VAL A 539 11.817 16.278 3.395 1.00 0.00 C ATOM 1626 O VAL A 539 12.956 16.041 3.798 1.00 0.00 O ATOM 1627 CB VAL A 539 10.333 14.691 4.622 1.00 0.00 C ATOM 1628 CG1 VAL A 539 9.792 15.866 5.423 1.00 0.00 C ATOM 1629 CG2 VAL A 539 9.276 13.604 4.494 1.00 0.00 C ATOM 0 H VAL A 539 11.996 13.456 2.972 1.00 0.00 H new ATOM 0 HA VAL A 539 9.938 15.529 2.675 1.00 0.00 H new ATOM 0 HB VAL A 539 11.191 14.278 5.152 1.00 0.00 H new ATOM 0 HG11 VAL A 539 9.467 15.519 6.404 1.00 0.00 H new ATOM 0 HG12 VAL A 539 10.575 16.615 5.544 1.00 0.00 H new ATOM 0 HG13 VAL A 539 8.946 16.307 4.896 1.00 0.00 H new ATOM 0 HG21 VAL A 539 8.958 13.287 5.487 1.00 0.00 H new ATOM 0 HG22 VAL A 539 8.418 13.993 3.945 1.00 0.00 H new ATOM 0 HG23 VAL A 539 9.693 12.752 3.958 1.00 0.00 H new ATOM 1639 N VAL A 540 11.399 17.499 3.083 1.00 0.00 N ATOM 1640 CA VAL A 540 12.285 18.655 3.157 1.00 0.00 C ATOM 1641 C VAL A 540 11.697 19.744 4.044 1.00 0.00 C ATOM 1642 O VAL A 540 10.507 19.729 4.356 1.00 0.00 O ATOM 1643 CB VAL A 540 12.569 19.241 1.761 1.00 0.00 C ATOM 1644 CG1 VAL A 540 13.322 18.234 0.904 1.00 0.00 C ATOM 1645 CG2 VAL A 540 11.272 19.652 1.083 1.00 0.00 C ATOM 0 H VAL A 540 10.451 17.715 2.776 1.00 0.00 H new ATOM 0 HA VAL A 540 13.222 18.304 3.590 1.00 0.00 H new ATOM 0 HB VAL A 540 13.192 20.127 1.879 1.00 0.00 H new ATOM 0 HG11 VAL A 540 13.514 18.664 -0.079 1.00 0.00 H new ATOM 0 HG12 VAL A 540 14.269 17.985 1.383 1.00 0.00 H new ATOM 0 HG13 VAL A 540 12.723 17.330 0.793 1.00 0.00 H new ATOM 0 HG21 VAL A 540 11.491 20.064 0.098 1.00 0.00 H new ATOM 0 HG22 VAL A 540 10.625 18.781 0.977 1.00 0.00 H new ATOM 0 HG23 VAL A 540 10.768 20.406 1.688 1.00 0.00 H new ATOM 1655 N LEU A 541 12.538 20.690 4.449 1.00 0.00 N ATOM 1656 CA LEU A 541 12.102 21.792 5.298 1.00 0.00 C ATOM 1657 C LEU A 541 11.569 22.951 4.465 1.00 0.00 C ATOM 1658 O LEU A 541 11.908 24.109 4.708 1.00 0.00 O ATOM 1659 CB LEU A 541 13.257 22.263 6.191 1.00 0.00 C ATOM 1660 CG LEU A 541 13.817 21.202 7.147 1.00 0.00 C ATOM 1661 CD1 LEU A 541 14.999 21.769 7.922 1.00 0.00 C ATOM 1662 CD2 LEU A 541 12.721 20.742 8.097 1.00 0.00 C ATOM 0 H LEU A 541 13.527 20.715 4.202 1.00 0.00 H new ATOM 0 HA LEU A 541 11.290 21.432 5.930 1.00 0.00 H new ATOM 0 HB2 LEU A 541 14.067 22.618 5.553 1.00 0.00 H new ATOM 0 HB3 LEU A 541 12.917 23.115 6.779 1.00 0.00 H new ATOM 0 HG LEU A 541 14.165 20.344 6.572 1.00 0.00 H new ATOM 0 HD11 LEU A 541 15.390 21.008 8.598 1.00 0.00 H new ATOM 0 HD12 LEU A 541 15.781 22.070 7.225 1.00 0.00 H new ATOM 0 HD13 LEU A 541 14.674 22.635 8.499 1.00 0.00 H new ATOM 0 HD21 LEU A 541 13.120 19.988 8.776 1.00 0.00 H new ATOM 0 HD22 LEU A 541 12.358 21.593 8.673 1.00 0.00 H new ATOM 0 HD23 LEU A 541 11.898 20.315 7.524 1.00 0.00 H new