USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 835 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 531 GLN : amide:sc= 0.371 K(o=1.1,f=-4.7!) USER MOD Set 1.2: A 533 SER OG : rot -15:sc= 0.757 USER MOD Set 2.1: A 467 GLN : amide:sc= -0.239 X(o=-0.25,f=-0.52) USER MOD Set 2.2: A 510 THR OG1 : rot 180:sc= -0.0105 USER MOD Single : A 453 SER OG : rot 29:sc= 0.0638 USER MOD Single : A 455 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ -153:sc= 0.841 (180deg=0.659) USER MOD Single : A 469 LYS NZ :NH3+ -139:sc= 1.35 (180deg=-0.714) USER MOD Single : A 470 ASN : amide:sc= 0.0837 K(o=0.084,f=-1.3) USER MOD Single : A 471 ASN : amide:sc= -0.813 X(o=-0.81,f=-0.4) USER MOD Single : A 472 SER OG : rot 180:sc= -0.164 USER MOD Single : A 474 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00258) USER MOD Single : A 476 GLN : amide:sc= -1.42 X(o=-1.4,f=-1.7) USER MOD Single : A 477 SER OG : rot 43:sc= 0.16 USER MOD Single : A 480 ASN : amide:sc= -0.249 X(o=-0.25,f=0) USER MOD Single : A 484 LYS NZ :NH3+ -172:sc= 0.638 (180deg=0.596) USER MOD Single : A 486 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 180:sc= 0 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot 41:sc= 0.626 USER MOD Single : A 507 GLN : amide:sc= -0.255 X(o=-0.25,f=-0.079) USER MOD Single : A 508 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 520 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-0.34) USER MOD Single : A 521 SER OG : rot 66:sc= 0.0422 USER MOD Single : A 524 SER OG : rot 180:sc= 0 USER MOD Single : A 525 THR OG1 : rot 180:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 532 SER OG : rot 180:sc= 0 USER MOD Single : A 536 THR OG1 : rot 57:sc= 0.14 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot -160:sc= -0.123 USER MOD Single : A 546 ASN : amide:sc= -2.45! C(o=-2.5!,f=-3.3!) USER MOD Single : A 554 MET CE :methyl 164:sc= -0.0959 (180deg=-0.427) USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0039) USER MOD Single : A 559 LYS NZ :NH3+ -126:sc= -0.105 (180deg=-0.165) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 9.516 3.297 -6.294 1.00 0.00 N ATOM 41 CA SER A 453 10.834 3.961 -6.119 1.00 0.00 C ATOM 42 C SER A 453 12.032 3.045 -6.483 1.00 0.00 C ATOM 43 O SER A 453 13.188 3.478 -6.405 1.00 0.00 O ATOM 44 CB SER A 453 10.980 4.561 -4.701 1.00 0.00 C ATOM 45 OG SER A 453 9.936 5.483 -4.436 1.00 0.00 O ATOM 0 HA SER A 453 10.860 4.783 -6.834 1.00 0.00 H new ATOM 0 HB2 SER A 453 10.963 3.762 -3.959 1.00 0.00 H new ATOM 0 HB3 SER A 453 11.945 5.060 -4.610 1.00 0.00 H new ATOM 0 HG SER A 453 9.139 5.231 -4.948 1.00 0.00 H new ATOM 51 N VAL A 454 11.751 1.789 -6.888 1.00 0.00 N ATOM 52 CA VAL A 454 12.749 0.882 -7.462 1.00 0.00 C ATOM 53 C VAL A 454 12.510 0.829 -8.979 1.00 0.00 C ATOM 54 O VAL A 454 11.424 0.429 -9.423 1.00 0.00 O ATOM 55 CB VAL A 454 12.672 -0.569 -6.850 1.00 0.00 C ATOM 56 CG1 VAL A 454 13.841 -1.458 -7.361 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.614 -0.531 -5.302 1.00 0.00 C ATOM 0 H VAL A 454 10.819 1.380 -6.823 1.00 0.00 H new ATOM 0 HA VAL A 454 13.744 1.260 -7.229 1.00 0.00 H new ATOM 0 HB VAL A 454 11.743 -1.023 -7.194 1.00 0.00 H new ATOM 0 HG11 VAL A 454 13.761 -2.452 -6.922 1.00 0.00 H new ATOM 0 HG12 VAL A 454 13.791 -1.536 -8.447 1.00 0.00 H new ATOM 0 HG13 VAL A 454 14.792 -1.010 -7.073 1.00 0.00 H new ATOM 0 HG21 VAL A 454 12.562 -1.549 -4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.508 -0.042 -4.916 1.00 0.00 H new ATOM 0 HG23 VAL A 454 11.731 0.024 -4.984 1.00 0.00 H new ATOM 67 N SER A 455 13.505 1.267 -9.764 1.00 0.00 N ATOM 68 CA SER A 455 13.412 1.307 -11.229 1.00 0.00 C ATOM 69 C SER A 455 14.391 0.302 -11.856 1.00 0.00 C ATOM 70 O SER A 455 15.395 -0.074 -11.235 1.00 0.00 O ATOM 71 CB SER A 455 13.691 2.740 -11.730 1.00 0.00 C ATOM 72 OG SER A 455 13.477 2.846 -13.125 1.00 0.00 O ATOM 0 H SER A 455 14.397 1.603 -9.400 1.00 0.00 H new ATOM 0 HA SER A 455 12.404 1.024 -11.532 1.00 0.00 H new ATOM 0 HB2 SER A 455 13.044 3.444 -11.206 1.00 0.00 H new ATOM 0 HB3 SER A 455 14.719 3.016 -11.495 1.00 0.00 H new ATOM 0 HG SER A 455 13.659 3.764 -13.415 1.00 0.00 H new ATOM 78 N ILE A 456 14.071 -0.145 -13.083 1.00 0.00 N ATOM 79 CA ILE A 456 14.929 -1.063 -13.852 1.00 0.00 C ATOM 80 C ILE A 456 15.995 -0.242 -14.598 1.00 0.00 C ATOM 81 O ILE A 456 15.653 0.526 -15.505 1.00 0.00 O ATOM 82 CB ILE A 456 14.086 -1.901 -14.886 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.908 -2.623 -14.167 1.00 0.00 C ATOM 84 CG2 ILE A 456 14.980 -2.922 -15.647 1.00 0.00 C ATOM 85 CD1 ILE A 456 11.939 -3.339 -15.093 1.00 0.00 C ATOM 0 H ILE A 456 13.213 0.119 -13.568 1.00 0.00 H new ATOM 0 HA ILE A 456 15.403 -1.760 -13.161 1.00 0.00 H new ATOM 0 HB ILE A 456 13.672 -1.212 -15.623 1.00 0.00 H new ATOM 0 HG12 ILE A 456 13.319 -3.347 -13.464 1.00 0.00 H new ATOM 0 HG13 ILE A 456 12.354 -1.889 -13.581 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.369 -3.485 -16.353 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.762 -2.389 -16.188 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.436 -3.609 -14.934 1.00 0.00 H new ATOM 0 HD11 ILE A 456 11.154 -3.811 -14.503 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.494 -2.620 -15.780 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.474 -4.100 -15.661 1.00 0.00 H new ATOM 97 N GLU A 457 17.265 -0.386 -14.196 1.00 0.00 N ATOM 98 CA GLU A 457 18.395 0.317 -14.828 1.00 0.00 C ATOM 99 C GLU A 457 18.881 -0.452 -16.059 1.00 0.00 C ATOM 100 O GLU A 457 18.691 -0.015 -17.202 1.00 0.00 O ATOM 101 CB GLU A 457 19.563 0.489 -13.819 1.00 0.00 C ATOM 102 CG GLU A 457 19.229 1.346 -12.596 1.00 0.00 C ATOM 103 CD GLU A 457 18.771 2.773 -12.937 1.00 0.00 C ATOM 104 OE1 GLU A 457 19.523 3.498 -13.630 1.00 0.00 O ATOM 105 OE2 GLU A 457 17.678 3.187 -12.495 1.00 0.00 O ATOM 0 H GLU A 457 17.540 -0.993 -13.424 1.00 0.00 H new ATOM 0 HA GLU A 457 18.051 1.303 -15.140 1.00 0.00 H new ATOM 0 HB2 GLU A 457 19.880 -0.497 -13.479 1.00 0.00 H new ATOM 0 HB3 GLU A 457 20.411 0.935 -14.338 1.00 0.00 H new ATOM 0 HG2 GLU A 457 18.445 0.852 -12.022 1.00 0.00 H new ATOM 0 HG3 GLU A 457 20.108 1.402 -11.953 1.00 0.00 H new ATOM 112 N GLU A 458 19.493 -1.621 -15.805 1.00 0.00 N ATOM 113 CA GLU A 458 20.187 -2.404 -16.841 1.00 0.00 C ATOM 114 C GLU A 458 19.511 -3.758 -17.012 1.00 0.00 C ATOM 115 O GLU A 458 18.907 -4.291 -16.080 1.00 0.00 O ATOM 116 CB GLU A 458 21.684 -2.616 -16.481 1.00 0.00 C ATOM 117 CG GLU A 458 22.435 -1.347 -16.067 1.00 0.00 C ATOM 118 CD GLU A 458 23.915 -1.613 -15.780 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.248 -2.006 -14.641 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.749 -1.449 -16.698 1.00 0.00 O ATOM 0 H GLU A 458 19.521 -2.048 -14.879 1.00 0.00 H new ATOM 0 HA GLU A 458 20.133 -1.844 -17.775 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.748 -3.340 -15.668 1.00 0.00 H new ATOM 0 HB3 GLU A 458 22.190 -3.056 -17.340 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.349 -0.603 -16.859 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.966 -0.924 -15.179 1.00 0.00 H new ATOM 127 N ILE A 459 19.595 -4.281 -18.233 1.00 0.00 N ATOM 128 CA ILE A 459 19.187 -5.645 -18.586 1.00 0.00 C ATOM 129 C ILE A 459 20.243 -6.178 -19.556 1.00 0.00 C ATOM 130 O ILE A 459 20.780 -5.415 -20.371 1.00 0.00 O ATOM 131 CB ILE A 459 17.759 -5.696 -19.271 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.694 -4.954 -18.408 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.314 -7.164 -19.534 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.387 -4.703 -19.109 1.00 0.00 C ATOM 0 H ILE A 459 19.958 -3.756 -19.028 1.00 0.00 H new ATOM 0 HA ILE A 459 19.113 -6.247 -17.681 1.00 0.00 H new ATOM 0 HB ILE A 459 17.839 -5.185 -20.231 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.503 -5.539 -17.508 1.00 0.00 H new ATOM 0 HG13 ILE A 459 17.108 -3.999 -18.085 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.331 -7.167 -20.005 1.00 0.00 H new ATOM 0 HG22 ILE A 459 18.033 -7.650 -20.193 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.266 -7.704 -18.589 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.707 -4.183 -18.435 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.560 -4.090 -19.994 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.946 -5.654 -19.407 1.00 0.00 H new ATOM 146 N ASP A 460 20.558 -7.463 -19.460 1.00 0.00 N ATOM 147 CA ASP A 460 21.493 -8.115 -20.386 1.00 0.00 C ATOM 148 C ASP A 460 20.843 -8.235 -21.793 1.00 0.00 C ATOM 149 O ASP A 460 19.619 -8.369 -21.908 1.00 0.00 O ATOM 150 CB ASP A 460 21.898 -9.490 -19.812 1.00 0.00 C ATOM 151 CG ASP A 460 22.945 -10.229 -20.659 1.00 0.00 C ATOM 152 OD1 ASP A 460 24.154 -10.023 -20.461 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.555 -11.025 -21.521 1.00 0.00 O ATOM 0 H ASP A 460 20.179 -8.085 -18.746 1.00 0.00 H new ATOM 0 HA ASP A 460 22.398 -7.517 -20.497 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.290 -9.352 -18.805 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.008 -10.114 -19.725 1.00 0.00 H new ATOM 158 N LEU A 461 21.682 -8.183 -22.848 1.00 0.00 N ATOM 159 CA LEU A 461 21.248 -8.233 -24.276 1.00 0.00 C ATOM 160 C LEU A 461 20.546 -9.572 -24.670 1.00 0.00 C ATOM 161 O LEU A 461 19.920 -9.665 -25.736 1.00 0.00 O ATOM 162 CB LEU A 461 22.465 -7.904 -25.220 1.00 0.00 C ATOM 163 CG LEU A 461 23.899 -8.411 -24.784 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.995 -9.944 -24.608 1.00 0.00 C ATOM 165 CD2 LEU A 461 24.992 -7.892 -25.753 1.00 0.00 C ATOM 0 H LEU A 461 22.693 -8.104 -22.740 1.00 0.00 H new ATOM 0 HA LEU A 461 20.483 -7.467 -24.406 1.00 0.00 H new ATOM 0 HB2 LEU A 461 22.248 -8.321 -26.203 1.00 0.00 H new ATOM 0 HB3 LEU A 461 22.514 -6.821 -25.337 1.00 0.00 H new ATOM 0 HG LEU A 461 24.074 -7.988 -23.795 1.00 0.00 H new ATOM 0 HD11 LEU A 461 25.008 -10.213 -24.309 1.00 0.00 H new ATOM 0 HD12 LEU A 461 23.292 -10.267 -23.840 1.00 0.00 H new ATOM 0 HD13 LEU A 461 23.753 -10.434 -25.551 1.00 0.00 H new ATOM 0 HD21 LEU A 461 25.967 -8.256 -25.430 1.00 0.00 H new ATOM 0 HD22 LEU A 461 24.786 -8.253 -26.761 1.00 0.00 H new ATOM 0 HD23 LEU A 461 24.992 -6.802 -25.751 1.00 0.00 H new ATOM 177 N GLU A 462 20.707 -10.603 -23.821 1.00 0.00 N ATOM 178 CA GLU A 462 19.968 -11.885 -23.896 1.00 0.00 C ATOM 179 C GLU A 462 19.016 -11.989 -22.696 1.00 0.00 C ATOM 180 O GLU A 462 17.940 -12.601 -22.787 1.00 0.00 O ATOM 181 CB GLU A 462 20.971 -13.067 -23.892 1.00 0.00 C ATOM 182 CG GLU A 462 21.974 -13.040 -25.059 1.00 0.00 C ATOM 183 CD GLU A 462 23.092 -14.078 -24.899 1.00 0.00 C ATOM 184 OE1 GLU A 462 22.849 -15.265 -25.188 1.00 0.00 O ATOM 185 OE2 GLU A 462 24.208 -13.708 -24.461 1.00 0.00 O ATOM 0 H GLU A 462 21.368 -10.571 -23.045 1.00 0.00 H new ATOM 0 HA GLU A 462 19.388 -11.924 -24.818 1.00 0.00 H new ATOM 0 HB2 GLU A 462 21.523 -13.059 -22.952 1.00 0.00 H new ATOM 0 HB3 GLU A 462 20.414 -14.003 -23.927 1.00 0.00 H new ATOM 0 HG2 GLU A 462 21.444 -13.223 -25.993 1.00 0.00 H new ATOM 0 HG3 GLU A 462 22.414 -12.046 -25.132 1.00 0.00 H new ATOM 192 N GLY A 463 19.444 -11.369 -21.579 1.00 0.00 N ATOM 193 CA GLY A 463 18.651 -11.259 -20.355 1.00 0.00 C ATOM 194 C GLY A 463 19.121 -12.187 -19.248 1.00 0.00 C ATOM 195 O GLY A 463 18.309 -12.613 -18.427 1.00 0.00 O ATOM 0 H GLY A 463 20.361 -10.928 -21.508 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.689 -10.230 -19.997 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.608 -11.478 -20.585 1.00 0.00 H new ATOM 199 N LYS A 464 20.439 -12.484 -19.194 1.00 0.00 N ATOM 200 CA LYS A 464 21.008 -13.383 -18.161 1.00 0.00 C ATOM 201 C LYS A 464 21.062 -12.682 -16.792 1.00 0.00 C ATOM 202 O LYS A 464 21.360 -13.329 -15.780 1.00 0.00 O ATOM 203 CB LYS A 464 22.423 -13.897 -18.555 1.00 0.00 C ATOM 204 CG LYS A 464 22.476 -14.802 -19.831 1.00 0.00 C ATOM 205 CD LYS A 464 23.158 -14.125 -21.039 1.00 0.00 C ATOM 206 CE LYS A 464 24.605 -13.668 -20.755 1.00 0.00 C ATOM 207 NZ LYS A 464 25.100 -12.751 -21.815 1.00 0.00 N ATOM 0 H LYS A 464 21.128 -12.116 -19.851 1.00 0.00 H new ATOM 0 HA LYS A 464 20.346 -14.246 -18.090 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.073 -13.036 -18.713 1.00 0.00 H new ATOM 0 HB3 LYS A 464 22.835 -14.457 -17.715 1.00 0.00 H new ATOM 0 HG2 LYS A 464 23.009 -15.722 -19.592 1.00 0.00 H new ATOM 0 HG3 LYS A 464 21.461 -15.085 -20.109 1.00 0.00 H new ATOM 0 HD2 LYS A 464 23.163 -14.820 -21.879 1.00 0.00 H new ATOM 0 HD3 LYS A 464 22.566 -13.262 -21.343 1.00 0.00 H new ATOM 0 HE2 LYS A 464 24.647 -13.166 -19.788 1.00 0.00 H new ATOM 0 HE3 LYS A 464 25.258 -14.539 -20.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 26.136 -12.818 -21.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 24.681 -13.018 -22.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 24.830 -11.774 -21.583 1.00 0.00 H new ATOM 221 N PHE A 465 20.775 -11.361 -16.773 1.00 0.00 N ATOM 222 CA PHE A 465 20.626 -10.588 -15.537 1.00 0.00 C ATOM 223 C PHE A 465 19.774 -9.336 -15.771 1.00 0.00 C ATOM 224 O PHE A 465 19.655 -8.850 -16.904 1.00 0.00 O ATOM 225 CB PHE A 465 22.008 -10.230 -14.933 1.00 0.00 C ATOM 226 CG PHE A 465 22.823 -9.146 -15.642 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.701 -9.467 -16.680 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.725 -7.803 -15.260 1.00 0.00 C ATOM 229 CE1 PHE A 465 24.444 -8.487 -17.316 1.00 0.00 C ATOM 230 CE2 PHE A 465 23.468 -6.824 -15.895 1.00 0.00 C ATOM 231 CZ PHE A 465 24.328 -7.168 -16.924 1.00 0.00 C ATOM 0 H PHE A 465 20.642 -10.808 -17.620 1.00 0.00 H new ATOM 0 HA PHE A 465 20.103 -11.211 -14.811 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.854 -9.916 -13.901 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.609 -11.139 -14.903 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.802 -10.496 -16.991 1.00 0.00 H new ATOM 0 HD2 PHE A 465 22.058 -7.527 -14.456 1.00 0.00 H new ATOM 0 HE1 PHE A 465 25.115 -8.754 -18.119 1.00 0.00 H new ATOM 0 HE2 PHE A 465 23.377 -5.792 -15.588 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.908 -6.404 -17.420 1.00 0.00 H new ATOM 241 N VAL A 466 19.185 -8.830 -14.673 1.00 0.00 N ATOM 242 CA VAL A 466 18.397 -7.589 -14.638 1.00 0.00 C ATOM 243 C VAL A 466 18.850 -6.776 -13.410 1.00 0.00 C ATOM 244 O VAL A 466 18.657 -7.208 -12.267 1.00 0.00 O ATOM 245 CB VAL A 466 16.837 -7.855 -14.560 1.00 0.00 C ATOM 246 CG1 VAL A 466 16.044 -6.517 -14.505 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.347 -8.744 -15.739 1.00 0.00 C ATOM 0 H VAL A 466 19.247 -9.286 -13.763 1.00 0.00 H new ATOM 0 HA VAL A 466 18.571 -7.043 -15.565 1.00 0.00 H new ATOM 0 HB VAL A 466 16.645 -8.401 -13.636 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.976 -6.729 -14.452 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.346 -5.951 -13.624 1.00 0.00 H new ATOM 0 HG13 VAL A 466 16.254 -5.933 -15.401 1.00 0.00 H new ATOM 0 HG21 VAL A 466 15.272 -8.905 -15.651 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.564 -8.246 -16.684 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.861 -9.705 -15.708 1.00 0.00 H new ATOM 257 N GLN A 467 19.469 -5.617 -13.662 1.00 0.00 N ATOM 258 CA GLN A 467 19.903 -4.676 -12.619 1.00 0.00 C ATOM 259 C GLN A 467 18.736 -3.739 -12.254 1.00 0.00 C ATOM 260 O GLN A 467 18.338 -2.882 -13.057 1.00 0.00 O ATOM 261 CB GLN A 467 21.123 -3.843 -13.113 1.00 0.00 C ATOM 262 CG GLN A 467 21.654 -2.784 -12.114 1.00 0.00 C ATOM 263 CD GLN A 467 22.308 -3.398 -10.874 1.00 0.00 C ATOM 264 OE1 GLN A 467 21.650 -3.667 -9.866 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.610 -3.636 -10.945 1.00 0.00 N ATOM 0 H GLN A 467 19.686 -5.301 -14.607 1.00 0.00 H new ATOM 0 HA GLN A 467 20.205 -5.239 -11.736 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.935 -4.529 -13.355 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.846 -3.338 -14.038 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.379 -2.147 -12.621 1.00 0.00 H new ATOM 0 HG3 GLN A 467 20.830 -2.143 -11.802 1.00 0.00 H new ATOM 0 HE21 GLN A 467 24.126 -3.402 -11.793 1.00 0.00 H new ATOM 0 HE22 GLN A 467 24.096 -4.053 -10.151 1.00 0.00 H new ATOM 274 N LEU A 468 18.172 -3.955 -11.059 1.00 0.00 N ATOM 275 CA LEU A 468 17.184 -3.051 -10.437 1.00 0.00 C ATOM 276 C LEU A 468 17.937 -2.063 -9.535 1.00 0.00 C ATOM 277 O LEU A 468 19.065 -2.344 -9.135 1.00 0.00 O ATOM 278 CB LEU A 468 16.173 -3.860 -9.580 1.00 0.00 C ATOM 279 CG LEU A 468 15.476 -5.069 -10.271 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.518 -5.769 -9.286 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.755 -4.648 -11.571 1.00 0.00 C ATOM 0 H LEU A 468 18.388 -4.771 -10.486 1.00 0.00 H new ATOM 0 HA LEU A 468 16.634 -2.521 -11.214 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.695 -4.228 -8.697 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.399 -3.176 -9.231 1.00 0.00 H new ATOM 0 HG LEU A 468 16.246 -5.784 -10.561 1.00 0.00 H new ATOM 0 HD11 LEU A 468 14.038 -6.612 -9.783 1.00 0.00 H new ATOM 0 HD12 LEU A 468 15.081 -6.128 -8.424 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.757 -5.062 -8.954 1.00 0.00 H new ATOM 0 HD21 LEU A 468 14.281 -5.520 -12.023 1.00 0.00 H new ATOM 0 HD22 LEU A 468 13.995 -3.901 -11.340 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.479 -4.226 -12.268 1.00 0.00 H new ATOM 293 N LYS A 469 17.307 -0.932 -9.195 1.00 0.00 N ATOM 294 CA LYS A 469 17.927 0.095 -8.333 1.00 0.00 C ATOM 295 C LYS A 469 16.849 0.734 -7.455 1.00 0.00 C ATOM 296 O LYS A 469 15.853 1.229 -7.975 1.00 0.00 O ATOM 297 CB LYS A 469 18.616 1.149 -9.255 1.00 0.00 C ATOM 298 CG LYS A 469 19.693 2.063 -8.624 1.00 0.00 C ATOM 299 CD LYS A 469 19.145 3.212 -7.759 1.00 0.00 C ATOM 300 CE LYS A 469 20.263 4.104 -7.203 1.00 0.00 C ATOM 301 NZ LYS A 469 21.270 3.306 -6.458 1.00 0.00 N ATOM 0 H LYS A 469 16.363 -0.699 -9.503 1.00 0.00 H new ATOM 0 HA LYS A 469 18.677 -0.342 -7.673 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.075 0.617 -10.088 1.00 0.00 H new ATOM 0 HB3 LYS A 469 17.838 1.787 -9.674 1.00 0.00 H new ATOM 0 HG2 LYS A 469 20.354 1.450 -8.011 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.301 2.488 -9.423 1.00 0.00 H new ATOM 0 HD2 LYS A 469 18.461 3.818 -8.354 1.00 0.00 H new ATOM 0 HD3 LYS A 469 18.568 2.798 -6.932 1.00 0.00 H new ATOM 0 HE2 LYS A 469 20.749 4.634 -8.022 1.00 0.00 H new ATOM 0 HE3 LYS A 469 19.835 4.859 -6.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 21.553 3.819 -5.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 20.859 2.388 -6.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 22.105 3.152 -7.059 1.00 0.00 H new ATOM 315 N ASN A 470 17.078 0.760 -6.131 1.00 0.00 N ATOM 316 CA ASN A 470 16.195 1.454 -5.177 1.00 0.00 C ATOM 317 C ASN A 470 16.685 2.903 -5.021 1.00 0.00 C ATOM 318 O ASN A 470 17.649 3.167 -4.298 1.00 0.00 O ATOM 319 CB ASN A 470 16.151 0.736 -3.797 1.00 0.00 C ATOM 320 CG ASN A 470 15.119 1.343 -2.827 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.091 1.877 -3.249 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.379 1.256 -1.525 1.00 0.00 N ATOM 0 H ASN A 470 17.877 0.302 -5.693 1.00 0.00 H new ATOM 0 HA ASN A 470 15.177 1.442 -5.567 1.00 0.00 H new ATOM 0 HB2 ASN A 470 15.919 -0.318 -3.951 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.140 0.781 -3.340 1.00 0.00 H new ATOM 0 HD21 ASN A 470 14.719 1.637 -0.847 1.00 0.00 H new ATOM 0 HD22 ASN A 470 16.238 0.808 -1.205 1.00 0.00 H new ATOM 329 N ASN A 471 16.038 3.819 -5.756 1.00 0.00 N ATOM 330 CA ASN A 471 16.349 5.267 -5.746 1.00 0.00 C ATOM 331 C ASN A 471 15.844 5.951 -4.456 1.00 0.00 C ATOM 332 O ASN A 471 16.193 7.106 -4.185 1.00 0.00 O ATOM 333 CB ASN A 471 15.718 5.940 -6.997 1.00 0.00 C ATOM 334 CG ASN A 471 16.232 5.346 -8.313 1.00 0.00 C ATOM 335 OD1 ASN A 471 15.671 4.380 -8.836 1.00 0.00 O ATOM 336 ND2 ASN A 471 17.305 5.912 -8.851 1.00 0.00 N ATOM 0 H ASN A 471 15.272 3.578 -6.385 1.00 0.00 H new ATOM 0 HA ASN A 471 17.432 5.384 -5.773 1.00 0.00 H new ATOM 0 HB2 ASN A 471 14.634 5.833 -6.954 1.00 0.00 H new ATOM 0 HB3 ASN A 471 15.934 7.008 -6.977 1.00 0.00 H new ATOM 0 HD21 ASN A 471 17.690 5.549 -9.723 1.00 0.00 H new ATOM 0 HD22 ASN A 471 17.745 6.710 -8.392 1.00 0.00 H new ATOM 343 N SER A 472 15.026 5.224 -3.673 1.00 0.00 N ATOM 344 CA SER A 472 14.421 5.731 -2.432 1.00 0.00 C ATOM 345 C SER A 472 15.492 6.067 -1.371 1.00 0.00 C ATOM 346 O SER A 472 16.516 5.381 -1.271 1.00 0.00 O ATOM 347 CB SER A 472 13.428 4.689 -1.881 1.00 0.00 C ATOM 348 OG SER A 472 12.646 5.216 -0.829 1.00 0.00 O ATOM 0 H SER A 472 14.766 4.261 -3.887 1.00 0.00 H new ATOM 0 HA SER A 472 13.891 6.655 -2.663 1.00 0.00 H new ATOM 0 HB2 SER A 472 12.775 4.349 -2.684 1.00 0.00 H new ATOM 0 HB3 SER A 472 13.976 3.817 -1.525 1.00 0.00 H new ATOM 0 HG SER A 472 12.027 4.529 -0.505 1.00 0.00 H new ATOM 354 N ASP A 473 15.215 7.119 -0.575 1.00 0.00 N ATOM 355 CA ASP A 473 16.118 7.617 0.494 1.00 0.00 C ATOM 356 C ASP A 473 15.945 6.812 1.797 1.00 0.00 C ATOM 357 O ASP A 473 16.626 7.074 2.796 1.00 0.00 O ATOM 358 CB ASP A 473 15.855 9.126 0.745 1.00 0.00 C ATOM 359 CG ASP A 473 16.133 9.993 -0.500 1.00 0.00 C ATOM 360 OD1 ASP A 473 15.213 10.168 -1.331 1.00 0.00 O ATOM 361 OD2 ASP A 473 17.271 10.487 -0.663 1.00 0.00 O ATOM 0 H ASP A 473 14.351 7.655 -0.653 1.00 0.00 H new ATOM 0 HA ASP A 473 17.148 7.484 0.161 1.00 0.00 H new ATOM 0 HB2 ASP A 473 14.819 9.264 1.055 1.00 0.00 H new ATOM 0 HB3 ASP A 473 16.482 9.468 1.568 1.00 0.00 H new ATOM 366 N LYS A 474 15.038 5.826 1.764 1.00 0.00 N ATOM 367 CA LYS A 474 14.780 4.902 2.872 1.00 0.00 C ATOM 368 C LYS A 474 14.633 3.481 2.303 1.00 0.00 C ATOM 369 O LYS A 474 14.472 3.300 1.080 1.00 0.00 O ATOM 370 CB LYS A 474 13.520 5.316 3.717 1.00 0.00 C ATOM 371 CG LYS A 474 12.166 5.420 2.957 1.00 0.00 C ATOM 372 CD LYS A 474 12.097 6.633 1.989 1.00 0.00 C ATOM 373 CE LYS A 474 10.725 6.801 1.313 1.00 0.00 C ATOM 374 NZ LYS A 474 9.673 7.226 2.264 1.00 0.00 N ATOM 0 H LYS A 474 14.452 5.647 0.948 1.00 0.00 H new ATOM 0 HA LYS A 474 15.624 4.938 3.561 1.00 0.00 H new ATOM 0 HB2 LYS A 474 13.401 4.594 4.525 1.00 0.00 H new ATOM 0 HB3 LYS A 474 13.724 6.281 4.180 1.00 0.00 H new ATOM 0 HG2 LYS A 474 12.003 4.503 2.391 1.00 0.00 H new ATOM 0 HG3 LYS A 474 11.355 5.496 3.682 1.00 0.00 H new ATOM 0 HD2 LYS A 474 12.335 7.542 2.541 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.861 6.518 1.220 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.805 7.537 0.513 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.433 5.858 0.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 8.772 7.341 1.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 9.563 6.505 3.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 9.943 8.131 2.699 1.00 0.00 H new ATOM 388 N ASP A 475 14.708 2.482 3.202 1.00 0.00 N ATOM 389 CA ASP A 475 14.604 1.045 2.848 1.00 0.00 C ATOM 390 C ASP A 475 13.245 0.709 2.228 1.00 0.00 C ATOM 391 O ASP A 475 12.271 1.454 2.378 1.00 0.00 O ATOM 392 CB ASP A 475 14.832 0.137 4.094 1.00 0.00 C ATOM 393 CG ASP A 475 16.293 0.102 4.554 1.00 0.00 C ATOM 394 OD1 ASP A 475 17.087 -0.662 3.967 1.00 0.00 O ATOM 395 OD2 ASP A 475 16.657 0.825 5.506 1.00 0.00 O ATOM 0 H ASP A 475 14.843 2.645 4.200 1.00 0.00 H new ATOM 0 HA ASP A 475 15.384 0.851 2.112 1.00 0.00 H new ATOM 0 HB2 ASP A 475 14.208 0.492 4.914 1.00 0.00 H new ATOM 0 HB3 ASP A 475 14.506 -0.877 3.862 1.00 0.00 H new ATOM 400 N GLN A 476 13.205 -0.431 1.541 1.00 0.00 N ATOM 401 CA GLN A 476 11.988 -0.975 0.938 1.00 0.00 C ATOM 402 C GLN A 476 11.972 -2.481 1.237 1.00 0.00 C ATOM 403 O GLN A 476 12.831 -3.215 0.741 1.00 0.00 O ATOM 404 CB GLN A 476 11.951 -0.683 -0.607 1.00 0.00 C ATOM 405 CG GLN A 476 10.548 -0.818 -1.262 1.00 0.00 C ATOM 406 CD GLN A 476 10.014 -2.252 -1.325 1.00 0.00 C ATOM 407 OE1 GLN A 476 10.762 -3.192 -1.568 1.00 0.00 O ATOM 408 NE2 GLN A 476 8.730 -2.442 -1.048 1.00 0.00 N ATOM 0 H GLN A 476 14.029 -1.012 1.385 1.00 0.00 H new ATOM 0 HA GLN A 476 11.099 -0.503 1.356 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.322 0.327 -0.781 1.00 0.00 H new ATOM 0 HB3 GLN A 476 12.638 -1.365 -1.108 1.00 0.00 H new ATOM 0 HG2 GLN A 476 9.840 -0.204 -0.705 1.00 0.00 H new ATOM 0 HG3 GLN A 476 10.593 -0.415 -2.274 1.00 0.00 H new ATOM 0 HE21 GLN A 476 8.128 -1.643 -0.849 1.00 0.00 H new ATOM 0 HE22 GLN A 476 8.346 -3.387 -1.034 1.00 0.00 H new ATOM 417 N SER A 477 11.016 -2.922 2.072 1.00 0.00 N ATOM 418 CA SER A 477 10.817 -4.345 2.394 1.00 0.00 C ATOM 419 C SER A 477 10.375 -5.114 1.128 1.00 0.00 C ATOM 420 O SER A 477 9.219 -5.011 0.694 1.00 0.00 O ATOM 421 CB SER A 477 9.790 -4.490 3.544 1.00 0.00 C ATOM 422 OG SER A 477 8.601 -3.761 3.281 1.00 0.00 O ATOM 0 H SER A 477 10.359 -2.301 2.543 1.00 0.00 H new ATOM 0 HA SER A 477 11.757 -4.778 2.735 1.00 0.00 H new ATOM 0 HB2 SER A 477 9.547 -5.543 3.685 1.00 0.00 H new ATOM 0 HB3 SER A 477 10.234 -4.138 4.475 1.00 0.00 H new ATOM 0 HG SER A 477 8.335 -3.895 2.348 1.00 0.00 H new ATOM 428 N LEU A 478 11.323 -5.857 0.530 1.00 0.00 N ATOM 429 CA LEU A 478 11.140 -6.521 -0.773 1.00 0.00 C ATOM 430 C LEU A 478 10.539 -7.925 -0.518 1.00 0.00 C ATOM 431 O LEU A 478 10.615 -8.430 0.610 1.00 0.00 O ATOM 432 CB LEU A 478 12.531 -6.577 -1.499 1.00 0.00 C ATOM 433 CG LEU A 478 12.526 -6.581 -3.062 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.907 -5.291 -3.631 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.948 -6.779 -3.625 1.00 0.00 C ATOM 0 H LEU A 478 12.244 -6.015 0.940 1.00 0.00 H new ATOM 0 HA LEU A 478 10.453 -5.977 -1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.120 -5.722 -1.166 1.00 0.00 H new ATOM 0 HB3 LEU A 478 13.052 -7.473 -1.161 1.00 0.00 H new ATOM 0 HG LEU A 478 11.908 -7.422 -3.376 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.921 -5.330 -4.720 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.878 -5.198 -3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.483 -4.430 -3.292 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.912 -6.777 -4.714 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.591 -5.969 -3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 478 14.348 -7.731 -3.277 1.00 0.00 H new ATOM 447 N GLY A 479 9.947 -8.557 -1.542 1.00 0.00 N ATOM 448 CA GLY A 479 9.319 -9.877 -1.357 1.00 0.00 C ATOM 449 C GLY A 479 8.120 -10.110 -2.246 1.00 0.00 C ATOM 450 O GLY A 479 8.156 -10.957 -3.146 1.00 0.00 O ATOM 0 H GLY A 479 9.889 -8.186 -2.490 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.060 -10.652 -1.551 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.014 -9.981 -0.316 1.00 0.00 H new ATOM 454 N ASN A 480 7.053 -9.341 -2.006 1.00 0.00 N ATOM 455 CA ASN A 480 5.806 -9.407 -2.805 1.00 0.00 C ATOM 456 C ASN A 480 6.031 -8.865 -4.235 1.00 0.00 C ATOM 457 O ASN A 480 5.178 -9.022 -5.120 1.00 0.00 O ATOM 458 CB ASN A 480 4.674 -8.627 -2.099 1.00 0.00 C ATOM 459 CG ASN A 480 4.362 -9.088 -0.668 1.00 0.00 C ATOM 460 OD1 ASN A 480 3.979 -8.279 0.184 1.00 0.00 O ATOM 461 ND2 ASN A 480 4.488 -10.383 -0.389 1.00 0.00 N ATOM 0 H ASN A 480 7.021 -8.652 -1.254 1.00 0.00 H new ATOM 0 HA ASN A 480 5.511 -10.453 -2.887 1.00 0.00 H new ATOM 0 HB2 ASN A 480 4.942 -7.571 -2.074 1.00 0.00 H new ATOM 0 HB3 ASN A 480 3.767 -8.712 -2.698 1.00 0.00 H new ATOM 0 HD21 ASN A 480 4.266 -10.727 0.545 1.00 0.00 H new ATOM 0 HD22 ASN A 480 4.806 -11.031 -1.109 1.00 0.00 H new ATOM 468 N TRP A 481 7.191 -8.202 -4.415 1.00 0.00 N ATOM 469 CA TRP A 481 7.676 -7.715 -5.705 1.00 0.00 C ATOM 470 C TRP A 481 8.023 -8.892 -6.624 1.00 0.00 C ATOM 471 O TRP A 481 8.514 -9.933 -6.164 1.00 0.00 O ATOM 472 CB TRP A 481 8.910 -6.813 -5.487 1.00 0.00 C ATOM 473 CG TRP A 481 8.592 -5.495 -4.826 1.00 0.00 C ATOM 474 CD1 TRP A 481 8.005 -5.288 -3.610 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.874 -4.201 -5.353 1.00 0.00 C ATOM 476 NE1 TRP A 481 7.892 -3.949 -3.370 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.424 -3.261 -4.419 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.460 -3.757 -6.533 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.544 -1.894 -4.626 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.581 -2.407 -6.740 1.00 0.00 C ATOM 481 CH2 TRP A 481 9.124 -1.488 -5.792 1.00 0.00 C ATOM 0 H TRP A 481 7.825 -7.990 -3.645 1.00 0.00 H new ATOM 0 HA TRP A 481 6.891 -7.130 -6.185 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.637 -7.349 -4.876 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.383 -6.621 -6.450 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.679 -6.068 -2.938 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.476 -3.530 -2.538 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.813 -4.461 -7.272 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 8.193 -1.181 -3.894 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 10.037 -2.048 -7.651 1.00 0.00 H new ATOM 0 HH2 TRP A 481 9.233 -0.431 -5.987 1.00 0.00 H new ATOM 492 N ARG A 482 7.771 -8.694 -7.925 1.00 0.00 N ATOM 493 CA ARG A 482 7.850 -9.748 -8.941 1.00 0.00 C ATOM 494 C ARG A 482 8.277 -9.152 -10.298 1.00 0.00 C ATOM 495 O ARG A 482 7.643 -8.221 -10.808 1.00 0.00 O ATOM 496 CB ARG A 482 6.474 -10.498 -9.020 1.00 0.00 C ATOM 497 CG ARG A 482 5.233 -9.589 -8.797 1.00 0.00 C ATOM 498 CD ARG A 482 3.914 -10.369 -8.675 1.00 0.00 C ATOM 499 NE ARG A 482 2.826 -9.530 -8.114 1.00 0.00 N ATOM 500 CZ ARG A 482 1.697 -9.169 -8.749 1.00 0.00 C ATOM 501 NH1 ARG A 482 1.502 -9.462 -10.034 1.00 0.00 N ATOM 502 NH2 ARG A 482 0.771 -8.487 -8.094 1.00 0.00 N ATOM 0 H ARG A 482 7.503 -7.786 -8.304 1.00 0.00 H new ATOM 0 HA ARG A 482 8.611 -10.478 -8.665 1.00 0.00 H new ATOM 0 HB2 ARG A 482 6.389 -10.974 -9.997 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.465 -11.294 -8.275 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.382 -9.000 -7.892 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.154 -8.886 -9.626 1.00 0.00 H new ATOM 0 HD2 ARG A 482 3.618 -10.738 -9.657 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.065 -11.241 -8.039 1.00 0.00 H new ATOM 0 HE ARG A 482 2.946 -9.196 -7.158 1.00 0.00 H new ATOM 0 HH11 ARG A 482 2.217 -9.970 -10.555 1.00 0.00 H new ATOM 0 HH12 ARG A 482 0.638 -9.179 -10.496 1.00 0.00 H new ATOM 0 HH21 ARG A 482 0.917 -8.239 -7.115 1.00 0.00 H new ATOM 0 HH22 ARG A 482 -0.088 -8.209 -8.568 1.00 0.00 H new ATOM 516 N ILE A 483 9.374 -9.693 -10.858 1.00 0.00 N ATOM 517 CA ILE A 483 9.923 -9.275 -12.152 1.00 0.00 C ATOM 518 C ILE A 483 9.296 -10.123 -13.267 1.00 0.00 C ATOM 519 O ILE A 483 9.600 -11.317 -13.381 1.00 0.00 O ATOM 520 CB ILE A 483 11.488 -9.451 -12.211 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.187 -8.785 -10.989 1.00 0.00 C ATOM 522 CG2 ILE A 483 12.057 -8.898 -13.547 1.00 0.00 C ATOM 523 CD1 ILE A 483 13.695 -9.011 -10.938 1.00 0.00 C ATOM 0 H ILE A 483 9.908 -10.442 -10.416 1.00 0.00 H new ATOM 0 HA ILE A 483 9.689 -8.219 -12.284 1.00 0.00 H new ATOM 0 HB ILE A 483 11.700 -10.519 -12.166 1.00 0.00 H new ATOM 0 HG12 ILE A 483 11.991 -7.713 -11.011 1.00 0.00 H new ATOM 0 HG13 ILE A 483 11.741 -9.172 -10.073 1.00 0.00 H new ATOM 0 HG21 ILE A 483 13.139 -9.031 -13.564 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.612 -9.437 -14.383 1.00 0.00 H new ATOM 0 HG23 ILE A 483 11.820 -7.837 -13.632 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.108 -8.516 -10.059 1.00 0.00 H new ATOM 0 HD12 ILE A 483 13.901 -10.080 -10.883 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.155 -8.598 -11.836 1.00 0.00 H new ATOM 535 N LYS A 484 8.433 -9.507 -14.081 1.00 0.00 N ATOM 536 CA LYS A 484 7.853 -10.157 -15.260 1.00 0.00 C ATOM 537 C LYS A 484 8.884 -10.168 -16.396 1.00 0.00 C ATOM 538 O LYS A 484 9.421 -9.123 -16.763 1.00 0.00 O ATOM 539 CB LYS A 484 6.577 -9.418 -15.737 1.00 0.00 C ATOM 540 CG LYS A 484 5.404 -9.426 -14.740 1.00 0.00 C ATOM 541 CD LYS A 484 4.155 -8.728 -15.328 1.00 0.00 C ATOM 542 CE LYS A 484 2.926 -8.817 -14.409 1.00 0.00 C ATOM 543 NZ LYS A 484 1.716 -8.241 -15.047 1.00 0.00 N ATOM 0 H LYS A 484 8.118 -8.547 -13.942 1.00 0.00 H new ATOM 0 HA LYS A 484 7.580 -11.177 -14.988 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.837 -8.383 -15.959 1.00 0.00 H new ATOM 0 HB3 LYS A 484 6.242 -9.870 -16.671 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.157 -10.454 -14.476 1.00 0.00 H new ATOM 0 HG3 LYS A 484 5.704 -8.924 -13.820 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.386 -7.679 -15.515 1.00 0.00 H new ATOM 0 HD3 LYS A 484 3.914 -9.178 -16.291 1.00 0.00 H new ATOM 0 HE2 LYS A 484 2.740 -9.860 -14.152 1.00 0.00 H new ATOM 0 HE3 LYS A 484 3.131 -8.290 -13.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 0.945 -8.196 -14.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 1.928 -7.283 -15.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 1.426 -8.840 -15.846 1.00 0.00 H new ATOM 557 N ARG A 485 9.180 -11.361 -16.910 1.00 0.00 N ATOM 558 CA ARG A 485 10.026 -11.556 -18.092 1.00 0.00 C ATOM 559 C ARG A 485 9.194 -12.270 -19.154 1.00 0.00 C ATOM 560 O ARG A 485 9.097 -13.499 -19.156 1.00 0.00 O ATOM 561 CB ARG A 485 11.293 -12.369 -17.715 1.00 0.00 C ATOM 562 CG ARG A 485 12.341 -11.568 -16.917 1.00 0.00 C ATOM 563 CD ARG A 485 13.092 -10.549 -17.787 1.00 0.00 C ATOM 564 NE ARG A 485 13.818 -11.212 -18.884 1.00 0.00 N ATOM 565 CZ ARG A 485 15.058 -11.709 -18.799 1.00 0.00 C ATOM 566 NH1 ARG A 485 15.787 -11.546 -17.703 1.00 0.00 N ATOM 567 NH2 ARG A 485 15.561 -12.379 -19.819 1.00 0.00 N ATOM 0 H ARG A 485 8.834 -12.234 -16.512 1.00 0.00 H new ATOM 0 HA ARG A 485 10.367 -10.598 -18.486 1.00 0.00 H new ATOM 0 HB2 ARG A 485 10.993 -13.238 -17.130 1.00 0.00 H new ATOM 0 HB3 ARG A 485 11.756 -12.744 -18.628 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.847 -11.046 -16.097 1.00 0.00 H new ATOM 0 HG3 ARG A 485 13.058 -12.258 -16.471 1.00 0.00 H new ATOM 0 HD2 ARG A 485 12.385 -9.829 -18.199 1.00 0.00 H new ATOM 0 HD3 ARG A 485 13.794 -9.989 -17.170 1.00 0.00 H new ATOM 0 HE ARG A 485 13.338 -11.299 -19.780 1.00 0.00 H new ATOM 0 HH11 ARG A 485 15.404 -11.035 -16.907 1.00 0.00 H new ATOM 0 HH12 ARG A 485 16.730 -11.932 -17.656 1.00 0.00 H new ATOM 0 HH21 ARG A 485 15.006 -12.515 -20.664 1.00 0.00 H new ATOM 0 HH22 ARG A 485 16.505 -12.761 -19.762 1.00 0.00 H new ATOM 581 N GLN A 486 8.557 -11.476 -20.021 1.00 0.00 N ATOM 582 CA GLN A 486 7.652 -11.972 -21.066 1.00 0.00 C ATOM 583 C GLN A 486 8.295 -11.728 -22.434 1.00 0.00 C ATOM 584 O GLN A 486 8.535 -10.582 -22.815 1.00 0.00 O ATOM 585 CB GLN A 486 6.284 -11.249 -20.976 1.00 0.00 C ATOM 586 CG GLN A 486 5.194 -11.819 -21.914 1.00 0.00 C ATOM 587 CD GLN A 486 3.971 -10.912 -22.059 1.00 0.00 C ATOM 588 OE1 GLN A 486 3.647 -10.125 -21.168 1.00 0.00 O ATOM 589 NE2 GLN A 486 3.276 -11.035 -23.176 1.00 0.00 N ATOM 0 H GLN A 486 8.655 -10.461 -20.018 1.00 0.00 H new ATOM 0 HA GLN A 486 7.482 -13.040 -20.929 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.926 -11.303 -19.948 1.00 0.00 H new ATOM 0 HB3 GLN A 486 6.429 -10.194 -21.208 1.00 0.00 H new ATOM 0 HG2 GLN A 486 5.628 -11.989 -22.899 1.00 0.00 H new ATOM 0 HG3 GLN A 486 4.873 -12.789 -21.535 1.00 0.00 H new ATOM 0 HE21 GLN A 486 3.574 -11.697 -23.892 1.00 0.00 H new ATOM 0 HE22 GLN A 486 2.441 -10.468 -23.322 1.00 0.00 H new ATOM 598 N VAL A 487 8.585 -12.807 -23.154 1.00 0.00 N ATOM 599 CA VAL A 487 9.216 -12.754 -24.478 1.00 0.00 C ATOM 600 C VAL A 487 8.144 -13.018 -25.551 1.00 0.00 C ATOM 601 O VAL A 487 7.209 -13.787 -25.299 1.00 0.00 O ATOM 602 CB VAL A 487 10.371 -13.823 -24.597 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.213 -13.584 -25.870 1.00 0.00 C ATOM 604 CG2 VAL A 487 11.268 -13.837 -23.329 1.00 0.00 C ATOM 0 H VAL A 487 8.388 -13.756 -22.835 1.00 0.00 H new ATOM 0 HA VAL A 487 9.656 -11.767 -24.623 1.00 0.00 H new ATOM 0 HB VAL A 487 9.905 -14.805 -24.678 1.00 0.00 H new ATOM 0 HG11 VAL A 487 12.003 -14.333 -25.930 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.573 -13.660 -26.749 1.00 0.00 H new ATOM 0 HG13 VAL A 487 11.658 -12.590 -25.830 1.00 0.00 H new ATOM 0 HG21 VAL A 487 12.052 -14.585 -23.446 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.721 -12.855 -23.193 1.00 0.00 H new ATOM 0 HG23 VAL A 487 10.661 -14.081 -22.457 1.00 0.00 H new ATOM 614 N LEU A 488 8.288 -12.402 -26.743 1.00 0.00 N ATOM 615 CA LEU A 488 7.361 -12.632 -27.883 1.00 0.00 C ATOM 616 C LEU A 488 7.492 -14.070 -28.435 1.00 0.00 C ATOM 617 O LEU A 488 6.563 -14.600 -29.056 1.00 0.00 O ATOM 618 CB LEU A 488 7.591 -11.551 -28.986 1.00 0.00 C ATOM 619 CG LEU A 488 9.033 -11.439 -29.626 1.00 0.00 C ATOM 620 CD1 LEU A 488 9.281 -12.471 -30.747 1.00 0.00 C ATOM 621 CD2 LEU A 488 9.309 -10.009 -30.145 1.00 0.00 C ATOM 0 H LEU A 488 9.037 -11.740 -26.946 1.00 0.00 H new ATOM 0 HA LEU A 488 6.336 -12.532 -27.527 1.00 0.00 H new ATOM 0 HB2 LEU A 488 6.882 -11.740 -29.792 1.00 0.00 H new ATOM 0 HB3 LEU A 488 7.338 -10.580 -28.560 1.00 0.00 H new ATOM 0 HG LEU A 488 9.733 -11.666 -28.822 1.00 0.00 H new ATOM 0 HD11 LEU A 488 10.288 -12.342 -31.145 1.00 0.00 H new ATOM 0 HD12 LEU A 488 9.177 -13.478 -30.344 1.00 0.00 H new ATOM 0 HD13 LEU A 488 8.554 -12.323 -31.545 1.00 0.00 H new ATOM 0 HD21 LEU A 488 10.308 -9.966 -30.579 1.00 0.00 H new ATOM 0 HD22 LEU A 488 8.572 -9.749 -30.905 1.00 0.00 H new ATOM 0 HD23 LEU A 488 9.242 -9.302 -29.318 1.00 0.00 H new ATOM 633 N GLU A 489 8.674 -14.675 -28.207 1.00 0.00 N ATOM 634 CA GLU A 489 8.951 -16.101 -28.494 1.00 0.00 C ATOM 635 C GLU A 489 8.025 -17.012 -27.662 1.00 0.00 C ATOM 636 O GLU A 489 7.762 -18.158 -28.043 1.00 0.00 O ATOM 637 CB GLU A 489 10.439 -16.429 -28.187 1.00 0.00 C ATOM 638 CG GLU A 489 11.467 -15.609 -29.002 1.00 0.00 C ATOM 639 CD GLU A 489 11.506 -15.983 -30.493 1.00 0.00 C ATOM 640 OE1 GLU A 489 12.116 -17.017 -30.839 1.00 0.00 O ATOM 641 OE2 GLU A 489 10.927 -15.260 -31.325 1.00 0.00 O ATOM 0 H GLU A 489 9.476 -14.183 -27.813 1.00 0.00 H new ATOM 0 HA GLU A 489 8.758 -16.284 -29.551 1.00 0.00 H new ATOM 0 HB2 GLU A 489 10.622 -16.261 -27.126 1.00 0.00 H new ATOM 0 HB3 GLU A 489 10.609 -17.489 -28.376 1.00 0.00 H new ATOM 0 HG2 GLU A 489 11.231 -14.549 -28.907 1.00 0.00 H new ATOM 0 HG3 GLU A 489 12.458 -15.755 -28.573 1.00 0.00 H new ATOM 648 N GLY A 490 7.531 -16.476 -26.529 1.00 0.00 N ATOM 649 CA GLY A 490 6.525 -17.144 -25.705 1.00 0.00 C ATOM 650 C GLY A 490 6.940 -17.287 -24.247 1.00 0.00 C ATOM 651 O GLY A 490 6.077 -17.455 -23.381 1.00 0.00 O ATOM 0 H GLY A 490 7.823 -15.568 -26.166 1.00 0.00 H new ATOM 0 HA2 GLY A 490 5.592 -16.583 -25.757 1.00 0.00 H new ATOM 0 HA3 GLY A 490 6.326 -18.133 -26.118 1.00 0.00 H new ATOM 655 N GLU A 491 8.260 -17.226 -23.978 1.00 0.00 N ATOM 656 CA GLU A 491 8.823 -17.464 -22.633 1.00 0.00 C ATOM 657 C GLU A 491 8.388 -16.369 -21.641 1.00 0.00 C ATOM 658 O GLU A 491 8.914 -15.259 -21.662 1.00 0.00 O ATOM 659 CB GLU A 491 10.364 -17.548 -22.715 1.00 0.00 C ATOM 660 CG GLU A 491 10.888 -18.695 -23.605 1.00 0.00 C ATOM 661 CD GLU A 491 12.417 -18.797 -23.629 1.00 0.00 C ATOM 662 OE1 GLU A 491 13.040 -18.791 -22.539 1.00 0.00 O ATOM 663 OE2 GLU A 491 13.010 -18.898 -24.728 1.00 0.00 O ATOM 0 H GLU A 491 8.964 -17.011 -24.684 1.00 0.00 H new ATOM 0 HA GLU A 491 8.436 -18.413 -22.262 1.00 0.00 H new ATOM 0 HB2 GLU A 491 10.749 -16.602 -23.097 1.00 0.00 H new ATOM 0 HB3 GLU A 491 10.764 -17.672 -21.709 1.00 0.00 H new ATOM 0 HG2 GLU A 491 10.474 -19.639 -23.250 1.00 0.00 H new ATOM 0 HG3 GLU A 491 10.525 -18.550 -24.623 1.00 0.00 H new ATOM 670 N GLU A 492 7.413 -16.700 -20.787 1.00 0.00 N ATOM 671 CA GLU A 492 6.825 -15.760 -19.816 1.00 0.00 C ATOM 672 C GLU A 492 6.879 -16.358 -18.396 1.00 0.00 C ATOM 673 O GLU A 492 6.288 -17.414 -18.121 1.00 0.00 O ATOM 674 CB GLU A 492 5.376 -15.387 -20.232 1.00 0.00 C ATOM 675 CG GLU A 492 4.447 -16.587 -20.512 1.00 0.00 C ATOM 676 CD GLU A 492 3.035 -16.155 -20.924 1.00 0.00 C ATOM 677 OE1 GLU A 492 2.844 -15.752 -22.090 1.00 0.00 O ATOM 678 OE2 GLU A 492 2.109 -16.219 -20.088 1.00 0.00 O ATOM 0 H GLU A 492 7.004 -17.634 -20.747 1.00 0.00 H new ATOM 0 HA GLU A 492 7.410 -14.840 -19.809 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.932 -14.780 -19.443 1.00 0.00 H new ATOM 0 HB3 GLU A 492 5.420 -14.765 -21.126 1.00 0.00 H new ATOM 0 HG2 GLU A 492 4.880 -17.201 -21.302 1.00 0.00 H new ATOM 0 HG3 GLU A 492 4.387 -17.211 -19.620 1.00 0.00 H new ATOM 685 N ILE A 493 7.640 -15.688 -17.520 1.00 0.00 N ATOM 686 CA ILE A 493 7.832 -16.069 -16.104 1.00 0.00 C ATOM 687 C ILE A 493 7.746 -14.814 -15.216 1.00 0.00 C ATOM 688 O ILE A 493 7.624 -13.688 -15.725 1.00 0.00 O ATOM 689 CB ILE A 493 9.217 -16.793 -15.875 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.390 -15.898 -16.391 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.240 -18.204 -16.521 1.00 0.00 C ATOM 692 CD1 ILE A 493 11.763 -16.512 -16.251 1.00 0.00 C ATOM 0 H ILE A 493 8.154 -14.845 -17.777 1.00 0.00 H new ATOM 0 HA ILE A 493 7.043 -16.771 -15.835 1.00 0.00 H new ATOM 0 HB ILE A 493 9.351 -16.939 -14.803 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.216 -15.666 -17.442 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.373 -14.953 -15.849 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.209 -18.670 -16.342 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.455 -18.819 -16.081 1.00 0.00 H new ATOM 0 HG23 ILE A 493 9.073 -18.115 -17.594 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.512 -15.819 -16.635 1.00 0.00 H new ATOM 0 HD12 ILE A 493 11.964 -16.718 -15.200 1.00 0.00 H new ATOM 0 HD13 ILE A 493 11.805 -17.442 -16.817 1.00 0.00 H new ATOM 704 N ALA A 494 7.822 -15.013 -13.889 1.00 0.00 N ATOM 705 CA ALA A 494 7.779 -13.918 -12.912 1.00 0.00 C ATOM 706 C ALA A 494 8.606 -14.300 -11.682 1.00 0.00 C ATOM 707 O ALA A 494 8.206 -15.185 -10.913 1.00 0.00 O ATOM 708 CB ALA A 494 6.325 -13.594 -12.523 1.00 0.00 C ATOM 0 H ALA A 494 7.915 -15.937 -13.467 1.00 0.00 H new ATOM 0 HA ALA A 494 8.207 -13.021 -13.359 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.315 -12.780 -11.798 1.00 0.00 H new ATOM 0 HB2 ALA A 494 5.769 -13.296 -13.411 1.00 0.00 H new ATOM 0 HB3 ALA A 494 5.861 -14.477 -12.084 1.00 0.00 H new ATOM 714 N TYR A 495 9.775 -13.650 -11.514 1.00 0.00 N ATOM 715 CA TYR A 495 10.635 -13.873 -10.349 1.00 0.00 C ATOM 716 C TYR A 495 10.106 -13.073 -9.159 1.00 0.00 C ATOM 717 O TYR A 495 10.281 -11.851 -9.098 1.00 0.00 O ATOM 718 CB TYR A 495 12.107 -13.469 -10.635 1.00 0.00 C ATOM 719 CG TYR A 495 13.037 -13.606 -9.410 1.00 0.00 C ATOM 720 CD1 TYR A 495 13.306 -14.858 -8.857 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.623 -12.492 -8.798 1.00 0.00 C ATOM 722 CE1 TYR A 495 14.123 -14.998 -7.754 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.443 -12.632 -7.692 1.00 0.00 C ATOM 724 CZ TYR A 495 14.691 -13.885 -7.177 1.00 0.00 C ATOM 725 OH TYR A 495 15.511 -14.030 -6.078 1.00 0.00 O ATOM 0 H TYR A 495 10.140 -12.966 -12.176 1.00 0.00 H new ATOM 0 HA TYR A 495 10.618 -14.939 -10.120 1.00 0.00 H new ATOM 0 HB2 TYR A 495 12.494 -14.088 -11.445 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.130 -12.437 -10.984 1.00 0.00 H new ATOM 0 HD1 TYR A 495 12.865 -15.738 -9.302 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.432 -11.506 -9.196 1.00 0.00 H new ATOM 0 HE1 TYR A 495 14.316 -15.978 -7.344 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.887 -11.761 -7.234 1.00 0.00 H new ATOM 0 HH TYR A 495 15.832 -13.150 -5.791 1.00 0.00 H new ATOM 735 N LYS A 496 9.478 -13.767 -8.211 1.00 0.00 N ATOM 736 CA LYS A 496 9.106 -13.176 -6.927 1.00 0.00 C ATOM 737 C LYS A 496 10.347 -13.132 -6.021 1.00 0.00 C ATOM 738 O LYS A 496 11.249 -13.974 -6.138 1.00 0.00 O ATOM 739 CB LYS A 496 7.955 -13.974 -6.263 1.00 0.00 C ATOM 740 CG LYS A 496 8.271 -15.464 -5.987 1.00 0.00 C ATOM 741 CD LYS A 496 7.085 -16.225 -5.359 1.00 0.00 C ATOM 742 CE LYS A 496 5.845 -16.276 -6.277 1.00 0.00 C ATOM 743 NZ LYS A 496 4.711 -16.976 -5.629 1.00 0.00 N ATOM 0 H LYS A 496 9.214 -14.747 -8.310 1.00 0.00 H new ATOM 0 HA LYS A 496 8.742 -12.161 -7.086 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.695 -13.492 -5.321 1.00 0.00 H new ATOM 0 HB3 LYS A 496 7.075 -13.917 -6.904 1.00 0.00 H new ATOM 0 HG2 LYS A 496 8.553 -15.949 -6.921 1.00 0.00 H new ATOM 0 HG3 LYS A 496 9.132 -15.530 -5.321 1.00 0.00 H new ATOM 0 HD2 LYS A 496 7.397 -17.242 -5.123 1.00 0.00 H new ATOM 0 HD3 LYS A 496 6.813 -15.749 -4.417 1.00 0.00 H new ATOM 0 HE2 LYS A 496 5.544 -15.262 -6.539 1.00 0.00 H new ATOM 0 HE3 LYS A 496 6.102 -16.783 -7.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 3.897 -16.990 -6.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 4.990 -17.952 -5.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 4.450 -16.478 -4.754 1.00 0.00 H new ATOM 757 N PHE A 497 10.394 -12.133 -5.148 1.00 0.00 N ATOM 758 CA PHE A 497 11.460 -11.974 -4.148 1.00 0.00 C ATOM 759 C PHE A 497 11.061 -12.660 -2.836 1.00 0.00 C ATOM 760 O PHE A 497 9.935 -13.152 -2.690 1.00 0.00 O ATOM 761 CB PHE A 497 11.750 -10.467 -3.940 1.00 0.00 C ATOM 762 CG PHE A 497 12.479 -9.820 -5.108 1.00 0.00 C ATOM 763 CD1 PHE A 497 13.866 -9.922 -5.218 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.790 -9.120 -6.102 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.539 -9.339 -6.272 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.464 -8.539 -7.156 1.00 0.00 C ATOM 767 CZ PHE A 497 13.838 -8.652 -7.242 1.00 0.00 C ATOM 0 H PHE A 497 9.688 -11.398 -5.108 1.00 0.00 H new ATOM 0 HA PHE A 497 12.373 -12.452 -4.503 1.00 0.00 H new ATOM 0 HB2 PHE A 497 10.808 -9.944 -3.776 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.346 -10.342 -3.036 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.421 -10.465 -4.467 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.715 -9.033 -6.044 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.614 -9.420 -6.338 1.00 0.00 H new ATOM 0 HE2 PHE A 497 11.918 -7.996 -7.913 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.365 -8.202 -8.070 1.00 0.00 H new ATOM 777 N THR A 498 12.010 -12.736 -1.905 1.00 0.00 N ATOM 778 CA THR A 498 11.788 -13.293 -0.567 1.00 0.00 C ATOM 779 C THR A 498 11.352 -12.163 0.397 1.00 0.00 C ATOM 780 O THR A 498 11.986 -11.101 0.413 1.00 0.00 O ATOM 781 CB THR A 498 13.095 -13.977 -0.061 1.00 0.00 C ATOM 782 OG1 THR A 498 14.167 -13.023 -0.055 1.00 0.00 O ATOM 783 CG2 THR A 498 13.491 -15.174 -0.947 1.00 0.00 C ATOM 0 H THR A 498 12.965 -12.410 -2.057 1.00 0.00 H new ATOM 0 HA THR A 498 10.998 -14.043 -0.606 1.00 0.00 H new ATOM 0 HB THR A 498 12.908 -14.345 0.948 1.00 0.00 H new ATOM 0 HG1 THR A 498 14.987 -13.454 0.265 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.406 -15.624 -0.563 1.00 0.00 H new ATOM 0 HG22 THR A 498 12.691 -15.914 -0.938 1.00 0.00 H new ATOM 0 HG23 THR A 498 13.656 -14.832 -1.968 1.00 0.00 H new ATOM 791 N PRO A 499 10.272 -12.365 1.231 1.00 0.00 N ATOM 792 CA PRO A 499 9.713 -11.297 2.111 1.00 0.00 C ATOM 793 C PRO A 499 10.559 -11.045 3.381 1.00 0.00 C ATOM 794 O PRO A 499 10.140 -10.314 4.290 1.00 0.00 O ATOM 795 CB PRO A 499 8.307 -11.844 2.444 1.00 0.00 C ATOM 796 CG PRO A 499 8.495 -13.332 2.475 1.00 0.00 C ATOM 797 CD PRO A 499 9.520 -13.644 1.397 1.00 0.00 C ATOM 0 HA PRO A 499 9.701 -10.319 1.629 1.00 0.00 H new ATOM 0 HB2 PRO A 499 7.948 -11.467 3.402 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.576 -11.550 1.691 1.00 0.00 H new ATOM 0 HG2 PRO A 499 8.844 -13.661 3.454 1.00 0.00 H new ATOM 0 HG3 PRO A 499 7.555 -13.849 2.282 1.00 0.00 H new ATOM 0 HD2 PRO A 499 10.179 -14.458 1.697 1.00 0.00 H new ATOM 0 HD3 PRO A 499 9.040 -13.949 0.467 1.00 0.00 H new ATOM 805 N LYS A 500 11.738 -11.674 3.424 1.00 0.00 N ATOM 806 CA LYS A 500 12.750 -11.488 4.473 1.00 0.00 C ATOM 807 C LYS A 500 13.884 -10.566 3.972 1.00 0.00 C ATOM 808 O LYS A 500 14.595 -9.958 4.780 1.00 0.00 O ATOM 809 CB LYS A 500 13.297 -12.877 4.899 1.00 0.00 C ATOM 810 CG LYS A 500 13.821 -13.748 3.728 1.00 0.00 C ATOM 811 CD LYS A 500 14.141 -15.197 4.151 1.00 0.00 C ATOM 812 CE LYS A 500 14.477 -16.103 2.951 1.00 0.00 C ATOM 813 NZ LYS A 500 14.666 -17.510 3.365 1.00 0.00 N ATOM 0 H LYS A 500 12.024 -12.345 2.711 1.00 0.00 H new ATOM 0 HA LYS A 500 12.299 -11.006 5.340 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.105 -12.731 5.616 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.507 -13.422 5.415 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.076 -13.764 2.932 1.00 0.00 H new ATOM 0 HG3 LYS A 500 14.719 -13.289 3.315 1.00 0.00 H new ATOM 0 HD2 LYS A 500 14.982 -15.192 4.845 1.00 0.00 H new ATOM 0 HD3 LYS A 500 13.288 -15.612 4.687 1.00 0.00 H new ATOM 0 HE2 LYS A 500 13.675 -16.045 2.215 1.00 0.00 H new ATOM 0 HE3 LYS A 500 15.383 -15.742 2.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 14.891 -18.090 2.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 15.448 -17.569 4.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 13.793 -17.862 3.807 1.00 0.00 H new ATOM 827 N TYR A 501 14.056 -10.475 2.634 1.00 0.00 N ATOM 828 CA TYR A 501 15.062 -9.594 2.018 1.00 0.00 C ATOM 829 C TYR A 501 14.482 -8.183 1.868 1.00 0.00 C ATOM 830 O TYR A 501 13.420 -7.998 1.271 1.00 0.00 O ATOM 831 CB TYR A 501 15.533 -10.136 0.637 1.00 0.00 C ATOM 832 CG TYR A 501 16.508 -9.189 -0.101 1.00 0.00 C ATOM 833 CD1 TYR A 501 17.838 -9.043 0.314 1.00 0.00 C ATOM 834 CD2 TYR A 501 16.081 -8.398 -1.175 1.00 0.00 C ATOM 835 CE1 TYR A 501 18.693 -8.158 -0.324 1.00 0.00 C ATOM 836 CE2 TYR A 501 16.933 -7.511 -1.803 1.00 0.00 C ATOM 837 CZ TYR A 501 18.232 -7.393 -1.379 1.00 0.00 C ATOM 838 OH TYR A 501 19.068 -6.498 -2.005 1.00 0.00 O ATOM 0 H TYR A 501 13.505 -11.007 1.960 1.00 0.00 H new ATOM 0 HA TYR A 501 15.935 -9.564 2.670 1.00 0.00 H new ATOM 0 HB2 TYR A 501 16.017 -11.102 0.781 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.660 -10.308 0.007 1.00 0.00 H new ATOM 0 HD1 TYR A 501 18.203 -9.629 1.144 1.00 0.00 H new ATOM 0 HD2 TYR A 501 15.061 -8.484 -1.520 1.00 0.00 H new ATOM 0 HE1 TYR A 501 19.718 -8.066 0.003 1.00 0.00 H new ATOM 0 HE2 TYR A 501 16.577 -6.911 -2.627 1.00 0.00 H new ATOM 0 HH TYR A 501 19.956 -6.899 -2.111 1.00 0.00 H new ATOM 848 N ILE A 502 15.173 -7.201 2.441 1.00 0.00 N ATOM 849 CA ILE A 502 14.846 -5.780 2.272 1.00 0.00 C ATOM 850 C ILE A 502 15.863 -5.150 1.308 1.00 0.00 C ATOM 851 O ILE A 502 17.071 -5.337 1.474 1.00 0.00 O ATOM 852 CB ILE A 502 14.855 -5.033 3.661 1.00 0.00 C ATOM 853 CG1 ILE A 502 13.767 -5.632 4.614 1.00 0.00 C ATOM 854 CG2 ILE A 502 14.691 -3.499 3.500 1.00 0.00 C ATOM 855 CD1 ILE A 502 13.645 -4.947 5.970 1.00 0.00 C ATOM 0 H ILE A 502 15.982 -7.366 3.040 1.00 0.00 H new ATOM 0 HA ILE A 502 13.843 -5.685 1.857 1.00 0.00 H new ATOM 0 HB ILE A 502 15.832 -5.194 4.116 1.00 0.00 H new ATOM 0 HG12 ILE A 502 12.801 -5.584 4.112 1.00 0.00 H new ATOM 0 HG13 ILE A 502 13.990 -6.687 4.776 1.00 0.00 H new ATOM 0 HG21 ILE A 502 14.703 -3.027 4.482 1.00 0.00 H new ATOM 0 HG22 ILE A 502 15.511 -3.107 2.899 1.00 0.00 H new ATOM 0 HG23 ILE A 502 13.744 -3.284 3.006 1.00 0.00 H new ATOM 0 HD11 ILE A 502 12.866 -5.435 6.555 1.00 0.00 H new ATOM 0 HD12 ILE A 502 14.595 -5.018 6.500 1.00 0.00 H new ATOM 0 HD13 ILE A 502 13.387 -3.898 5.826 1.00 0.00 H new ATOM 867 N LEU A 503 15.357 -4.433 0.292 1.00 0.00 N ATOM 868 CA LEU A 503 16.194 -3.673 -0.660 1.00 0.00 C ATOM 869 C LEU A 503 16.553 -2.328 0.002 1.00 0.00 C ATOM 870 O LEU A 503 15.663 -1.603 0.454 1.00 0.00 O ATOM 871 CB LEU A 503 15.444 -3.452 -2.019 1.00 0.00 C ATOM 872 CG LEU A 503 16.314 -3.513 -3.333 1.00 0.00 C ATOM 873 CD1 LEU A 503 15.470 -3.132 -4.564 1.00 0.00 C ATOM 874 CD2 LEU A 503 17.611 -2.666 -3.254 1.00 0.00 C ATOM 0 H LEU A 503 14.357 -4.362 0.104 1.00 0.00 H new ATOM 0 HA LEU A 503 17.101 -4.231 -0.891 1.00 0.00 H new ATOM 0 HB2 LEU A 503 14.657 -4.202 -2.098 1.00 0.00 H new ATOM 0 HB3 LEU A 503 14.954 -2.479 -1.982 1.00 0.00 H new ATOM 0 HG LEU A 503 16.641 -4.547 -3.439 1.00 0.00 H new ATOM 0 HD11 LEU A 503 16.090 -3.181 -5.459 1.00 0.00 H new ATOM 0 HD12 LEU A 503 14.636 -3.826 -4.662 1.00 0.00 H new ATOM 0 HD13 LEU A 503 15.087 -2.119 -4.443 1.00 0.00 H new ATOM 0 HD21 LEU A 503 18.161 -2.754 -4.191 1.00 0.00 H new ATOM 0 HD22 LEU A 503 17.353 -1.621 -3.081 1.00 0.00 H new ATOM 0 HD23 LEU A 503 18.232 -3.027 -2.434 1.00 0.00 H new ATOM 886 N ARG A 504 17.850 -1.998 0.036 1.00 0.00 N ATOM 887 CA ARG A 504 18.370 -0.895 0.868 1.00 0.00 C ATOM 888 C ARG A 504 18.334 0.468 0.142 1.00 0.00 C ATOM 889 O ARG A 504 18.290 0.535 -1.096 1.00 0.00 O ATOM 890 CB ARG A 504 19.800 -1.219 1.375 1.00 0.00 C ATOM 891 CG ARG A 504 19.905 -2.468 2.295 1.00 0.00 C ATOM 892 CD ARG A 504 19.885 -3.809 1.529 1.00 0.00 C ATOM 893 NE ARG A 504 19.927 -4.980 2.419 1.00 0.00 N ATOM 894 CZ ARG A 504 21.031 -5.480 2.988 1.00 0.00 C ATOM 895 NH1 ARG A 504 22.219 -4.913 2.798 1.00 0.00 N ATOM 896 NH2 ARG A 504 20.941 -6.561 3.751 1.00 0.00 N ATOM 0 H ARG A 504 18.567 -2.481 -0.506 1.00 0.00 H new ATOM 0 HA ARG A 504 17.706 -0.805 1.728 1.00 0.00 H new ATOM 0 HB2 ARG A 504 20.450 -1.366 0.513 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.181 -0.354 1.918 1.00 0.00 H new ATOM 0 HG2 ARG A 504 20.826 -2.405 2.874 1.00 0.00 H new ATOM 0 HG3 ARG A 504 19.079 -2.454 3.007 1.00 0.00 H new ATOM 0 HD2 ARG A 504 18.985 -3.858 0.916 1.00 0.00 H new ATOM 0 HD3 ARG A 504 20.736 -3.846 0.849 1.00 0.00 H new ATOM 0 HE ARG A 504 19.043 -5.449 2.619 1.00 0.00 H new ATOM 0 HH11 ARG A 504 22.300 -4.083 2.211 1.00 0.00 H new ATOM 0 HH12 ARG A 504 23.049 -5.308 3.240 1.00 0.00 H new ATOM 0 HH21 ARG A 504 20.035 -7.005 3.901 1.00 0.00 H new ATOM 0 HH22 ARG A 504 21.778 -6.948 4.188 1.00 0.00 H new ATOM 910 N ALA A 505 18.362 1.545 0.955 1.00 0.00 N ATOM 911 CA ALA A 505 18.239 2.947 0.499 1.00 0.00 C ATOM 912 C ALA A 505 19.400 3.373 -0.423 1.00 0.00 C ATOM 913 O ALA A 505 20.577 3.214 -0.062 1.00 0.00 O ATOM 914 CB ALA A 505 18.187 3.877 1.714 1.00 0.00 C ATOM 0 H ALA A 505 18.473 1.464 1.966 1.00 0.00 H new ATOM 0 HA ALA A 505 17.318 3.021 -0.080 1.00 0.00 H new ATOM 0 HB1 ALA A 505 18.096 4.910 1.378 1.00 0.00 H new ATOM 0 HB2 ALA A 505 17.327 3.620 2.332 1.00 0.00 H new ATOM 0 HB3 ALA A 505 19.101 3.764 2.298 1.00 0.00 H new ATOM 920 N GLY A 506 19.049 3.907 -1.612 1.00 0.00 N ATOM 921 CA GLY A 506 20.028 4.405 -2.588 1.00 0.00 C ATOM 922 C GLY A 506 20.916 3.314 -3.179 1.00 0.00 C ATOM 923 O GLY A 506 21.947 3.614 -3.792 1.00 0.00 O ATOM 0 H GLY A 506 18.080 4.003 -1.917 1.00 0.00 H new ATOM 0 HA2 GLY A 506 19.498 4.907 -3.397 1.00 0.00 H new ATOM 0 HA3 GLY A 506 20.658 5.153 -2.107 1.00 0.00 H new ATOM 927 N GLN A 507 20.515 2.042 -2.991 1.00 0.00 N ATOM 928 CA GLN A 507 21.283 0.863 -3.435 1.00 0.00 C ATOM 929 C GLN A 507 20.625 0.234 -4.673 1.00 0.00 C ATOM 930 O GLN A 507 19.819 0.880 -5.351 1.00 0.00 O ATOM 931 CB GLN A 507 21.412 -0.157 -2.264 1.00 0.00 C ATOM 932 CG GLN A 507 22.142 0.371 -1.009 1.00 0.00 C ATOM 933 CD GLN A 507 23.478 1.050 -1.321 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.505 0.387 -1.445 1.00 0.00 O ATOM 935 NE2 GLN A 507 23.480 2.374 -1.409 1.00 0.00 N ATOM 0 H GLN A 507 19.641 1.802 -2.523 1.00 0.00 H new ATOM 0 HA GLN A 507 22.289 1.171 -3.722 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.413 -0.481 -1.974 1.00 0.00 H new ATOM 0 HB3 GLN A 507 21.940 -1.039 -2.628 1.00 0.00 H new ATOM 0 HG2 GLN A 507 21.495 1.080 -0.493 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.316 -0.458 -0.324 1.00 0.00 H new ATOM 0 HE21 GLN A 507 22.609 2.894 -1.301 1.00 0.00 H new ATOM 0 HE22 GLN A 507 24.353 2.872 -1.585 1.00 0.00 H new ATOM 944 N MET A 508 21.017 -1.014 -4.977 1.00 0.00 N ATOM 945 CA MET A 508 20.554 -1.758 -6.160 1.00 0.00 C ATOM 946 C MET A 508 20.604 -3.277 -5.895 1.00 0.00 C ATOM 947 O MET A 508 21.264 -3.728 -4.948 1.00 0.00 O ATOM 948 CB MET A 508 21.429 -1.371 -7.388 1.00 0.00 C ATOM 949 CG MET A 508 22.934 -1.550 -7.191 1.00 0.00 C ATOM 950 SD MET A 508 23.883 -1.094 -8.664 1.00 0.00 S ATOM 951 CE MET A 508 25.568 -1.364 -8.113 1.00 0.00 C ATOM 0 H MET A 508 21.673 -1.541 -4.401 1.00 0.00 H new ATOM 0 HA MET A 508 19.518 -1.495 -6.373 1.00 0.00 H new ATOM 0 HB2 MET A 508 21.116 -1.971 -8.242 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.232 -0.329 -7.641 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.262 -0.942 -6.348 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.143 -2.589 -6.935 1.00 0.00 H new ATOM 0 HE1 MET A 508 26.258 -1.122 -8.921 1.00 0.00 H new ATOM 0 HE2 MET A 508 25.777 -0.726 -7.254 1.00 0.00 H new ATOM 0 HE3 MET A 508 25.695 -2.408 -7.828 1.00 0.00 H new ATOM 961 N VAL A 509 19.897 -4.058 -6.735 1.00 0.00 N ATOM 962 CA VAL A 509 19.890 -5.529 -6.655 1.00 0.00 C ATOM 963 C VAL A 509 19.943 -6.106 -8.085 1.00 0.00 C ATOM 964 O VAL A 509 19.061 -5.852 -8.915 1.00 0.00 O ATOM 965 CB VAL A 509 18.652 -6.090 -5.833 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.288 -5.663 -6.432 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.739 -7.629 -5.670 1.00 0.00 C ATOM 0 H VAL A 509 19.316 -3.686 -7.486 1.00 0.00 H new ATOM 0 HA VAL A 509 20.772 -5.852 -6.103 1.00 0.00 H new ATOM 0 HB VAL A 509 18.707 -5.638 -4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.480 -6.076 -5.828 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.217 -4.575 -6.437 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.206 -6.037 -7.453 1.00 0.00 H new ATOM 0 HG21 VAL A 509 17.878 -7.984 -5.103 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.745 -8.099 -6.653 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.655 -7.887 -5.139 1.00 0.00 H new ATOM 977 N THR A 510 21.030 -6.828 -8.382 1.00 0.00 N ATOM 978 CA THR A 510 21.268 -7.419 -9.701 1.00 0.00 C ATOM 979 C THR A 510 20.800 -8.884 -9.687 1.00 0.00 C ATOM 980 O THR A 510 21.476 -9.751 -9.120 1.00 0.00 O ATOM 981 CB THR A 510 22.792 -7.330 -10.080 1.00 0.00 C ATOM 982 OG1 THR A 510 23.366 -6.138 -9.514 1.00 0.00 O ATOM 983 CG2 THR A 510 23.009 -7.307 -11.606 1.00 0.00 C ATOM 0 H THR A 510 21.772 -7.019 -7.709 1.00 0.00 H new ATOM 0 HA THR A 510 20.704 -6.866 -10.452 1.00 0.00 H new ATOM 0 HB THR A 510 23.277 -8.219 -9.678 1.00 0.00 H new ATOM 0 HG1 THR A 510 24.315 -6.088 -9.752 1.00 0.00 H new ATOM 0 HG21 THR A 510 24.076 -7.245 -11.821 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.603 -8.218 -12.045 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.502 -6.441 -12.033 1.00 0.00 H new ATOM 991 N VAL A 511 19.616 -9.142 -10.258 1.00 0.00 N ATOM 992 CA VAL A 511 19.037 -10.492 -10.313 1.00 0.00 C ATOM 993 C VAL A 511 19.538 -11.238 -11.560 1.00 0.00 C ATOM 994 O VAL A 511 19.126 -10.930 -12.678 1.00 0.00 O ATOM 995 CB VAL A 511 17.468 -10.467 -10.287 1.00 0.00 C ATOM 996 CG1 VAL A 511 16.882 -11.911 -10.323 1.00 0.00 C ATOM 997 CG2 VAL A 511 16.960 -9.676 -9.052 1.00 0.00 C ATOM 0 H VAL A 511 19.035 -8.425 -10.693 1.00 0.00 H new ATOM 0 HA VAL A 511 19.367 -11.022 -9.419 1.00 0.00 H new ATOM 0 HB VAL A 511 17.117 -9.954 -11.183 1.00 0.00 H new ATOM 0 HG11 VAL A 511 15.793 -11.862 -10.304 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.207 -12.413 -11.234 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.235 -12.469 -9.456 1.00 0.00 H new ATOM 0 HG21 VAL A 511 15.870 -9.668 -9.048 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.322 -10.152 -8.141 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.330 -8.652 -9.098 1.00 0.00 H new ATOM 1007 N TRP A 512 20.447 -12.199 -11.347 1.00 0.00 N ATOM 1008 CA TRP A 512 21.031 -13.026 -12.421 1.00 0.00 C ATOM 1009 C TRP A 512 20.267 -14.355 -12.583 1.00 0.00 C ATOM 1010 O TRP A 512 19.296 -14.627 -11.871 1.00 0.00 O ATOM 1011 CB TRP A 512 22.523 -13.314 -12.111 1.00 0.00 C ATOM 1012 CG TRP A 512 23.458 -12.127 -12.236 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.484 -11.010 -11.456 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.512 -11.955 -13.200 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.498 -10.179 -11.851 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.137 -10.728 -12.922 1.00 0.00 C ATOM 1017 CE3 TRP A 512 24.990 -12.726 -14.261 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.205 -10.245 -13.672 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.049 -12.251 -15.007 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.654 -11.022 -14.705 1.00 0.00 C ATOM 0 H TRP A 512 20.803 -12.429 -10.419 1.00 0.00 H new ATOM 0 HA TRP A 512 20.951 -12.472 -13.356 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.596 -13.706 -11.097 1.00 0.00 H new ATOM 0 HB3 TRP A 512 22.870 -14.100 -12.782 1.00 0.00 H new ATOM 0 HD1 TRP A 512 22.802 -10.809 -10.643 1.00 0.00 H new ATOM 0 HE1 TRP A 512 24.737 -9.290 -11.413 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.538 -13.679 -14.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.662 -9.293 -13.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.418 -12.835 -15.837 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.490 -10.683 -15.299 1.00 0.00 H new ATOM 1031 N ALA A 513 20.728 -15.166 -13.551 1.00 0.00 N ATOM 1032 CA ALA A 513 20.249 -16.544 -13.780 1.00 0.00 C ATOM 1033 C ALA A 513 21.312 -17.551 -13.332 1.00 0.00 C ATOM 1034 O ALA A 513 22.508 -17.231 -13.313 1.00 0.00 O ATOM 1035 CB ALA A 513 19.945 -16.755 -15.271 1.00 0.00 C ATOM 0 H ALA A 513 21.455 -14.880 -14.207 1.00 0.00 H new ATOM 0 HA ALA A 513 19.339 -16.697 -13.200 1.00 0.00 H new ATOM 0 HB1 ALA A 513 19.592 -17.774 -15.430 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.176 -16.051 -15.589 1.00 0.00 H new ATOM 0 HB3 ALA A 513 20.851 -16.590 -15.854 1.00 0.00 H new ATOM 1041 N ALA A 514 20.872 -18.776 -12.996 1.00 0.00 N ATOM 1042 CA ALA A 514 21.777 -19.910 -12.704 1.00 0.00 C ATOM 1043 C ALA A 514 22.560 -20.319 -13.972 1.00 0.00 C ATOM 1044 O ALA A 514 23.729 -20.722 -13.903 1.00 0.00 O ATOM 1045 CB ALA A 514 20.968 -21.097 -12.159 1.00 0.00 C ATOM 0 H ALA A 514 19.883 -19.011 -12.918 1.00 0.00 H new ATOM 0 HA ALA A 514 22.498 -19.601 -11.947 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.640 -21.928 -11.946 1.00 0.00 H new ATOM 0 HB2 ALA A 514 20.457 -20.799 -11.243 1.00 0.00 H new ATOM 0 HB3 ALA A 514 20.232 -21.407 -12.901 1.00 0.00 H new ATOM 1051 N GLY A 515 21.895 -20.172 -15.139 1.00 0.00 N ATOM 1052 CA GLY A 515 22.487 -20.513 -16.440 1.00 0.00 C ATOM 1053 C GLY A 515 23.452 -19.463 -16.974 1.00 0.00 C ATOM 1054 O GLY A 515 24.065 -19.664 -18.024 1.00 0.00 O ATOM 0 H GLY A 515 20.941 -19.816 -15.200 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.013 -21.463 -16.351 1.00 0.00 H new ATOM 0 HA3 GLY A 515 21.686 -20.659 -17.165 1.00 0.00 H new ATOM 1058 N ALA A 516 23.585 -18.335 -16.252 1.00 0.00 N ATOM 1059 CA ALA A 516 24.630 -17.327 -16.520 1.00 0.00 C ATOM 1060 C ALA A 516 26.006 -17.813 -15.988 1.00 0.00 C ATOM 1061 O ALA A 516 27.042 -17.180 -16.245 1.00 0.00 O ATOM 1062 CB ALA A 516 24.232 -15.978 -15.894 1.00 0.00 C ATOM 0 H ALA A 516 22.975 -18.096 -15.470 1.00 0.00 H new ATOM 0 HA ALA A 516 24.723 -17.189 -17.597 1.00 0.00 H new ATOM 0 HB1 ALA A 516 25.008 -15.240 -16.096 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.289 -15.641 -16.325 1.00 0.00 H new ATOM 0 HB3 ALA A 516 24.116 -16.097 -14.817 1.00 0.00 H new ATOM 1068 N GLY A 517 25.989 -18.945 -15.235 1.00 0.00 N ATOM 1069 CA GLY A 517 27.201 -19.583 -14.701 1.00 0.00 C ATOM 1070 C GLY A 517 27.813 -18.824 -13.530 1.00 0.00 C ATOM 1071 O GLY A 517 28.991 -19.002 -13.202 1.00 0.00 O ATOM 0 H GLY A 517 25.129 -19.434 -14.987 1.00 0.00 H new ATOM 0 HA2 GLY A 517 26.960 -20.597 -14.382 1.00 0.00 H new ATOM 0 HA3 GLY A 517 27.940 -19.667 -15.497 1.00 0.00 H new ATOM 1075 N VAL A 518 26.985 -17.995 -12.884 1.00 0.00 N ATOM 1076 CA VAL A 518 27.401 -17.072 -11.818 1.00 0.00 C ATOM 1077 C VAL A 518 26.923 -17.587 -10.444 1.00 0.00 C ATOM 1078 O VAL A 518 25.841 -18.189 -10.325 1.00 0.00 O ATOM 1079 CB VAL A 518 26.836 -15.627 -12.116 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.293 -15.638 -12.223 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.332 -14.570 -11.087 1.00 0.00 C ATOM 0 H VAL A 518 25.987 -17.945 -13.090 1.00 0.00 H new ATOM 0 HA VAL A 518 28.489 -17.018 -11.791 1.00 0.00 H new ATOM 0 HB VAL A 518 27.235 -15.326 -13.085 1.00 0.00 H new ATOM 0 HG11 VAL A 518 24.935 -14.629 -12.428 1.00 0.00 H new ATOM 0 HG12 VAL A 518 24.989 -16.302 -13.032 1.00 0.00 H new ATOM 0 HG13 VAL A 518 24.866 -15.990 -11.284 1.00 0.00 H new ATOM 0 HG21 VAL A 518 26.915 -13.595 -11.337 1.00 0.00 H new ATOM 0 HG22 VAL A 518 27.009 -14.857 -10.086 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.420 -14.517 -11.116 1.00 0.00 H new ATOM 1091 N ALA A 519 27.760 -17.372 -9.417 1.00 0.00 N ATOM 1092 CA ALA A 519 27.459 -17.752 -8.035 1.00 0.00 C ATOM 1093 C ALA A 519 26.682 -16.630 -7.328 1.00 0.00 C ATOM 1094 O ALA A 519 26.942 -15.440 -7.556 1.00 0.00 O ATOM 1095 CB ALA A 519 28.757 -18.098 -7.287 1.00 0.00 C ATOM 0 H ALA A 519 28.671 -16.926 -9.527 1.00 0.00 H new ATOM 0 HA ALA A 519 26.827 -18.640 -8.038 1.00 0.00 H new ATOM 0 HB1 ALA A 519 28.522 -18.379 -6.261 1.00 0.00 H new ATOM 0 HB2 ALA A 519 29.254 -18.930 -7.786 1.00 0.00 H new ATOM 0 HB3 ALA A 519 29.417 -17.231 -7.283 1.00 0.00 H new ATOM 1101 N HIS A 520 25.708 -17.033 -6.494 1.00 0.00 N ATOM 1102 CA HIS A 520 24.899 -16.117 -5.676 1.00 0.00 C ATOM 1103 C HIS A 520 25.809 -15.356 -4.697 1.00 0.00 C ATOM 1104 O HIS A 520 26.496 -15.974 -3.877 1.00 0.00 O ATOM 1105 CB HIS A 520 23.804 -16.935 -4.938 1.00 0.00 C ATOM 1106 CG HIS A 520 22.897 -16.152 -4.013 1.00 0.00 C ATOM 1107 ND1 HIS A 520 22.481 -16.612 -2.780 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.297 -14.946 -4.174 1.00 0.00 C ATOM 1109 CE1 HIS A 520 21.659 -15.699 -2.252 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.515 -14.666 -3.060 1.00 0.00 N ATOM 0 H HIS A 520 25.459 -18.014 -6.369 1.00 0.00 H new ATOM 0 HA HIS A 520 24.405 -15.376 -6.304 1.00 0.00 H new ATOM 0 HB2 HIS A 520 23.185 -17.432 -5.685 1.00 0.00 H new ATOM 0 HB3 HIS A 520 24.293 -17.717 -4.358 1.00 0.00 H new ATOM 0 HD1 HIS A 520 22.753 -17.495 -2.347 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.410 -14.303 -5.035 1.00 0.00 H new ATOM 0 HE1 HIS A 520 21.176 -15.795 -1.291 1.00 0.00 H new ATOM 1118 N SER A 521 25.830 -14.018 -4.820 1.00 0.00 N ATOM 1119 CA SER A 521 26.673 -13.135 -3.991 1.00 0.00 C ATOM 1120 C SER A 521 25.813 -11.991 -3.397 1.00 0.00 C ATOM 1121 O SER A 521 25.864 -10.851 -3.877 1.00 0.00 O ATOM 1122 CB SER A 521 27.844 -12.586 -4.843 1.00 0.00 C ATOM 1123 OG SER A 521 28.612 -13.640 -5.406 1.00 0.00 O ATOM 0 H SER A 521 25.260 -13.515 -5.500 1.00 0.00 H new ATOM 0 HA SER A 521 27.095 -13.699 -3.160 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.452 -11.954 -5.639 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.484 -11.958 -4.223 1.00 0.00 H new ATOM 0 HG SER A 521 28.065 -14.135 -6.051 1.00 0.00 H new ATOM 1129 N PRO A 522 24.977 -12.288 -2.349 1.00 0.00 N ATOM 1130 CA PRO A 522 24.056 -11.291 -1.750 1.00 0.00 C ATOM 1131 C PRO A 522 24.813 -10.254 -0.859 1.00 0.00 C ATOM 1132 O PRO A 522 25.952 -10.514 -0.447 1.00 0.00 O ATOM 1133 CB PRO A 522 23.088 -12.182 -0.928 1.00 0.00 C ATOM 1134 CG PRO A 522 23.934 -13.338 -0.491 1.00 0.00 C ATOM 1135 CD PRO A 522 24.874 -13.607 -1.653 1.00 0.00 C ATOM 0 HA PRO A 522 23.546 -10.673 -2.489 1.00 0.00 H new ATOM 0 HB2 PRO A 522 22.679 -11.643 -0.074 1.00 0.00 H new ATOM 0 HB3 PRO A 522 22.242 -12.513 -1.531 1.00 0.00 H new ATOM 0 HG2 PRO A 522 24.488 -13.099 0.416 1.00 0.00 H new ATOM 0 HG3 PRO A 522 23.322 -14.212 -0.270 1.00 0.00 H new ATOM 0 HD2 PRO A 522 25.848 -13.952 -1.306 1.00 0.00 H new ATOM 0 HD3 PRO A 522 24.480 -14.378 -2.315 1.00 0.00 H new ATOM 1143 N PRO A 523 24.211 -9.054 -0.543 1.00 0.00 N ATOM 1144 CA PRO A 523 22.848 -8.643 -0.969 1.00 0.00 C ATOM 1145 C PRO A 523 22.824 -7.858 -2.303 1.00 0.00 C ATOM 1146 O PRO A 523 21.834 -7.193 -2.616 1.00 0.00 O ATOM 1147 CB PRO A 523 22.407 -7.773 0.229 1.00 0.00 C ATOM 1148 CG PRO A 523 23.668 -7.093 0.698 1.00 0.00 C ATOM 1149 CD PRO A 523 24.835 -7.995 0.299 1.00 0.00 C ATOM 0 HA PRO A 523 22.192 -9.487 -1.182 1.00 0.00 H new ATOM 0 HB2 PRO A 523 21.652 -7.045 -0.068 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.969 -8.382 1.020 1.00 0.00 H new ATOM 0 HG2 PRO A 523 23.768 -6.108 0.242 1.00 0.00 H new ATOM 0 HG3 PRO A 523 23.647 -6.944 1.778 1.00 0.00 H new ATOM 0 HD2 PRO A 523 25.594 -7.442 -0.255 1.00 0.00 H new ATOM 0 HD3 PRO A 523 25.326 -8.421 1.174 1.00 0.00 H new ATOM 1157 N SER A 524 23.913 -7.956 -3.083 1.00 0.00 N ATOM 1158 CA SER A 524 24.029 -7.292 -4.393 1.00 0.00 C ATOM 1159 C SER A 524 23.513 -8.230 -5.511 1.00 0.00 C ATOM 1160 O SER A 524 22.458 -7.997 -6.103 1.00 0.00 O ATOM 1161 CB SER A 524 25.507 -6.899 -4.642 1.00 0.00 C ATOM 1162 OG SER A 524 26.034 -6.154 -3.556 1.00 0.00 O ATOM 0 H SER A 524 24.738 -8.497 -2.824 1.00 0.00 H new ATOM 0 HA SER A 524 23.419 -6.388 -4.400 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.104 -7.799 -4.792 1.00 0.00 H new ATOM 0 HB3 SER A 524 25.580 -6.312 -5.557 1.00 0.00 H new ATOM 0 HG SER A 524 26.968 -5.922 -3.741 1.00 0.00 H new ATOM 1168 N THR A 525 24.264 -9.321 -5.748 1.00 0.00 N ATOM 1169 CA THR A 525 23.995 -10.290 -6.820 1.00 0.00 C ATOM 1170 C THR A 525 23.075 -11.414 -6.306 1.00 0.00 C ATOM 1171 O THR A 525 23.543 -12.360 -5.665 1.00 0.00 O ATOM 1172 CB THR A 525 25.352 -10.881 -7.354 1.00 0.00 C ATOM 1173 OG1 THR A 525 26.199 -9.812 -7.799 1.00 0.00 O ATOM 1174 CG2 THR A 525 25.169 -11.895 -8.500 1.00 0.00 C ATOM 0 H THR A 525 25.086 -9.555 -5.191 1.00 0.00 H new ATOM 0 HA THR A 525 23.486 -9.784 -7.641 1.00 0.00 H new ATOM 0 HB THR A 525 25.807 -11.420 -6.523 1.00 0.00 H new ATOM 0 HG1 THR A 525 27.045 -10.181 -8.130 1.00 0.00 H new ATOM 0 HG21 THR A 525 26.144 -12.262 -8.820 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.562 -12.731 -8.152 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.671 -11.410 -9.339 1.00 0.00 H new ATOM 1182 N LEU A 526 21.753 -11.271 -6.530 1.00 0.00 N ATOM 1183 CA LEU A 526 20.777 -12.334 -6.224 1.00 0.00 C ATOM 1184 C LEU A 526 20.573 -13.194 -7.485 1.00 0.00 C ATOM 1185 O LEU A 526 19.921 -12.775 -8.431 1.00 0.00 O ATOM 1186 CB LEU A 526 19.425 -11.737 -5.695 1.00 0.00 C ATOM 1187 CG LEU A 526 19.368 -11.414 -4.157 1.00 0.00 C ATOM 1188 CD1 LEU A 526 20.460 -10.410 -3.716 1.00 0.00 C ATOM 1189 CD2 LEU A 526 17.953 -10.934 -3.736 1.00 0.00 C ATOM 0 H LEU A 526 21.337 -10.427 -6.923 1.00 0.00 H new ATOM 0 HA LEU A 526 21.163 -12.964 -5.423 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.215 -10.820 -6.246 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.625 -12.439 -5.928 1.00 0.00 H new ATOM 0 HG LEU A 526 19.578 -12.347 -3.634 1.00 0.00 H new ATOM 0 HD11 LEU A 526 20.373 -10.224 -2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 526 21.444 -10.824 -3.933 1.00 0.00 H new ATOM 0 HD13 LEU A 526 20.333 -9.473 -4.258 1.00 0.00 H new ATOM 0 HD21 LEU A 526 17.945 -10.718 -2.668 1.00 0.00 H new ATOM 0 HD22 LEU A 526 17.695 -10.032 -4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 526 17.224 -11.715 -3.954 1.00 0.00 H new ATOM 1201 N VAL A 527 21.154 -14.398 -7.486 1.00 0.00 N ATOM 1202 CA VAL A 527 21.070 -15.333 -8.617 1.00 0.00 C ATOM 1203 C VAL A 527 19.864 -16.255 -8.416 1.00 0.00 C ATOM 1204 O VAL A 527 19.756 -16.906 -7.370 1.00 0.00 O ATOM 1205 CB VAL A 527 22.393 -16.178 -8.744 1.00 0.00 C ATOM 1206 CG1 VAL A 527 22.303 -17.243 -9.868 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.608 -15.244 -8.955 1.00 0.00 C ATOM 0 H VAL A 527 21.698 -14.755 -6.700 1.00 0.00 H new ATOM 0 HA VAL A 527 20.947 -14.767 -9.540 1.00 0.00 H new ATOM 0 HB VAL A 527 22.528 -16.722 -7.809 1.00 0.00 H new ATOM 0 HG11 VAL A 527 23.239 -17.800 -9.917 1.00 0.00 H new ATOM 0 HG12 VAL A 527 21.483 -17.929 -9.655 1.00 0.00 H new ATOM 0 HG13 VAL A 527 22.124 -16.750 -10.823 1.00 0.00 H new ATOM 0 HG21 VAL A 527 24.516 -15.841 -9.041 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.467 -14.664 -9.867 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.698 -14.567 -8.105 1.00 0.00 H new ATOM 1217 N TRP A 528 18.945 -16.283 -9.402 1.00 0.00 N ATOM 1218 CA TRP A 528 17.813 -17.223 -9.414 1.00 0.00 C ATOM 1219 C TRP A 528 18.359 -18.633 -9.710 1.00 0.00 C ATOM 1220 O TRP A 528 18.497 -19.040 -10.873 1.00 0.00 O ATOM 1221 CB TRP A 528 16.728 -16.788 -10.451 1.00 0.00 C ATOM 1222 CG TRP A 528 15.390 -17.516 -10.338 1.00 0.00 C ATOM 1223 CD1 TRP A 528 15.022 -18.480 -9.430 1.00 0.00 C ATOM 1224 CD2 TRP A 528 14.231 -17.296 -11.158 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.729 -18.871 -9.649 1.00 0.00 N ATOM 1226 CE2 TRP A 528 13.216 -18.158 -10.698 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.958 -16.457 -12.234 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.949 -18.197 -11.280 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 12.704 -16.497 -12.807 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.714 -17.358 -12.332 1.00 0.00 C ATOM 0 H TRP A 528 18.969 -15.657 -10.207 1.00 0.00 H new ATOM 0 HA TRP A 528 17.320 -17.225 -8.442 1.00 0.00 H new ATOM 0 HB2 TRP A 528 16.551 -15.718 -10.341 1.00 0.00 H new ATOM 0 HB3 TRP A 528 17.124 -16.944 -11.454 1.00 0.00 H new ATOM 0 HD1 TRP A 528 15.662 -18.873 -8.654 1.00 0.00 H new ATOM 0 HE1 TRP A 528 13.228 -19.581 -9.115 1.00 0.00 H new ATOM 0 HE3 TRP A 528 14.715 -15.786 -12.614 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 11.183 -18.865 -10.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.484 -15.848 -13.641 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.743 -17.361 -12.805 1.00 0.00 H new ATOM 1241 N LYS A 529 18.721 -19.338 -8.626 1.00 0.00 N ATOM 1242 CA LYS A 529 19.346 -20.659 -8.689 1.00 0.00 C ATOM 1243 C LYS A 529 18.268 -21.707 -9.023 1.00 0.00 C ATOM 1244 O LYS A 529 17.320 -21.881 -8.251 1.00 0.00 O ATOM 1245 CB LYS A 529 20.045 -20.968 -7.333 1.00 0.00 C ATOM 1246 CG LYS A 529 21.092 -22.103 -7.379 1.00 0.00 C ATOM 1247 CD LYS A 529 22.301 -21.748 -8.281 1.00 0.00 C ATOM 1248 CE LYS A 529 23.414 -22.809 -8.230 1.00 0.00 C ATOM 1249 NZ LYS A 529 22.958 -24.134 -8.723 1.00 0.00 N ATOM 0 H LYS A 529 18.584 -18.999 -7.674 1.00 0.00 H new ATOM 0 HA LYS A 529 20.106 -20.686 -9.470 1.00 0.00 H new ATOM 0 HB2 LYS A 529 20.532 -20.060 -6.978 1.00 0.00 H new ATOM 0 HB3 LYS A 529 19.282 -21.228 -6.600 1.00 0.00 H new ATOM 0 HG2 LYS A 529 21.444 -22.312 -6.369 1.00 0.00 H new ATOM 0 HG3 LYS A 529 20.621 -23.014 -7.747 1.00 0.00 H new ATOM 0 HD2 LYS A 529 21.960 -21.635 -9.310 1.00 0.00 H new ATOM 0 HD3 LYS A 529 22.708 -20.785 -7.972 1.00 0.00 H new ATOM 0 HE2 LYS A 529 24.260 -22.473 -8.830 1.00 0.00 H new ATOM 0 HE3 LYS A 529 23.770 -22.909 -7.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 23.743 -24.814 -8.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 22.168 -24.470 -8.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 22.643 -24.047 -9.710 1.00 0.00 H new ATOM 1263 N GLY A 530 18.421 -22.385 -10.170 1.00 0.00 N ATOM 1264 CA GLY A 530 17.412 -23.310 -10.696 1.00 0.00 C ATOM 1265 C GLY A 530 16.970 -22.926 -12.107 1.00 0.00 C ATOM 1266 O GLY A 530 16.793 -23.799 -12.965 1.00 0.00 O ATOM 0 H GLY A 530 19.250 -22.306 -10.759 1.00 0.00 H new ATOM 0 HA2 GLY A 530 17.816 -24.322 -10.705 1.00 0.00 H new ATOM 0 HA3 GLY A 530 16.546 -23.318 -10.034 1.00 0.00 H new ATOM 1270 N GLN A 531 16.801 -21.611 -12.356 1.00 0.00 N ATOM 1271 CA GLN A 531 16.369 -21.091 -13.676 1.00 0.00 C ATOM 1272 C GLN A 531 17.607 -20.718 -14.508 1.00 0.00 C ATOM 1273 O GLN A 531 18.364 -19.816 -14.132 1.00 0.00 O ATOM 1274 CB GLN A 531 15.402 -19.862 -13.516 1.00 0.00 C ATOM 1275 CG GLN A 531 14.029 -20.001 -14.236 1.00 0.00 C ATOM 1276 CD GLN A 531 14.073 -19.932 -15.774 1.00 0.00 C ATOM 1277 OE1 GLN A 531 15.067 -20.267 -16.411 1.00 0.00 O ATOM 1278 NE2 GLN A 531 12.970 -19.530 -16.390 1.00 0.00 N ATOM 0 H GLN A 531 16.957 -20.884 -11.658 1.00 0.00 H new ATOM 0 HA GLN A 531 15.812 -21.870 -14.197 1.00 0.00 H new ATOM 0 HB2 GLN A 531 15.222 -19.698 -12.454 1.00 0.00 H new ATOM 0 HB3 GLN A 531 15.905 -18.973 -13.896 1.00 0.00 H new ATOM 0 HG2 GLN A 531 13.582 -20.952 -13.946 1.00 0.00 H new ATOM 0 HG3 GLN A 531 13.368 -19.214 -13.874 1.00 0.00 H new ATOM 0 HE21 GLN A 531 12.153 -19.255 -15.845 1.00 0.00 H new ATOM 0 HE22 GLN A 531 12.939 -19.496 -17.409 1.00 0.00 H new ATOM 1287 N SER A 532 17.801 -21.421 -15.631 1.00 0.00 N ATOM 1288 CA SER A 532 18.952 -21.214 -16.518 1.00 0.00 C ATOM 1289 C SER A 532 18.665 -20.131 -17.570 1.00 0.00 C ATOM 1290 O SER A 532 19.526 -19.284 -17.846 1.00 0.00 O ATOM 1291 CB SER A 532 19.350 -22.547 -17.193 1.00 0.00 C ATOM 1292 OG SER A 532 18.269 -23.120 -17.906 1.00 0.00 O ATOM 0 H SER A 532 17.163 -22.150 -15.950 1.00 0.00 H new ATOM 0 HA SER A 532 19.788 -20.864 -15.912 1.00 0.00 H new ATOM 0 HB2 SER A 532 20.184 -22.375 -17.874 1.00 0.00 H new ATOM 0 HB3 SER A 532 19.698 -23.249 -16.435 1.00 0.00 H new ATOM 0 HG SER A 532 18.559 -23.960 -18.320 1.00 0.00 H new ATOM 1298 N SER A 533 17.442 -20.154 -18.138 1.00 0.00 N ATOM 1299 CA SER A 533 17.077 -19.283 -19.267 1.00 0.00 C ATOM 1300 C SER A 533 16.724 -17.852 -18.806 1.00 0.00 C ATOM 1301 O SER A 533 16.974 -16.907 -19.541 1.00 0.00 O ATOM 1302 CB SER A 533 15.885 -19.899 -20.044 1.00 0.00 C ATOM 1303 OG SER A 533 14.749 -20.069 -19.213 1.00 0.00 O ATOM 0 H SER A 533 16.690 -20.770 -17.830 1.00 0.00 H new ATOM 0 HA SER A 533 17.946 -19.211 -19.921 1.00 0.00 H new ATOM 0 HB2 SER A 533 15.627 -19.255 -20.885 1.00 0.00 H new ATOM 0 HB3 SER A 533 16.180 -20.863 -20.459 1.00 0.00 H new ATOM 0 HG SER A 533 15.017 -19.993 -18.273 1.00 0.00 H new ATOM 1309 N TRP A 534 16.161 -17.703 -17.575 1.00 0.00 N ATOM 1310 CA TRP A 534 15.683 -16.389 -17.032 1.00 0.00 C ATOM 1311 C TRP A 534 14.670 -15.719 -18.022 1.00 0.00 C ATOM 1312 O TRP A 534 14.435 -14.514 -17.972 1.00 0.00 O ATOM 1313 CB TRP A 534 16.919 -15.461 -16.738 1.00 0.00 C ATOM 1314 CG TRP A 534 16.782 -14.258 -15.781 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.823 -13.429 -15.439 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.634 -13.740 -15.048 1.00 0.00 C ATOM 1317 NE1 TRP A 534 17.407 -12.443 -14.594 1.00 0.00 N ATOM 1318 CE2 TRP A 534 16.081 -12.605 -14.334 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.286 -14.096 -14.923 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 15.241 -11.844 -13.530 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.458 -13.339 -14.119 1.00 0.00 C ATOM 1322 CH2 TRP A 534 13.938 -12.227 -13.435 1.00 0.00 C ATOM 0 H TRP A 534 16.024 -18.482 -16.931 1.00 0.00 H new ATOM 0 HA TRP A 534 15.151 -16.553 -16.095 1.00 0.00 H new ATOM 0 HB2 TRP A 534 17.713 -16.096 -16.345 1.00 0.00 H new ATOM 0 HB3 TRP A 534 17.266 -15.073 -17.696 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.837 -13.543 -15.793 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.997 -11.701 -14.216 1.00 0.00 H new ATOM 0 HE3 TRP A 534 13.898 -14.955 -15.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 15.609 -10.979 -12.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 12.419 -13.615 -14.019 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.263 -11.655 -12.815 1.00 0.00 H new ATOM 1333 N GLY A 535 14.018 -16.547 -18.870 1.00 0.00 N ATOM 1334 CA GLY A 535 13.183 -16.048 -19.962 1.00 0.00 C ATOM 1335 C GLY A 535 14.024 -15.466 -21.092 1.00 0.00 C ATOM 1336 O GLY A 535 14.009 -14.243 -21.317 1.00 0.00 O ATOM 0 H GLY A 535 14.061 -17.564 -18.810 1.00 0.00 H new ATOM 0 HA2 GLY A 535 12.565 -16.859 -20.348 1.00 0.00 H new ATOM 0 HA3 GLY A 535 12.505 -15.284 -19.582 1.00 0.00 H new ATOM 1340 N THR A 536 14.780 -16.347 -21.790 1.00 0.00 N ATOM 1341 CA THR A 536 15.657 -15.947 -22.908 1.00 0.00 C ATOM 1342 C THR A 536 14.835 -15.366 -24.060 1.00 0.00 C ATOM 1343 O THR A 536 13.740 -15.858 -24.366 1.00 0.00 O ATOM 1344 CB THR A 536 16.543 -17.136 -23.432 1.00 0.00 C ATOM 1345 OG1 THR A 536 15.765 -18.339 -23.493 1.00 0.00 O ATOM 1346 CG2 THR A 536 17.796 -17.372 -22.567 1.00 0.00 C ATOM 0 H THR A 536 14.797 -17.348 -21.593 1.00 0.00 H new ATOM 0 HA THR A 536 16.329 -15.182 -22.519 1.00 0.00 H new ATOM 0 HB THR A 536 16.886 -16.860 -24.429 1.00 0.00 H new ATOM 0 HG1 THR A 536 14.978 -18.191 -24.058 1.00 0.00 H new ATOM 0 HG21 THR A 536 18.369 -18.204 -22.976 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.412 -16.473 -22.566 1.00 0.00 H new ATOM 0 HG23 THR A 536 17.494 -17.606 -21.546 1.00 0.00 H new ATOM 1354 N GLY A 537 15.365 -14.307 -24.675 1.00 0.00 N ATOM 1355 CA GLY A 537 14.702 -13.664 -25.787 1.00 0.00 C ATOM 1356 C GLY A 537 15.598 -12.693 -26.514 1.00 0.00 C ATOM 1357 O GLY A 537 16.437 -12.035 -25.896 1.00 0.00 O ATOM 0 H GLY A 537 16.255 -13.883 -24.413 1.00 0.00 H new ATOM 0 HA2 GLY A 537 14.353 -14.424 -26.486 1.00 0.00 H new ATOM 0 HA3 GLY A 537 13.820 -13.137 -25.424 1.00 0.00 H new ATOM 1361 N GLU A 538 15.434 -12.632 -27.840 1.00 0.00 N ATOM 1362 CA GLU A 538 16.078 -11.615 -28.688 1.00 0.00 C ATOM 1363 C GLU A 538 15.346 -10.267 -28.546 1.00 0.00 C ATOM 1364 O GLU A 538 15.935 -9.215 -28.776 1.00 0.00 O ATOM 1365 CB GLU A 538 16.102 -12.104 -30.157 1.00 0.00 C ATOM 1366 CG GLU A 538 14.716 -12.430 -30.751 1.00 0.00 C ATOM 1367 CD GLU A 538 14.810 -13.150 -32.100 1.00 0.00 C ATOM 1368 OE1 GLU A 538 14.870 -12.472 -33.148 1.00 0.00 O ATOM 1369 OE2 GLU A 538 14.845 -14.402 -32.116 1.00 0.00 O ATOM 0 H GLU A 538 14.850 -13.287 -28.360 1.00 0.00 H new ATOM 0 HA GLU A 538 17.108 -11.464 -28.366 1.00 0.00 H new ATOM 0 HB2 GLU A 538 16.575 -11.339 -30.773 1.00 0.00 H new ATOM 0 HB3 GLU A 538 16.727 -12.995 -30.219 1.00 0.00 H new ATOM 0 HG2 GLU A 538 14.161 -13.052 -30.049 1.00 0.00 H new ATOM 0 HG3 GLU A 538 14.151 -11.506 -30.875 1.00 0.00 H new ATOM 1376 N SER A 539 14.046 -10.327 -28.179 1.00 0.00 N ATOM 1377 CA SER A 539 13.216 -9.148 -27.872 1.00 0.00 C ATOM 1378 C SER A 539 12.170 -9.549 -26.811 1.00 0.00 C ATOM 1379 O SER A 539 11.370 -10.470 -27.037 1.00 0.00 O ATOM 1380 CB SER A 539 12.507 -8.610 -29.146 1.00 0.00 C ATOM 1381 OG SER A 539 13.413 -8.412 -30.225 1.00 0.00 O ATOM 0 H SER A 539 13.541 -11.208 -28.088 1.00 0.00 H new ATOM 0 HA SER A 539 13.854 -8.351 -27.492 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.730 -9.312 -29.451 1.00 0.00 H new ATOM 0 HB3 SER A 539 12.012 -7.668 -28.913 1.00 0.00 H new ATOM 0 HG SER A 539 12.924 -8.075 -31.005 1.00 0.00 H new ATOM 1387 N PHE A 540 12.199 -8.867 -25.654 1.00 0.00 N ATOM 1388 CA PHE A 540 11.313 -9.143 -24.516 1.00 0.00 C ATOM 1389 C PHE A 540 11.052 -7.871 -23.703 1.00 0.00 C ATOM 1390 O PHE A 540 11.703 -6.838 -23.902 1.00 0.00 O ATOM 1391 CB PHE A 540 11.906 -10.264 -23.615 1.00 0.00 C ATOM 1392 CG PHE A 540 13.336 -10.035 -23.109 1.00 0.00 C ATOM 1393 CD1 PHE A 540 14.431 -10.339 -23.916 1.00 0.00 C ATOM 1394 CD2 PHE A 540 13.591 -9.539 -21.830 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.721 -10.151 -23.470 1.00 0.00 C ATOM 1396 CE2 PHE A 540 14.889 -9.356 -21.385 1.00 0.00 C ATOM 1397 CZ PHE A 540 15.953 -9.662 -22.207 1.00 0.00 C ATOM 0 H PHE A 540 12.848 -8.099 -25.483 1.00 0.00 H new ATOM 0 HA PHE A 540 10.358 -9.492 -24.909 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.253 -10.392 -22.752 1.00 0.00 H new ATOM 0 HB3 PHE A 540 11.885 -11.200 -24.173 1.00 0.00 H new ATOM 0 HD1 PHE A 540 14.265 -10.729 -24.909 1.00 0.00 H new ATOM 0 HD2 PHE A 540 12.765 -9.295 -21.179 1.00 0.00 H new ATOM 0 HE1 PHE A 540 16.553 -10.389 -24.116 1.00 0.00 H new ATOM 0 HE2 PHE A 540 15.069 -8.973 -20.391 1.00 0.00 H new ATOM 0 HZ PHE A 540 16.965 -9.518 -21.859 1.00 0.00 H new ATOM 1407 N ARG A 541 10.088 -7.976 -22.779 1.00 0.00 N ATOM 1408 CA ARG A 541 9.696 -6.890 -21.876 1.00 0.00 C ATOM 1409 C ARG A 541 9.963 -7.325 -20.423 1.00 0.00 C ATOM 1410 O ARG A 541 9.422 -8.334 -19.941 1.00 0.00 O ATOM 1411 CB ARG A 541 8.199 -6.509 -22.115 1.00 0.00 C ATOM 1412 CG ARG A 541 7.193 -7.678 -21.972 1.00 0.00 C ATOM 1413 CD ARG A 541 5.797 -7.361 -22.536 1.00 0.00 C ATOM 1414 NE ARG A 541 5.828 -7.122 -23.995 1.00 0.00 N ATOM 1415 CZ ARG A 541 4.777 -6.752 -24.746 1.00 0.00 C ATOM 1416 NH1 ARG A 541 3.576 -6.568 -24.213 1.00 0.00 N ATOM 1417 NH2 ARG A 541 4.940 -6.558 -26.042 1.00 0.00 N ATOM 0 H ARG A 541 9.551 -8.832 -22.637 1.00 0.00 H new ATOM 0 HA ARG A 541 10.288 -5.997 -22.076 1.00 0.00 H new ATOM 0 HB2 ARG A 541 7.923 -5.724 -21.411 1.00 0.00 H new ATOM 0 HB3 ARG A 541 8.103 -6.087 -23.116 1.00 0.00 H new ATOM 0 HG2 ARG A 541 7.592 -8.554 -22.483 1.00 0.00 H new ATOM 0 HG3 ARG A 541 7.099 -7.939 -20.918 1.00 0.00 H new ATOM 0 HD2 ARG A 541 5.122 -8.189 -22.319 1.00 0.00 H new ATOM 0 HD3 ARG A 541 5.394 -6.482 -22.033 1.00 0.00 H new ATOM 0 HE ARG A 541 6.721 -7.249 -24.471 1.00 0.00 H new ATOM 0 HH11 ARG A 541 3.435 -6.707 -23.212 1.00 0.00 H new ATOM 0 HH12 ARG A 541 2.793 -6.287 -24.804 1.00 0.00 H new ATOM 0 HH21 ARG A 541 5.858 -6.689 -26.466 1.00 0.00 H new ATOM 0 HH22 ARG A 541 4.147 -6.277 -26.619 1.00 0.00 H new ATOM 1431 N THR A 542 10.867 -6.598 -19.761 1.00 0.00 N ATOM 1432 CA THR A 542 11.143 -6.763 -18.340 1.00 0.00 C ATOM 1433 C THR A 542 10.331 -5.715 -17.570 1.00 0.00 C ATOM 1434 O THR A 542 10.507 -4.514 -17.779 1.00 0.00 O ATOM 1435 CB THR A 542 12.659 -6.600 -18.037 1.00 0.00 C ATOM 1436 OG1 THR A 542 13.422 -7.499 -18.863 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.985 -6.859 -16.555 1.00 0.00 C ATOM 0 H THR A 542 11.431 -5.873 -20.205 1.00 0.00 H new ATOM 0 HA THR A 542 10.857 -7.768 -18.030 1.00 0.00 H new ATOM 0 HB THR A 542 12.928 -5.567 -18.260 1.00 0.00 H new ATOM 0 HG1 THR A 542 14.309 -7.632 -18.469 1.00 0.00 H new ATOM 0 HG21 THR A 542 14.055 -6.734 -16.391 1.00 0.00 H new ATOM 0 HG22 THR A 542 12.437 -6.151 -15.933 1.00 0.00 H new ATOM 0 HG23 THR A 542 12.694 -7.876 -16.291 1.00 0.00 H new ATOM 1445 N VAL A 543 9.417 -6.185 -16.725 1.00 0.00 N ATOM 1446 CA VAL A 543 8.534 -5.345 -15.910 1.00 0.00 C ATOM 1447 C VAL A 543 8.828 -5.622 -14.428 1.00 0.00 C ATOM 1448 O VAL A 543 9.057 -6.765 -14.051 1.00 0.00 O ATOM 1449 CB VAL A 543 7.017 -5.643 -16.219 1.00 0.00 C ATOM 1450 CG1 VAL A 543 6.091 -4.693 -15.428 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.729 -5.577 -17.743 1.00 0.00 C ATOM 0 H VAL A 543 9.264 -7.183 -16.582 1.00 0.00 H new ATOM 0 HA VAL A 543 8.721 -4.298 -16.147 1.00 0.00 H new ATOM 0 HB VAL A 543 6.804 -6.660 -15.890 1.00 0.00 H new ATOM 0 HG11 VAL A 543 5.051 -4.921 -15.661 1.00 0.00 H new ATOM 0 HG12 VAL A 543 6.261 -4.825 -14.360 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.306 -3.661 -15.705 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.675 -5.787 -17.923 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.970 -4.582 -18.116 1.00 0.00 H new ATOM 0 HG23 VAL A 543 7.340 -6.316 -18.261 1.00 0.00 H new ATOM 1461 N LEU A 544 8.850 -4.572 -13.608 1.00 0.00 N ATOM 1462 CA LEU A 544 8.985 -4.682 -12.153 1.00 0.00 C ATOM 1463 C LEU A 544 7.646 -4.285 -11.514 1.00 0.00 C ATOM 1464 O LEU A 544 7.178 -3.153 -11.679 1.00 0.00 O ATOM 1465 CB LEU A 544 10.147 -3.789 -11.655 1.00 0.00 C ATOM 1466 CG LEU A 544 10.505 -3.890 -10.141 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.795 -5.351 -9.716 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.679 -2.952 -9.806 1.00 0.00 C ATOM 0 H LEU A 544 8.774 -3.610 -13.937 1.00 0.00 H new ATOM 0 HA LEU A 544 9.225 -5.706 -11.866 1.00 0.00 H new ATOM 0 HB2 LEU A 544 11.038 -4.035 -12.233 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.899 -2.751 -11.878 1.00 0.00 H new ATOM 0 HG LEU A 544 9.639 -3.566 -9.564 1.00 0.00 H new ATOM 0 HD11 LEU A 544 11.040 -5.379 -8.654 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.914 -5.966 -9.901 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.635 -5.738 -10.293 1.00 0.00 H new ATOM 0 HD21 LEU A 544 11.918 -3.033 -8.746 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.550 -3.234 -10.397 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.401 -1.924 -10.038 1.00 0.00 H new ATOM 1480 N VAL A 545 7.015 -5.251 -10.844 1.00 0.00 N ATOM 1481 CA VAL A 545 5.730 -5.081 -10.152 1.00 0.00 C ATOM 1482 C VAL A 545 5.979 -5.103 -8.630 1.00 0.00 C ATOM 1483 O VAL A 545 6.936 -5.732 -8.175 1.00 0.00 O ATOM 1484 CB VAL A 545 4.744 -6.235 -10.577 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.369 -6.119 -9.882 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.586 -6.289 -12.120 1.00 0.00 C ATOM 0 H VAL A 545 7.390 -6.196 -10.764 1.00 0.00 H new ATOM 0 HA VAL A 545 5.276 -4.128 -10.424 1.00 0.00 H new ATOM 0 HB VAL A 545 5.189 -7.173 -10.243 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.726 -6.937 -10.208 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.502 -6.171 -8.801 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.907 -5.167 -10.146 1.00 0.00 H new ATOM 0 HG21 VAL A 545 3.901 -7.093 -12.388 1.00 0.00 H new ATOM 0 HG22 VAL A 545 4.189 -5.339 -12.479 1.00 0.00 H new ATOM 0 HG23 VAL A 545 5.558 -6.472 -12.579 1.00 0.00 H new ATOM 1496 N ASN A 546 5.117 -4.414 -7.855 1.00 0.00 N ATOM 1497 CA ASN A 546 5.280 -4.283 -6.385 1.00 0.00 C ATOM 1498 C ASN A 546 4.192 -5.083 -5.630 1.00 0.00 C ATOM 1499 O ASN A 546 3.393 -5.801 -6.247 1.00 0.00 O ATOM 1500 CB ASN A 546 5.265 -2.775 -5.987 1.00 0.00 C ATOM 1501 CG ASN A 546 3.868 -2.178 -5.820 1.00 0.00 C ATOM 1502 OD1 ASN A 546 3.468 -1.809 -4.717 1.00 0.00 O ATOM 1503 ND2 ASN A 546 3.100 -2.128 -6.887 1.00 0.00 N ATOM 0 H ASN A 546 4.294 -3.935 -8.222 1.00 0.00 H new ATOM 0 HA ASN A 546 6.242 -4.706 -6.096 1.00 0.00 H new ATOM 0 HB2 ASN A 546 5.813 -2.653 -5.052 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.801 -2.206 -6.747 1.00 0.00 H new ATOM 0 HD21 ASN A 546 2.146 -1.776 -6.812 1.00 0.00 H new ATOM 0 HD22 ASN A 546 3.459 -2.441 -7.789 1.00 0.00 H new ATOM 1510 N ALA A 547 4.166 -4.910 -4.287 1.00 0.00 N ATOM 1511 CA ALA A 547 3.220 -5.589 -3.376 1.00 0.00 C ATOM 1512 C ALA A 547 1.743 -5.254 -3.678 1.00 0.00 C ATOM 1513 O ALA A 547 0.868 -6.115 -3.533 1.00 0.00 O ATOM 1514 CB ALA A 547 3.558 -5.229 -1.924 1.00 0.00 C ATOM 0 H ALA A 547 4.811 -4.286 -3.802 1.00 0.00 H new ATOM 0 HA ALA A 547 3.333 -6.661 -3.535 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.860 -5.730 -1.253 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.574 -5.551 -1.697 1.00 0.00 H new ATOM 0 HB3 ALA A 547 3.480 -4.150 -1.789 1.00 0.00 H new ATOM 1520 N ASP A 548 1.485 -3.999 -4.091 1.00 0.00 N ATOM 1521 CA ASP A 548 0.132 -3.540 -4.490 1.00 0.00 C ATOM 1522 C ASP A 548 -0.361 -4.320 -5.725 1.00 0.00 C ATOM 1523 O ASP A 548 -1.523 -4.748 -5.791 1.00 0.00 O ATOM 1524 CB ASP A 548 0.145 -2.013 -4.796 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.182 -1.490 -5.398 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -2.169 -1.331 -4.649 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -1.240 -1.253 -6.625 1.00 0.00 O ATOM 0 H ASP A 548 2.200 -3.275 -4.159 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.551 -3.728 -3.662 1.00 0.00 H new ATOM 0 HB2 ASP A 548 0.356 -1.468 -3.876 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.959 -1.797 -5.488 1.00 0.00 H new ATOM 1532 N GLY A 549 0.560 -4.545 -6.671 1.00 0.00 N ATOM 1533 CA GLY A 549 0.253 -5.220 -7.930 1.00 0.00 C ATOM 1534 C GLY A 549 0.355 -4.314 -9.147 1.00 0.00 C ATOM 1535 O GLY A 549 0.322 -4.812 -10.276 1.00 0.00 O ATOM 0 H GLY A 549 1.536 -4.263 -6.581 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.933 -6.062 -8.056 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -0.755 -5.630 -7.876 1.00 0.00 H new ATOM 1539 N GLU A 550 0.475 -2.982 -8.934 1.00 0.00 N ATOM 1540 CA GLU A 550 0.751 -2.041 -10.040 1.00 0.00 C ATOM 1541 C GLU A 550 2.189 -2.242 -10.557 1.00 0.00 C ATOM 1542 O GLU A 550 3.106 -2.591 -9.787 1.00 0.00 O ATOM 1543 CB GLU A 550 0.526 -0.557 -9.624 1.00 0.00 C ATOM 1544 CG GLU A 550 1.434 -0.051 -8.491 1.00 0.00 C ATOM 1545 CD GLU A 550 1.328 1.455 -8.228 1.00 0.00 C ATOM 1546 OE1 GLU A 550 0.314 1.893 -7.646 1.00 0.00 O ATOM 1547 OE2 GLU A 550 2.277 2.204 -8.570 1.00 0.00 O ATOM 0 H GLU A 550 0.386 -2.541 -8.018 1.00 0.00 H new ATOM 0 HA GLU A 550 0.043 -2.259 -10.840 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.676 0.076 -10.499 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.513 -0.436 -9.317 1.00 0.00 H new ATOM 0 HG2 GLU A 550 1.186 -0.587 -7.575 1.00 0.00 H new ATOM 0 HG3 GLU A 550 2.469 -0.295 -8.733 1.00 0.00 H new ATOM 1554 N GLU A 551 2.366 -2.039 -11.867 1.00 0.00 N ATOM 1555 CA GLU A 551 3.662 -2.176 -12.536 1.00 0.00 C ATOM 1556 C GLU A 551 4.435 -0.856 -12.390 1.00 0.00 C ATOM 1557 O GLU A 551 4.159 0.122 -13.100 1.00 0.00 O ATOM 1558 CB GLU A 551 3.437 -2.568 -14.016 1.00 0.00 C ATOM 1559 CG GLU A 551 2.498 -3.785 -14.200 1.00 0.00 C ATOM 1560 CD GLU A 551 2.460 -4.317 -15.638 1.00 0.00 C ATOM 1561 OE1 GLU A 551 2.204 -3.528 -16.568 1.00 0.00 O ATOM 1562 OE2 GLU A 551 2.682 -5.527 -15.849 1.00 0.00 O ATOM 0 H GLU A 551 1.608 -1.773 -12.496 1.00 0.00 H new ATOM 0 HA GLU A 551 4.258 -2.966 -12.079 1.00 0.00 H new ATOM 0 HB2 GLU A 551 3.020 -1.714 -14.550 1.00 0.00 H new ATOM 0 HB3 GLU A 551 4.400 -2.791 -14.474 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.819 -4.585 -13.533 1.00 0.00 H new ATOM 0 HG3 GLU A 551 1.489 -3.504 -13.898 1.00 0.00 H new ATOM 1569 N VAL A 552 5.358 -0.830 -11.413 1.00 0.00 N ATOM 1570 CA VAL A 552 6.056 0.397 -10.984 1.00 0.00 C ATOM 1571 C VAL A 552 7.180 0.794 -11.955 1.00 0.00 C ATOM 1572 O VAL A 552 7.535 1.974 -12.053 1.00 0.00 O ATOM 1573 CB VAL A 552 6.613 0.239 -9.521 1.00 0.00 C ATOM 1574 CG1 VAL A 552 5.456 -0.031 -8.527 1.00 0.00 C ATOM 1575 CG2 VAL A 552 7.708 -0.859 -9.424 1.00 0.00 C ATOM 0 H VAL A 552 5.643 -1.662 -10.896 1.00 0.00 H new ATOM 0 HA VAL A 552 5.323 1.204 -10.993 1.00 0.00 H new ATOM 0 HB VAL A 552 7.091 1.180 -9.249 1.00 0.00 H new ATOM 0 HG11 VAL A 552 5.859 -0.138 -7.520 1.00 0.00 H new ATOM 0 HG12 VAL A 552 4.754 0.803 -8.551 1.00 0.00 H new ATOM 0 HG13 VAL A 552 4.940 -0.948 -8.810 1.00 0.00 H new ATOM 0 HG21 VAL A 552 8.061 -0.931 -8.395 1.00 0.00 H new ATOM 0 HG22 VAL A 552 7.290 -1.818 -9.732 1.00 0.00 H new ATOM 0 HG23 VAL A 552 8.542 -0.600 -10.077 1.00 0.00 H new ATOM 1585 N ALA A 553 7.722 -0.201 -12.672 1.00 0.00 N ATOM 1586 CA ALA A 553 8.786 -0.003 -13.667 1.00 0.00 C ATOM 1587 C ALA A 553 8.579 -0.971 -14.840 1.00 0.00 C ATOM 1588 O ALA A 553 7.934 -2.011 -14.678 1.00 0.00 O ATOM 1589 CB ALA A 553 10.174 -0.190 -13.017 1.00 0.00 C ATOM 0 H ALA A 553 7.432 -1.174 -12.577 1.00 0.00 H new ATOM 0 HA ALA A 553 8.740 1.016 -14.051 1.00 0.00 H new ATOM 0 HB1 ALA A 553 10.950 -0.040 -13.767 1.00 0.00 H new ATOM 0 HB2 ALA A 553 10.300 0.536 -12.214 1.00 0.00 H new ATOM 0 HB3 ALA A 553 10.252 -1.198 -12.610 1.00 0.00 H new ATOM 1595 N MET A 554 9.122 -0.612 -16.015 1.00 0.00 N ATOM 1596 CA MET A 554 8.987 -1.413 -17.252 1.00 0.00 C ATOM 1597 C MET A 554 10.090 -1.018 -18.249 1.00 0.00 C ATOM 1598 O MET A 554 10.488 0.152 -18.301 1.00 0.00 O ATOM 1599 CB MET A 554 7.573 -1.206 -17.874 1.00 0.00 C ATOM 1600 CG MET A 554 7.292 -2.004 -19.160 1.00 0.00 C ATOM 1601 SD MET A 554 5.607 -1.774 -19.782 1.00 0.00 S ATOM 1602 CE MET A 554 5.559 -0.006 -20.096 1.00 0.00 C ATOM 0 H MET A 554 9.668 0.241 -16.138 1.00 0.00 H new ATOM 0 HA MET A 554 9.099 -2.470 -17.012 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.824 -1.475 -17.129 1.00 0.00 H new ATOM 0 HB3 MET A 554 7.441 -0.146 -18.089 1.00 0.00 H new ATOM 0 HG2 MET A 554 8.002 -1.703 -19.930 1.00 0.00 H new ATOM 0 HG3 MET A 554 7.461 -3.064 -18.968 1.00 0.00 H new ATOM 0 HE1 MET A 554 4.706 0.227 -20.734 1.00 0.00 H new ATOM 0 HE2 MET A 554 5.462 0.529 -19.151 1.00 0.00 H new ATOM 0 HE3 MET A 554 6.479 0.300 -20.594 1.00 0.00 H new ATOM 1612 N ARG A 555 10.565 -1.992 -19.051 1.00 0.00 N ATOM 1613 CA ARG A 555 11.639 -1.768 -20.029 1.00 0.00 C ATOM 1614 C ARG A 555 11.512 -2.761 -21.205 1.00 0.00 C ATOM 1615 O ARG A 555 11.606 -3.979 -21.012 1.00 0.00 O ATOM 1616 CB ARG A 555 13.033 -1.903 -19.345 1.00 0.00 C ATOM 1617 CG ARG A 555 14.234 -1.405 -20.200 1.00 0.00 C ATOM 1618 CD ARG A 555 14.462 0.124 -20.112 1.00 0.00 C ATOM 1619 NE ARG A 555 13.255 0.915 -20.442 1.00 0.00 N ATOM 1620 CZ ARG A 555 12.930 2.098 -19.898 1.00 0.00 C ATOM 1621 NH1 ARG A 555 13.719 2.680 -19.010 1.00 0.00 N ATOM 1622 NH2 ARG A 555 11.803 2.692 -20.245 1.00 0.00 N ATOM 0 H ARG A 555 10.215 -2.950 -19.037 1.00 0.00 H new ATOM 0 HA ARG A 555 11.546 -0.756 -20.422 1.00 0.00 H new ATOM 0 HB2 ARG A 555 13.017 -1.346 -18.408 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.197 -2.950 -19.090 1.00 0.00 H new ATOM 0 HG2 ARG A 555 15.139 -1.919 -19.875 1.00 0.00 H new ATOM 0 HG3 ARG A 555 14.067 -1.680 -21.241 1.00 0.00 H new ATOM 0 HD2 ARG A 555 14.790 0.378 -19.104 1.00 0.00 H new ATOM 0 HD3 ARG A 555 15.268 0.404 -20.790 1.00 0.00 H new ATOM 0 HE ARG A 555 12.619 0.530 -21.140 1.00 0.00 H new ATOM 0 HH11 ARG A 555 14.590 2.229 -18.729 1.00 0.00 H new ATOM 0 HH12 ARG A 555 13.457 3.579 -18.607 1.00 0.00 H new ATOM 0 HH21 ARG A 555 11.183 2.252 -20.924 1.00 0.00 H new ATOM 0 HH22 ARG A 555 11.553 3.591 -19.834 1.00 0.00 H new ATOM 1636 N THR A 556 11.285 -2.226 -22.416 1.00 0.00 N ATOM 1637 CA THR A 556 11.235 -3.010 -23.658 1.00 0.00 C ATOM 1638 C THR A 556 12.666 -3.124 -24.236 1.00 0.00 C ATOM 1639 O THR A 556 13.207 -2.162 -24.799 1.00 0.00 O ATOM 1640 CB THR A 556 10.261 -2.343 -24.693 1.00 0.00 C ATOM 1641 OG1 THR A 556 8.957 -2.195 -24.098 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.134 -3.158 -25.996 1.00 0.00 C ATOM 0 H THR A 556 11.130 -1.228 -22.560 1.00 0.00 H new ATOM 0 HA THR A 556 10.853 -4.009 -23.446 1.00 0.00 H new ATOM 0 HB THR A 556 10.680 -1.371 -24.953 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.349 -1.777 -24.743 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.449 -2.652 -26.676 1.00 0.00 H new ATOM 0 HG22 THR A 556 11.113 -3.247 -26.467 1.00 0.00 H new ATOM 0 HG23 THR A 556 9.750 -4.152 -25.767 1.00 0.00 H new ATOM 1650 N VAL A 557 13.276 -4.301 -24.061 1.00 0.00 N ATOM 1651 CA VAL A 557 14.690 -4.560 -24.398 1.00 0.00 C ATOM 1652 C VAL A 557 14.791 -5.592 -25.537 1.00 0.00 C ATOM 1653 O VAL A 557 14.173 -6.658 -25.486 1.00 0.00 O ATOM 1654 CB VAL A 557 15.489 -5.029 -23.118 1.00 0.00 C ATOM 1655 CG1 VAL A 557 14.699 -6.097 -22.334 1.00 0.00 C ATOM 1656 CG2 VAL A 557 16.932 -5.523 -23.459 1.00 0.00 C ATOM 0 H VAL A 557 12.799 -5.116 -23.676 1.00 0.00 H new ATOM 0 HA VAL A 557 15.143 -3.632 -24.748 1.00 0.00 H new ATOM 0 HB VAL A 557 15.605 -4.154 -22.479 1.00 0.00 H new ATOM 0 HG11 VAL A 557 15.271 -6.403 -21.458 1.00 0.00 H new ATOM 0 HG12 VAL A 557 13.743 -5.682 -22.016 1.00 0.00 H new ATOM 0 HG13 VAL A 557 14.524 -6.962 -22.973 1.00 0.00 H new ATOM 0 HG21 VAL A 557 17.436 -5.833 -22.544 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.875 -6.367 -24.146 1.00 0.00 H new ATOM 0 HG23 VAL A 557 17.493 -4.713 -23.926 1.00 0.00 H new ATOM 1666 N LYS A 558 15.574 -5.245 -26.570 1.00 0.00 N ATOM 1667 CA LYS A 558 15.832 -6.105 -27.736 1.00 0.00 C ATOM 1668 C LYS A 558 17.311 -6.015 -28.136 1.00 0.00 C ATOM 1669 O LYS A 558 18.029 -5.091 -27.727 1.00 0.00 O ATOM 1670 CB LYS A 558 14.892 -5.761 -28.947 1.00 0.00 C ATOM 1671 CG LYS A 558 14.759 -4.262 -29.325 1.00 0.00 C ATOM 1672 CD LYS A 558 13.750 -3.494 -28.429 1.00 0.00 C ATOM 1673 CE LYS A 558 13.547 -2.039 -28.876 1.00 0.00 C ATOM 1674 NZ LYS A 558 14.796 -1.233 -28.778 1.00 0.00 N ATOM 0 H LYS A 558 16.053 -4.346 -26.620 1.00 0.00 H new ATOM 0 HA LYS A 558 15.605 -7.132 -27.451 1.00 0.00 H new ATOM 0 HB2 LYS A 558 15.254 -6.301 -29.822 1.00 0.00 H new ATOM 0 HB3 LYS A 558 13.896 -6.145 -28.724 1.00 0.00 H new ATOM 0 HG2 LYS A 558 15.737 -3.787 -29.250 1.00 0.00 H new ATOM 0 HG3 LYS A 558 14.445 -4.183 -30.366 1.00 0.00 H new ATOM 0 HD2 LYS A 558 12.791 -4.011 -28.444 1.00 0.00 H new ATOM 0 HD3 LYS A 558 14.103 -3.507 -27.398 1.00 0.00 H new ATOM 0 HE2 LYS A 558 13.189 -2.025 -29.906 1.00 0.00 H new ATOM 0 HE3 LYS A 558 12.772 -1.579 -28.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 14.598 -0.251 -29.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 15.144 -1.250 -27.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 15.519 -1.634 -29.409 1.00 0.00 H new ATOM 1688 N LYS A 559 17.749 -6.990 -28.940 1.00 0.00 N ATOM 1689 CA LYS A 559 19.141 -7.132 -29.364 1.00 0.00 C ATOM 1690 C LYS A 559 19.396 -6.253 -30.599 1.00 0.00 C ATOM 1691 O LYS A 559 18.977 -6.595 -31.710 1.00 0.00 O ATOM 1692 CB LYS A 559 19.448 -8.625 -29.672 1.00 0.00 C ATOM 1693 CG LYS A 559 20.944 -8.936 -29.907 1.00 0.00 C ATOM 1694 CD LYS A 559 21.197 -10.403 -30.327 1.00 0.00 C ATOM 1695 CE LYS A 559 20.639 -11.430 -29.323 1.00 0.00 C ATOM 1696 NZ LYS A 559 21.142 -11.224 -27.934 1.00 0.00 N ATOM 0 H LYS A 559 17.135 -7.712 -29.318 1.00 0.00 H new ATOM 0 HA LYS A 559 19.804 -6.804 -28.563 1.00 0.00 H new ATOM 0 HB2 LYS A 559 19.089 -9.235 -28.843 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.884 -8.924 -30.556 1.00 0.00 H new ATOM 0 HG2 LYS A 559 21.331 -8.271 -30.679 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.501 -8.724 -28.995 1.00 0.00 H new ATOM 0 HD2 LYS A 559 20.745 -10.577 -31.303 1.00 0.00 H new ATOM 0 HD3 LYS A 559 22.270 -10.561 -30.440 1.00 0.00 H new ATOM 0 HE2 LYS A 559 19.551 -11.373 -29.321 1.00 0.00 H new ATOM 0 HE3 LYS A 559 20.905 -12.434 -29.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 21.562 -12.108 -27.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 21.862 -10.474 -27.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 20.353 -10.946 -27.317 1.00 0.00 H new