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 532 SER OG : rot 180:sc= 0.00676 USER MOD Set 1.2: A 533 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 467 GLN : amide:sc= -0.101 X(o=-0.11,f=-0.35) USER MOD Set 2.2: A 510 THR OG1 : rot 180:sc= -0.0048 USER MOD Set 3.1: A 453 SER OG : rot -175:sc= 0.0852 USER MOD Set 3.2: A 476 GLN : amide:sc= 0.0813 X(o=0.17,f=-0.076) USER MOD Single : A 455 SER OG : rot 180:sc= -0.104 USER MOD Single : A 464 LYS NZ :NH3+ 175:sc= 0.729 (180deg=0.696) USER MOD Single : A 469 LYS NZ :NH3+ 172:sc= 0.627 (180deg=0.432) USER MOD Single : A 470 ASN : amide:sc= -2.13! C(o=-2.1!,f=-11!) USER MOD Single : A 471 ASN : amide:sc= -1.42! K(o=-1.4!,f=-0.1) USER MOD Single : A 472 SER OG : rot 69:sc= 0.222 USER MOD Single : A 474 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00974) USER MOD Single : A 477 SER OG : rot 41:sc= 0.106 USER MOD Single : A 480 ASN : amide:sc= -0.158 X(o=-0.16,f=-0.043) USER MOD Single : A 484 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0944) USER MOD Single : A 486 GLN : amide:sc= 0.0195 K(o=0.02,f=-3.4!) USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ -169:sc= 0.377 (180deg=0.331) USER MOD Single : A 498 THR OG1 : rot 180:sc= -0.063 USER MOD Single : A 500 LYS NZ :NH3+ 135:sc= -0.569 (180deg=-2.67!) USER MOD Single : A 501 TYR OH : rot 21:sc= 0.348 USER MOD Single : A 507 GLN : amide:sc= -0.0252 X(o=-0.025,f=-0.025) USER MOD Single : A 508 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 520 HIS : no HE2:sc= -2.17 K(o=-2.2,f=-1.2) USER MOD Single : A 521 SER OG : rot 69:sc= 0.0207 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 531 GLN : amide:sc=-0.00175 K(o=-0.0017,f=-1.7) USER MOD Single : A 536 THR OG1 : rot 180:sc= 0.00595 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot 180:sc= 0 USER MOD Single : A 546 ASN : amide:sc= -2.95! K(o=-2.9!,f=0.21) USER MOD Single : A 554 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 LYS NZ :NH3+ -164:sc= -0.0486 (180deg=-0.369) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 9.520 2.775 -5.750 1.00 0.00 N ATOM 41 CA SER A 453 10.562 2.761 -4.716 1.00 0.00 C ATOM 42 C SER A 453 11.883 2.271 -5.343 1.00 0.00 C ATOM 43 O SER A 453 12.937 2.917 -5.234 1.00 0.00 O ATOM 44 CB SER A 453 10.138 1.851 -3.541 1.00 0.00 C ATOM 45 OG SER A 453 8.873 2.228 -3.020 1.00 0.00 O ATOM 0 HA SER A 453 10.705 3.767 -4.323 1.00 0.00 H new ATOM 0 HB2 SER A 453 10.100 0.815 -3.878 1.00 0.00 H new ATOM 0 HB3 SER A 453 10.888 1.902 -2.751 1.00 0.00 H new ATOM 0 HG SER A 453 8.668 1.683 -2.232 1.00 0.00 H new ATOM 51 N VAL A 454 11.790 1.118 -6.026 1.00 0.00 N ATOM 52 CA VAL A 454 12.876 0.544 -6.828 1.00 0.00 C ATOM 53 C VAL A 454 12.477 0.649 -8.315 1.00 0.00 C ATOM 54 O VAL A 454 11.287 0.549 -8.655 1.00 0.00 O ATOM 55 CB VAL A 454 13.168 -0.964 -6.452 1.00 0.00 C ATOM 56 CG1 VAL A 454 14.529 -1.445 -7.024 1.00 0.00 C ATOM 57 CG2 VAL A 454 13.084 -1.202 -4.923 1.00 0.00 C ATOM 0 H VAL A 454 10.942 0.551 -6.034 1.00 0.00 H new ATOM 0 HA VAL A 454 13.792 1.100 -6.627 1.00 0.00 H new ATOM 0 HB VAL A 454 12.387 -1.565 -6.918 1.00 0.00 H new ATOM 0 HG11 VAL A 454 14.694 -2.486 -6.744 1.00 0.00 H new ATOM 0 HG12 VAL A 454 14.518 -1.358 -8.111 1.00 0.00 H new ATOM 0 HG13 VAL A 454 15.332 -0.829 -6.619 1.00 0.00 H new ATOM 0 HG21 VAL A 454 13.291 -2.250 -4.706 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.818 -0.575 -4.416 1.00 0.00 H new ATOM 0 HG23 VAL A 454 12.084 -0.949 -4.570 1.00 0.00 H new ATOM 67 N SER A 455 13.472 0.849 -9.178 1.00 0.00 N ATOM 68 CA SER A 455 13.307 0.941 -10.634 1.00 0.00 C ATOM 69 C SER A 455 14.213 -0.097 -11.323 1.00 0.00 C ATOM 70 O SER A 455 14.946 -0.829 -10.650 1.00 0.00 O ATOM 71 CB SER A 455 13.640 2.375 -11.112 1.00 0.00 C ATOM 72 OG SER A 455 13.332 2.547 -12.488 1.00 0.00 O ATOM 0 H SER A 455 14.442 0.955 -8.879 1.00 0.00 H new ATOM 0 HA SER A 455 12.272 0.726 -10.900 1.00 0.00 H new ATOM 0 HB2 SER A 455 13.079 3.097 -10.519 1.00 0.00 H new ATOM 0 HB3 SER A 455 14.698 2.579 -10.946 1.00 0.00 H new ATOM 0 HG SER A 455 13.551 3.462 -12.760 1.00 0.00 H new ATOM 78 N ILE A 456 14.142 -0.168 -12.661 1.00 0.00 N ATOM 79 CA ILE A 456 15.034 -1.015 -13.472 1.00 0.00 C ATOM 80 C ILE A 456 16.174 -0.141 -14.029 1.00 0.00 C ATOM 81 O ILE A 456 15.907 0.870 -14.689 1.00 0.00 O ATOM 82 CB ILE A 456 14.258 -1.715 -14.656 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.995 -2.469 -14.115 1.00 0.00 C ATOM 84 CG2 ILE A 456 15.193 -2.679 -15.439 1.00 0.00 C ATOM 85 CD1 ILE A 456 12.169 -3.184 -15.173 1.00 0.00 C ATOM 0 H ILE A 456 13.465 0.360 -13.212 1.00 0.00 H new ATOM 0 HA ILE A 456 15.437 -1.805 -12.838 1.00 0.00 H new ATOM 0 HB ILE A 456 13.922 -0.944 -15.349 1.00 0.00 H new ATOM 0 HG12 ILE A 456 13.317 -3.199 -13.373 1.00 0.00 H new ATOM 0 HG13 ILE A 456 12.356 -1.752 -13.600 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.635 -3.149 -16.249 1.00 0.00 H new ATOM 0 HG22 ILE A 456 16.030 -2.117 -15.853 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.570 -3.448 -14.765 1.00 0.00 H new ATOM 0 HD11 ILE A 456 11.318 -3.675 -14.700 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.810 -2.460 -15.905 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.786 -3.930 -15.674 1.00 0.00 H new ATOM 97 N GLU A 457 17.430 -0.518 -13.739 1.00 0.00 N ATOM 98 CA GLU A 457 18.617 0.189 -14.238 1.00 0.00 C ATOM 99 C GLU A 457 19.009 -0.381 -15.613 1.00 0.00 C ATOM 100 O GLU A 457 18.716 0.215 -16.657 1.00 0.00 O ATOM 101 CB GLU A 457 19.786 0.040 -13.223 1.00 0.00 C ATOM 102 CG GLU A 457 21.071 0.827 -13.563 1.00 0.00 C ATOM 103 CD GLU A 457 20.931 2.346 -13.370 1.00 0.00 C ATOM 104 OE1 GLU A 457 20.321 3.024 -14.224 1.00 0.00 O ATOM 105 OE2 GLU A 457 21.422 2.872 -12.350 1.00 0.00 O ATOM 0 H GLU A 457 17.649 -1.322 -13.151 1.00 0.00 H new ATOM 0 HA GLU A 457 18.395 1.250 -14.349 1.00 0.00 H new ATOM 0 HB2 GLU A 457 19.434 0.360 -12.242 1.00 0.00 H new ATOM 0 HB3 GLU A 457 20.040 -1.017 -13.141 1.00 0.00 H new ATOM 0 HG2 GLU A 457 21.886 0.463 -12.938 1.00 0.00 H new ATOM 0 HG3 GLU A 457 21.348 0.625 -14.598 1.00 0.00 H new ATOM 112 N GLU A 458 19.627 -1.576 -15.585 1.00 0.00 N ATOM 113 CA GLU A 458 20.154 -2.267 -16.772 1.00 0.00 C ATOM 114 C GLU A 458 19.515 -3.649 -16.879 1.00 0.00 C ATOM 115 O GLU A 458 18.967 -4.165 -15.905 1.00 0.00 O ATOM 116 CB GLU A 458 21.704 -2.434 -16.664 1.00 0.00 C ATOM 117 CG GLU A 458 22.500 -1.125 -16.531 1.00 0.00 C ATOM 118 CD GLU A 458 22.290 -0.177 -17.727 1.00 0.00 C ATOM 119 OE1 GLU A 458 22.704 -0.528 -18.857 1.00 0.00 O ATOM 120 OE2 GLU A 458 21.688 0.903 -17.555 1.00 0.00 O ATOM 0 H GLU A 458 19.776 -2.096 -14.720 1.00 0.00 H new ATOM 0 HA GLU A 458 19.918 -1.673 -17.655 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.926 -3.063 -15.802 1.00 0.00 H new ATOM 0 HB3 GLU A 458 22.058 -2.966 -17.547 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.204 -0.616 -15.613 1.00 0.00 H new ATOM 0 HG3 GLU A 458 23.561 -1.358 -16.439 1.00 0.00 H new ATOM 127 N ILE A 459 19.578 -4.229 -18.074 1.00 0.00 N ATOM 128 CA ILE A 459 19.258 -5.644 -18.319 1.00 0.00 C ATOM 129 C ILE A 459 20.281 -6.158 -19.338 1.00 0.00 C ATOM 130 O ILE A 459 20.774 -5.382 -20.168 1.00 0.00 O ATOM 131 CB ILE A 459 17.779 -5.865 -18.854 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.728 -5.245 -17.873 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.473 -7.374 -19.084 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.292 -5.288 -18.336 1.00 0.00 C ATOM 0 H ILE A 459 19.857 -3.727 -18.917 1.00 0.00 H new ATOM 0 HA ILE A 459 19.310 -6.193 -17.379 1.00 0.00 H new ATOM 0 HB ILE A 459 17.704 -5.354 -19.814 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.798 -5.767 -16.918 1.00 0.00 H new ATOM 0 HG13 ILE A 459 17.000 -4.206 -17.689 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.452 -7.487 -19.450 1.00 0.00 H new ATOM 0 HG22 ILE A 459 18.169 -7.778 -19.819 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.583 -7.915 -18.144 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.652 -4.832 -17.580 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.195 -4.739 -19.273 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.990 -6.324 -18.490 1.00 0.00 H new ATOM 146 N ASP A 460 20.634 -7.443 -19.243 1.00 0.00 N ATOM 147 CA ASP A 460 21.508 -8.096 -20.225 1.00 0.00 C ATOM 148 C ASP A 460 20.780 -8.221 -21.581 1.00 0.00 C ATOM 149 O ASP A 460 19.554 -8.384 -21.616 1.00 0.00 O ATOM 150 CB ASP A 460 21.936 -9.483 -19.707 1.00 0.00 C ATOM 151 CG ASP A 460 22.961 -10.185 -20.619 1.00 0.00 C ATOM 152 OD1 ASP A 460 24.150 -9.814 -20.592 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.580 -11.116 -21.354 1.00 0.00 O ATOM 0 H ASP A 460 20.325 -8.057 -18.489 1.00 0.00 H new ATOM 0 HA ASP A 460 22.402 -7.489 -20.369 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.362 -9.375 -18.709 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.053 -10.115 -19.610 1.00 0.00 H new ATOM 158 N LEU A 461 21.551 -8.153 -22.680 1.00 0.00 N ATOM 159 CA LEU A 461 21.014 -8.158 -24.054 1.00 0.00 C ATOM 160 C LEU A 461 20.362 -9.523 -24.404 1.00 0.00 C ATOM 161 O LEU A 461 19.338 -9.561 -25.082 1.00 0.00 O ATOM 162 CB LEU A 461 22.139 -7.721 -25.052 1.00 0.00 C ATOM 163 CG LEU A 461 23.496 -8.530 -25.001 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.507 -9.703 -26.001 1.00 0.00 C ATOM 165 CD2 LEU A 461 24.727 -7.611 -25.210 1.00 0.00 C ATOM 0 H LEU A 461 22.568 -8.093 -22.641 1.00 0.00 H new ATOM 0 HA LEU A 461 20.206 -7.431 -24.138 1.00 0.00 H new ATOM 0 HB2 LEU A 461 21.740 -7.791 -26.064 1.00 0.00 H new ATOM 0 HB3 LEU A 461 22.364 -6.670 -24.870 1.00 0.00 H new ATOM 0 HG LEU A 461 23.566 -8.952 -23.999 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.458 -10.231 -25.932 1.00 0.00 H new ATOM 0 HD12 LEU A 461 22.693 -10.389 -25.766 1.00 0.00 H new ATOM 0 HD13 LEU A 461 23.378 -9.320 -27.013 1.00 0.00 H new ATOM 0 HD21 LEU A 461 25.638 -8.208 -25.167 1.00 0.00 H new ATOM 0 HD22 LEU A 461 24.657 -7.125 -26.183 1.00 0.00 H new ATOM 0 HD23 LEU A 461 24.753 -6.853 -24.427 1.00 0.00 H new ATOM 177 N GLU A 462 20.950 -10.635 -23.902 1.00 0.00 N ATOM 178 CA GLU A 462 20.323 -11.985 -23.987 1.00 0.00 C ATOM 179 C GLU A 462 19.284 -12.130 -22.856 1.00 0.00 C ATOM 180 O GLU A 462 18.251 -12.798 -23.008 1.00 0.00 O ATOM 181 CB GLU A 462 21.397 -13.105 -23.833 1.00 0.00 C ATOM 182 CG GLU A 462 22.539 -13.049 -24.855 1.00 0.00 C ATOM 183 CD GLU A 462 23.656 -14.070 -24.566 1.00 0.00 C ATOM 184 OE1 GLU A 462 24.499 -13.811 -23.679 1.00 0.00 O ATOM 185 OE2 GLU A 462 23.702 -15.134 -25.218 1.00 0.00 O ATOM 0 H GLU A 462 21.856 -10.629 -23.434 1.00 0.00 H new ATOM 0 HA GLU A 462 19.845 -12.087 -24.961 1.00 0.00 H new ATOM 0 HB2 GLU A 462 21.822 -13.045 -22.831 1.00 0.00 H new ATOM 0 HB3 GLU A 462 20.904 -14.074 -23.913 1.00 0.00 H new ATOM 0 HG2 GLU A 462 22.137 -13.231 -25.852 1.00 0.00 H new ATOM 0 HG3 GLU A 462 22.964 -12.045 -24.862 1.00 0.00 H new ATOM 192 N GLY A 463 19.587 -11.460 -21.737 1.00 0.00 N ATOM 193 CA GLY A 463 18.794 -11.531 -20.520 1.00 0.00 C ATOM 194 C GLY A 463 19.297 -12.603 -19.570 1.00 0.00 C ATOM 195 O GLY A 463 18.530 -13.452 -19.120 1.00 0.00 O ATOM 0 H GLY A 463 20.400 -10.849 -21.658 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.815 -10.564 -20.018 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.754 -11.734 -20.777 1.00 0.00 H new ATOM 199 N LYS A 464 20.607 -12.560 -19.284 1.00 0.00 N ATOM 200 CA LYS A 464 21.240 -13.405 -18.257 1.00 0.00 C ATOM 201 C LYS A 464 21.046 -12.791 -16.859 1.00 0.00 C ATOM 202 O LYS A 464 21.199 -13.489 -15.850 1.00 0.00 O ATOM 203 CB LYS A 464 22.754 -13.582 -18.552 1.00 0.00 C ATOM 204 CG LYS A 464 23.070 -14.292 -19.890 1.00 0.00 C ATOM 205 CD LYS A 464 24.576 -14.618 -20.048 1.00 0.00 C ATOM 206 CE LYS A 464 25.480 -13.371 -20.045 1.00 0.00 C ATOM 207 NZ LYS A 464 25.231 -12.491 -21.217 1.00 0.00 N ATOM 0 H LYS A 464 21.260 -11.937 -19.759 1.00 0.00 H new ATOM 0 HA LYS A 464 20.762 -14.384 -18.281 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.227 -12.600 -18.556 1.00 0.00 H new ATOM 0 HB3 LYS A 464 23.205 -14.150 -17.739 1.00 0.00 H new ATOM 0 HG2 LYS A 464 22.493 -15.215 -19.953 1.00 0.00 H new ATOM 0 HG3 LYS A 464 22.750 -13.659 -20.718 1.00 0.00 H new ATOM 0 HD2 LYS A 464 24.883 -15.281 -19.239 1.00 0.00 H new ATOM 0 HD3 LYS A 464 24.726 -15.163 -20.980 1.00 0.00 H new ATOM 0 HE2 LYS A 464 25.313 -12.806 -19.128 1.00 0.00 H new ATOM 0 HE3 LYS A 464 26.525 -13.682 -20.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 25.800 -11.625 -21.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 25.496 -12.992 -22.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 24.223 -12.240 -21.254 1.00 0.00 H new ATOM 221 N PHE A 465 20.726 -11.476 -16.813 1.00 0.00 N ATOM 222 CA PHE A 465 20.497 -10.753 -15.552 1.00 0.00 C ATOM 223 C PHE A 465 19.617 -9.511 -15.765 1.00 0.00 C ATOM 224 O PHE A 465 19.508 -8.995 -16.883 1.00 0.00 O ATOM 225 CB PHE A 465 21.848 -10.374 -14.873 1.00 0.00 C ATOM 226 CG PHE A 465 22.675 -9.274 -15.549 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.623 -9.578 -16.525 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.512 -7.933 -15.193 1.00 0.00 C ATOM 229 CE1 PHE A 465 24.375 -8.578 -17.124 1.00 0.00 C ATOM 230 CE2 PHE A 465 23.263 -6.934 -15.791 1.00 0.00 C ATOM 231 CZ PHE A 465 24.194 -7.258 -16.759 1.00 0.00 C ATOM 0 H PHE A 465 20.621 -10.896 -17.645 1.00 0.00 H new ATOM 0 HA PHE A 465 19.959 -11.423 -14.882 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.639 -10.062 -13.850 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.462 -11.273 -14.813 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.774 -10.606 -16.819 1.00 0.00 H new ATOM 0 HD2 PHE A 465 21.787 -7.670 -14.437 1.00 0.00 H new ATOM 0 HE1 PHE A 465 25.105 -8.832 -17.879 1.00 0.00 H new ATOM 0 HE2 PHE A 465 23.121 -5.903 -15.501 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.779 -6.481 -17.229 1.00 0.00 H new ATOM 241 N VAL A 466 18.991 -9.052 -14.666 1.00 0.00 N ATOM 242 CA VAL A 466 18.201 -7.810 -14.603 1.00 0.00 C ATOM 243 C VAL A 466 18.730 -6.961 -13.425 1.00 0.00 C ATOM 244 O VAL A 466 18.515 -7.299 -12.258 1.00 0.00 O ATOM 245 CB VAL A 466 16.653 -8.100 -14.428 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.826 -6.785 -14.366 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.125 -9.028 -15.558 1.00 0.00 C ATOM 0 H VAL A 466 19.022 -9.548 -13.775 1.00 0.00 H new ATOM 0 HA VAL A 466 18.312 -7.270 -15.543 1.00 0.00 H new ATOM 0 HB VAL A 466 16.527 -8.616 -13.476 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.770 -7.025 -14.246 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.160 -6.184 -13.520 1.00 0.00 H new ATOM 0 HG13 VAL A 466 15.967 -6.222 -15.289 1.00 0.00 H new ATOM 0 HG21 VAL A 466 15.060 -9.210 -15.412 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.282 -8.550 -16.525 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.662 -9.976 -15.531 1.00 0.00 H new ATOM 257 N GLN A 467 19.439 -5.878 -13.754 1.00 0.00 N ATOM 258 CA GLN A 467 20.001 -4.932 -12.776 1.00 0.00 C ATOM 259 C GLN A 467 18.930 -3.878 -12.412 1.00 0.00 C ATOM 260 O GLN A 467 18.489 -3.113 -13.265 1.00 0.00 O ATOM 261 CB GLN A 467 21.264 -4.249 -13.388 1.00 0.00 C ATOM 262 CG GLN A 467 21.900 -3.111 -12.557 1.00 0.00 C ATOM 263 CD GLN A 467 22.621 -3.592 -11.295 1.00 0.00 C ATOM 264 OE1 GLN A 467 22.026 -3.716 -10.222 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.911 -3.880 -11.418 1.00 0.00 N ATOM 0 H GLN A 467 19.644 -5.627 -14.721 1.00 0.00 H new ATOM 0 HA GLN A 467 20.294 -5.459 -11.868 1.00 0.00 H new ATOM 0 HB2 GLN A 467 22.021 -5.016 -13.553 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.996 -3.849 -14.366 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.608 -2.569 -13.184 1.00 0.00 H new ATOM 0 HG3 GLN A 467 21.121 -2.404 -12.271 1.00 0.00 H new ATOM 0 HE21 GLN A 467 24.375 -3.767 -12.319 1.00 0.00 H new ATOM 0 HE22 GLN A 467 24.438 -4.214 -10.611 1.00 0.00 H new ATOM 274 N LEU A 468 18.494 -3.888 -11.148 1.00 0.00 N ATOM 275 CA LEU A 468 17.527 -2.925 -10.585 1.00 0.00 C ATOM 276 C LEU A 468 18.283 -1.862 -9.769 1.00 0.00 C ATOM 277 O LEU A 468 19.332 -2.170 -9.220 1.00 0.00 O ATOM 278 CB LEU A 468 16.521 -3.674 -9.669 1.00 0.00 C ATOM 279 CG LEU A 468 15.759 -4.876 -10.315 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.848 -5.566 -9.281 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.955 -4.438 -11.557 1.00 0.00 C ATOM 0 H LEU A 468 18.808 -4.580 -10.468 1.00 0.00 H new ATOM 0 HA LEU A 468 16.981 -2.439 -11.394 1.00 0.00 H new ATOM 0 HB2 LEU A 468 17.061 -4.041 -8.796 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.785 -2.955 -9.310 1.00 0.00 H new ATOM 0 HG LEU A 468 16.504 -5.598 -10.648 1.00 0.00 H new ATOM 0 HD11 LEU A 468 14.328 -6.399 -9.753 1.00 0.00 H new ATOM 0 HD12 LEU A 468 15.453 -5.938 -8.454 1.00 0.00 H new ATOM 0 HD13 LEU A 468 14.118 -4.850 -8.904 1.00 0.00 H new ATOM 0 HD21 LEU A 468 14.439 -5.300 -11.979 1.00 0.00 H new ATOM 0 HD22 LEU A 468 14.224 -3.682 -11.269 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.634 -4.021 -12.301 1.00 0.00 H new ATOM 293 N LYS A 469 17.729 -0.637 -9.668 1.00 0.00 N ATOM 294 CA LYS A 469 18.346 0.489 -8.920 1.00 0.00 C ATOM 295 C LYS A 469 17.259 1.247 -8.142 1.00 0.00 C ATOM 296 O LYS A 469 16.202 1.540 -8.687 1.00 0.00 O ATOM 297 CB LYS A 469 19.105 1.420 -9.918 1.00 0.00 C ATOM 298 CG LYS A 469 19.846 2.661 -9.325 1.00 0.00 C ATOM 299 CD LYS A 469 18.958 3.935 -9.177 1.00 0.00 C ATOM 300 CE LYS A 469 18.306 4.385 -10.502 1.00 0.00 C ATOM 301 NZ LYS A 469 19.310 4.709 -11.547 1.00 0.00 N ATOM 0 H LYS A 469 16.838 -0.395 -10.102 1.00 0.00 H new ATOM 0 HA LYS A 469 19.069 0.112 -8.197 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.837 0.815 -10.452 1.00 0.00 H new ATOM 0 HB3 LYS A 469 18.387 1.778 -10.656 1.00 0.00 H new ATOM 0 HG2 LYS A 469 20.245 2.396 -8.346 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.697 2.899 -9.963 1.00 0.00 H new ATOM 0 HD2 LYS A 469 18.176 3.740 -8.443 1.00 0.00 H new ATOM 0 HD3 LYS A 469 19.567 4.750 -8.785 1.00 0.00 H new ATOM 0 HE2 LYS A 469 17.648 3.596 -10.866 1.00 0.00 H new ATOM 0 HE3 LYS A 469 17.682 5.260 -10.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 18.827 4.874 -12.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 19.833 5.565 -11.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 19.974 3.915 -11.648 1.00 0.00 H new ATOM 315 N ASN A 470 17.561 1.598 -6.883 1.00 0.00 N ATOM 316 CA ASN A 470 16.613 2.260 -5.954 1.00 0.00 C ATOM 317 C ASN A 470 16.714 3.799 -6.050 1.00 0.00 C ATOM 318 O ASN A 470 17.816 4.352 -6.020 1.00 0.00 O ATOM 319 CB ASN A 470 16.920 1.815 -4.505 1.00 0.00 C ATOM 320 CG ASN A 470 15.968 2.401 -3.463 1.00 0.00 C ATOM 321 OD1 ASN A 470 16.179 3.504 -2.984 1.00 0.00 O ATOM 322 ND2 ASN A 470 14.938 1.659 -3.080 1.00 0.00 N ATOM 0 H ASN A 470 18.479 1.431 -6.470 1.00 0.00 H new ATOM 0 HA ASN A 470 15.601 1.966 -6.232 1.00 0.00 H new ATOM 0 HB2 ASN A 470 16.876 0.727 -4.452 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.940 2.105 -4.255 1.00 0.00 H new ATOM 0 HD21 ASN A 470 14.296 2.006 -2.367 1.00 0.00 H new ATOM 0 HD22 ASN A 470 14.787 0.741 -3.498 1.00 0.00 H new ATOM 329 N ASN A 471 15.550 4.478 -6.140 1.00 0.00 N ATOM 330 CA ASN A 471 15.460 5.959 -6.161 1.00 0.00 C ATOM 331 C ASN A 471 14.819 6.518 -4.868 1.00 0.00 C ATOM 332 O ASN A 471 14.552 7.723 -4.774 1.00 0.00 O ATOM 333 CB ASN A 471 14.663 6.420 -7.407 1.00 0.00 C ATOM 334 CG ASN A 471 15.366 6.072 -8.718 1.00 0.00 C ATOM 335 OD1 ASN A 471 15.125 5.019 -9.312 1.00 0.00 O ATOM 336 ND2 ASN A 471 16.273 6.935 -9.154 1.00 0.00 N ATOM 0 H ASN A 471 14.643 4.016 -6.200 1.00 0.00 H new ATOM 0 HA ASN A 471 16.474 6.355 -6.214 1.00 0.00 H new ATOM 0 HB2 ASN A 471 13.677 5.957 -7.394 1.00 0.00 H new ATOM 0 HB3 ASN A 471 14.509 7.498 -7.357 1.00 0.00 H new ATOM 0 HD21 ASN A 471 16.797 6.737 -10.006 1.00 0.00 H new ATOM 0 HD22 ASN A 471 16.447 7.797 -8.637 1.00 0.00 H new ATOM 343 N SER A 472 14.582 5.647 -3.877 1.00 0.00 N ATOM 344 CA SER A 472 14.036 6.044 -2.561 1.00 0.00 C ATOM 345 C SER A 472 15.130 6.617 -1.639 1.00 0.00 C ATOM 346 O SER A 472 16.317 6.301 -1.789 1.00 0.00 O ATOM 347 CB SER A 472 13.387 4.824 -1.874 1.00 0.00 C ATOM 348 OG SER A 472 12.362 4.267 -2.664 1.00 0.00 O ATOM 0 H SER A 472 14.762 4.646 -3.960 1.00 0.00 H new ATOM 0 HA SER A 472 13.292 6.821 -2.735 1.00 0.00 H new ATOM 0 HB2 SER A 472 14.148 4.068 -1.679 1.00 0.00 H new ATOM 0 HB3 SER A 472 12.980 5.124 -0.908 1.00 0.00 H new ATOM 0 HG SER A 472 12.752 3.856 -3.463 1.00 0.00 H new ATOM 354 N ASP A 473 14.700 7.449 -0.676 1.00 0.00 N ATOM 355 CA ASP A 473 15.569 7.976 0.399 1.00 0.00 C ATOM 356 C ASP A 473 15.632 6.972 1.568 1.00 0.00 C ATOM 357 O ASP A 473 16.550 7.015 2.389 1.00 0.00 O ATOM 358 CB ASP A 473 15.032 9.346 0.894 1.00 0.00 C ATOM 359 CG ASP A 473 13.669 9.243 1.616 1.00 0.00 C ATOM 360 OD1 ASP A 473 12.641 9.022 0.931 1.00 0.00 O ATOM 361 OD2 ASP A 473 13.630 9.338 2.868 1.00 0.00 O ATOM 0 H ASP A 473 13.736 7.779 -0.618 1.00 0.00 H new ATOM 0 HA ASP A 473 16.575 8.117 0.004 1.00 0.00 H new ATOM 0 HB2 ASP A 473 15.761 9.791 1.571 1.00 0.00 H new ATOM 0 HB3 ASP A 473 14.934 10.019 0.043 1.00 0.00 H new ATOM 366 N LYS A 474 14.640 6.062 1.616 1.00 0.00 N ATOM 367 CA LYS A 474 14.499 5.031 2.668 1.00 0.00 C ATOM 368 C LYS A 474 14.463 3.636 2.007 1.00 0.00 C ATOM 369 O LYS A 474 14.044 3.508 0.853 1.00 0.00 O ATOM 370 CB LYS A 474 13.223 5.286 3.544 1.00 0.00 C ATOM 371 CG LYS A 474 11.845 4.928 2.911 1.00 0.00 C ATOM 372 CD LYS A 474 11.505 5.732 1.630 1.00 0.00 C ATOM 373 CE LYS A 474 10.145 5.339 1.021 1.00 0.00 C ATOM 374 NZ LYS A 474 9.005 5.713 1.902 1.00 0.00 N ATOM 0 H LYS A 474 13.901 6.020 0.914 1.00 0.00 H new ATOM 0 HA LYS A 474 15.356 5.082 3.339 1.00 0.00 H new ATOM 0 HB2 LYS A 474 13.328 4.718 4.469 1.00 0.00 H new ATOM 0 HB3 LYS A 474 13.206 6.341 3.818 1.00 0.00 H new ATOM 0 HG2 LYS A 474 11.833 3.864 2.673 1.00 0.00 H new ATOM 0 HG3 LYS A 474 11.063 5.098 3.651 1.00 0.00 H new ATOM 0 HD2 LYS A 474 11.498 6.796 1.866 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.289 5.574 0.889 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.028 5.826 0.053 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.126 4.264 0.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 8.110 5.460 1.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 9.082 5.203 2.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 9.026 6.737 2.080 1.00 0.00 H new ATOM 388 N ASP A 475 14.929 2.608 2.727 1.00 0.00 N ATOM 389 CA ASP A 475 15.037 1.228 2.199 1.00 0.00 C ATOM 390 C ASP A 475 13.644 0.599 1.977 1.00 0.00 C ATOM 391 O ASP A 475 12.742 0.749 2.812 1.00 0.00 O ATOM 392 CB ASP A 475 15.912 0.348 3.142 1.00 0.00 C ATOM 393 CG ASP A 475 15.396 0.282 4.593 1.00 0.00 C ATOM 394 OD1 ASP A 475 15.503 1.297 5.316 1.00 0.00 O ATOM 395 OD2 ASP A 475 14.883 -0.777 5.025 1.00 0.00 O ATOM 0 H ASP A 475 15.244 2.702 3.693 1.00 0.00 H new ATOM 0 HA ASP A 475 15.528 1.276 1.227 1.00 0.00 H new ATOM 0 HB2 ASP A 475 15.960 -0.663 2.738 1.00 0.00 H new ATOM 0 HB3 ASP A 475 16.930 0.738 3.146 1.00 0.00 H new ATOM 400 N GLN A 476 13.476 -0.068 0.823 1.00 0.00 N ATOM 401 CA GLN A 476 12.238 -0.774 0.467 1.00 0.00 C ATOM 402 C GLN A 476 12.300 -2.226 0.969 1.00 0.00 C ATOM 403 O GLN A 476 13.180 -2.995 0.560 1.00 0.00 O ATOM 404 CB GLN A 476 12.009 -0.742 -1.074 1.00 0.00 C ATOM 405 CG GLN A 476 10.781 -1.550 -1.567 1.00 0.00 C ATOM 406 CD GLN A 476 9.439 -1.079 -0.995 1.00 0.00 C ATOM 407 OE1 GLN A 476 9.237 0.111 -0.735 1.00 0.00 O ATOM 408 NE2 GLN A 476 8.515 -2.008 -0.783 1.00 0.00 N ATOM 0 H GLN A 476 14.201 -0.132 0.108 1.00 0.00 H new ATOM 0 HA GLN A 476 11.399 -0.269 0.946 1.00 0.00 H new ATOM 0 HB2 GLN A 476 11.893 0.295 -1.388 1.00 0.00 H new ATOM 0 HB3 GLN A 476 12.901 -1.127 -1.568 1.00 0.00 H new ATOM 0 HG2 GLN A 476 10.738 -1.494 -2.655 1.00 0.00 H new ATOM 0 HG3 GLN A 476 10.924 -2.599 -1.308 1.00 0.00 H new ATOM 0 HE21 GLN A 476 8.711 -2.983 -1.008 1.00 0.00 H new ATOM 0 HE22 GLN A 476 7.609 -1.747 -0.395 1.00 0.00 H new ATOM 417 N SER A 477 11.368 -2.583 1.867 1.00 0.00 N ATOM 418 CA SER A 477 11.153 -3.968 2.302 1.00 0.00 C ATOM 419 C SER A 477 10.654 -4.800 1.100 1.00 0.00 C ATOM 420 O SER A 477 9.535 -4.595 0.604 1.00 0.00 O ATOM 421 CB SER A 477 10.146 -3.989 3.482 1.00 0.00 C ATOM 422 OG SER A 477 8.986 -3.218 3.196 1.00 0.00 O ATOM 0 H SER A 477 10.740 -1.914 2.313 1.00 0.00 H new ATOM 0 HA SER A 477 12.084 -4.410 2.656 1.00 0.00 H new ATOM 0 HB2 SER A 477 9.856 -5.018 3.695 1.00 0.00 H new ATOM 0 HB3 SER A 477 10.629 -3.602 4.379 1.00 0.00 H new ATOM 0 HG SER A 477 8.711 -3.373 2.268 1.00 0.00 H new ATOM 428 N LEU A 478 11.515 -5.704 0.603 1.00 0.00 N ATOM 429 CA LEU A 478 11.258 -6.442 -0.647 1.00 0.00 C ATOM 430 C LEU A 478 10.786 -7.868 -0.307 1.00 0.00 C ATOM 431 O LEU A 478 10.713 -8.246 0.870 1.00 0.00 O ATOM 432 CB LEU A 478 12.547 -6.436 -1.546 1.00 0.00 C ATOM 433 CG LEU A 478 12.307 -6.233 -3.080 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.712 -4.837 -3.365 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.599 -6.449 -3.896 1.00 0.00 C ATOM 0 H LEU A 478 12.400 -5.943 1.050 1.00 0.00 H new ATOM 0 HA LEU A 478 10.466 -5.957 -1.218 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.209 -5.645 -1.193 1.00 0.00 H new ATOM 0 HB3 LEU A 478 13.072 -7.380 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 478 11.587 -6.988 -3.397 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.555 -4.721 -4.437 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.759 -4.734 -2.845 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.401 -4.069 -3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.390 -6.299 -4.955 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.358 -5.737 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 478 13.963 -7.464 -3.738 1.00 0.00 H new ATOM 447 N GLY A 479 10.424 -8.641 -1.335 1.00 0.00 N ATOM 448 CA GLY A 479 9.946 -10.016 -1.139 1.00 0.00 C ATOM 449 C GLY A 479 8.570 -10.198 -1.709 1.00 0.00 C ATOM 450 O GLY A 479 8.295 -11.132 -2.473 1.00 0.00 O ATOM 0 H GLY A 479 10.452 -8.341 -2.309 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.635 -10.715 -1.614 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.936 -10.252 -0.075 1.00 0.00 H new ATOM 454 N ASN A 480 7.707 -9.273 -1.307 1.00 0.00 N ATOM 455 CA ASN A 480 6.335 -9.172 -1.796 1.00 0.00 C ATOM 456 C ASN A 480 6.320 -8.813 -3.306 1.00 0.00 C ATOM 457 O ASN A 480 5.367 -9.128 -4.022 1.00 0.00 O ATOM 458 CB ASN A 480 5.590 -8.094 -0.967 1.00 0.00 C ATOM 459 CG ASN A 480 5.673 -8.279 0.559 1.00 0.00 C ATOM 460 OD1 ASN A 480 5.678 -7.300 1.304 1.00 0.00 O ATOM 461 ND2 ASN A 480 5.721 -9.522 1.036 1.00 0.00 N ATOM 0 H ASN A 480 7.944 -8.558 -0.619 1.00 0.00 H new ATOM 0 HA ASN A 480 5.832 -10.132 -1.680 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.996 -7.115 -1.222 1.00 0.00 H new ATOM 0 HB3 ASN A 480 4.541 -8.091 -1.262 1.00 0.00 H new ATOM 0 HD21 ASN A 480 5.763 -9.681 2.043 1.00 0.00 H new ATOM 0 HD22 ASN A 480 5.715 -10.315 0.394 1.00 0.00 H new ATOM 468 N TRP A 481 7.420 -8.175 -3.770 1.00 0.00 N ATOM 469 CA TRP A 481 7.578 -7.705 -5.159 1.00 0.00 C ATOM 470 C TRP A 481 7.912 -8.869 -6.108 1.00 0.00 C ATOM 471 O TRP A 481 8.336 -9.946 -5.670 1.00 0.00 O ATOM 472 CB TRP A 481 8.674 -6.605 -5.237 1.00 0.00 C ATOM 473 CG TRP A 481 8.284 -5.269 -4.638 1.00 0.00 C ATOM 474 CD1 TRP A 481 7.498 -5.034 -3.539 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.698 -3.981 -5.107 1.00 0.00 C ATOM 476 NE1 TRP A 481 7.389 -3.685 -3.322 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.118 -3.019 -4.266 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.502 -3.553 -6.163 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.314 -1.655 -4.449 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.698 -2.202 -6.338 1.00 0.00 C ATOM 481 CH2 TRP A 481 9.106 -1.264 -5.488 1.00 0.00 C ATOM 0 H TRP A 481 8.228 -7.972 -3.182 1.00 0.00 H new ATOM 0 HA TRP A 481 6.628 -7.276 -5.479 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.568 -6.967 -4.729 1.00 0.00 H new ATOM 0 HB3 TRP A 481 8.941 -6.453 -6.283 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.034 -5.799 -2.934 1.00 0.00 H new ATOM 0 HE1 TRP A 481 6.850 -3.248 -2.575 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.962 -4.267 -6.830 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 7.855 -0.931 -3.792 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 10.323 -1.859 -7.150 1.00 0.00 H new ATOM 0 HH2 TRP A 481 9.279 -0.211 -5.657 1.00 0.00 H new ATOM 492 N ARG A 482 7.749 -8.605 -7.416 1.00 0.00 N ATOM 493 CA ARG A 482 7.824 -9.625 -8.475 1.00 0.00 C ATOM 494 C ARG A 482 8.186 -8.975 -9.828 1.00 0.00 C ATOM 495 O ARG A 482 7.685 -7.906 -10.166 1.00 0.00 O ATOM 496 CB ARG A 482 6.470 -10.404 -8.545 1.00 0.00 C ATOM 497 CG ARG A 482 5.198 -9.514 -8.520 1.00 0.00 C ATOM 498 CD ARG A 482 3.900 -10.328 -8.366 1.00 0.00 C ATOM 499 NE ARG A 482 2.719 -9.467 -8.143 1.00 0.00 N ATOM 500 CZ ARG A 482 1.448 -9.819 -8.400 1.00 0.00 C ATOM 501 NH1 ARG A 482 1.160 -10.981 -8.988 1.00 0.00 N ATOM 502 NH2 ARG A 482 0.465 -9.000 -8.070 1.00 0.00 N ATOM 0 H ARG A 482 7.560 -7.668 -7.771 1.00 0.00 H new ATOM 0 HA ARG A 482 8.615 -10.338 -8.241 1.00 0.00 H new ATOM 0 HB2 ARG A 482 6.459 -11.002 -9.456 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.425 -11.100 -7.707 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.275 -8.803 -7.698 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.149 -8.933 -9.441 1.00 0.00 H new ATOM 0 HD2 ARG A 482 3.744 -10.930 -9.261 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.005 -11.020 -7.530 1.00 0.00 H new ATOM 0 HE ARG A 482 2.882 -8.534 -7.765 1.00 0.00 H new ATOM 0 HH11 ARG A 482 1.911 -11.620 -9.251 1.00 0.00 H new ATOM 0 HH12 ARG A 482 0.189 -11.231 -9.175 1.00 0.00 H new ATOM 0 HH21 ARG A 482 0.673 -8.107 -7.623 1.00 0.00 H new ATOM 0 HH22 ARG A 482 -0.502 -9.261 -8.262 1.00 0.00 H new ATOM 516 N ILE A 483 9.066 -9.640 -10.589 1.00 0.00 N ATOM 517 CA ILE A 483 9.541 -9.183 -11.897 1.00 0.00 C ATOM 518 C ILE A 483 8.841 -10.007 -12.988 1.00 0.00 C ATOM 519 O ILE A 483 9.059 -11.217 -13.080 1.00 0.00 O ATOM 520 CB ILE A 483 11.105 -9.356 -12.052 1.00 0.00 C ATOM 521 CG1 ILE A 483 11.884 -8.626 -10.911 1.00 0.00 C ATOM 522 CG2 ILE A 483 11.578 -8.862 -13.446 1.00 0.00 C ATOM 523 CD1 ILE A 483 13.401 -8.783 -10.982 1.00 0.00 C ATOM 0 H ILE A 483 9.475 -10.530 -10.304 1.00 0.00 H new ATOM 0 HA ILE A 483 9.309 -8.122 -11.991 1.00 0.00 H new ATOM 0 HB ILE A 483 11.326 -10.420 -11.969 1.00 0.00 H new ATOM 0 HG12 ILE A 483 11.639 -7.564 -10.942 1.00 0.00 H new ATOM 0 HG13 ILE A 483 11.536 -9.005 -9.950 1.00 0.00 H new ATOM 0 HG21 ILE A 483 12.657 -8.990 -13.531 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.082 -9.441 -14.225 1.00 0.00 H new ATOM 0 HG23 ILE A 483 11.328 -7.807 -13.562 1.00 0.00 H new ATOM 0 HD11 ILE A 483 13.862 -8.245 -10.153 1.00 0.00 H new ATOM 0 HD12 ILE A 483 13.661 -9.840 -10.918 1.00 0.00 H new ATOM 0 HD13 ILE A 483 13.765 -8.376 -11.925 1.00 0.00 H new ATOM 535 N LYS A 484 7.996 -9.354 -13.787 1.00 0.00 N ATOM 536 CA LYS A 484 7.408 -9.942 -14.997 1.00 0.00 C ATOM 537 C LYS A 484 8.438 -9.883 -16.136 1.00 0.00 C ATOM 538 O LYS A 484 9.177 -8.904 -16.248 1.00 0.00 O ATOM 539 CB LYS A 484 6.128 -9.161 -15.399 1.00 0.00 C ATOM 540 CG LYS A 484 4.989 -9.250 -14.365 1.00 0.00 C ATOM 541 CD LYS A 484 3.754 -8.409 -14.759 1.00 0.00 C ATOM 542 CE LYS A 484 2.567 -8.615 -13.799 1.00 0.00 C ATOM 543 NZ LYS A 484 2.012 -9.986 -13.909 1.00 0.00 N ATOM 0 H LYS A 484 7.696 -8.395 -13.613 1.00 0.00 H new ATOM 0 HA LYS A 484 7.137 -10.980 -14.803 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.387 -8.113 -15.550 1.00 0.00 H new ATOM 0 HB3 LYS A 484 5.768 -9.541 -16.355 1.00 0.00 H new ATOM 0 HG2 LYS A 484 4.691 -10.292 -14.249 1.00 0.00 H new ATOM 0 HG3 LYS A 484 5.357 -8.914 -13.396 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.027 -7.354 -14.773 1.00 0.00 H new ATOM 0 HD3 LYS A 484 3.448 -8.672 -15.771 1.00 0.00 H new ATOM 0 HE2 LYS A 484 2.891 -8.433 -12.774 1.00 0.00 H new ATOM 0 HE3 LYS A 484 1.787 -7.887 -14.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 1.118 -10.042 -13.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 1.838 -10.211 -14.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 2.690 -10.668 -13.513 1.00 0.00 H new ATOM 557 N ARG A 485 8.496 -10.940 -16.951 1.00 0.00 N ATOM 558 CA ARG A 485 9.332 -10.977 -18.158 1.00 0.00 C ATOM 559 C ARG A 485 8.597 -11.756 -19.255 1.00 0.00 C ATOM 560 O ARG A 485 8.609 -12.992 -19.286 1.00 0.00 O ATOM 561 CB ARG A 485 10.724 -11.588 -17.867 1.00 0.00 C ATOM 562 CG ARG A 485 11.657 -11.661 -19.104 1.00 0.00 C ATOM 563 CD ARG A 485 13.044 -12.190 -18.747 1.00 0.00 C ATOM 564 NE ARG A 485 13.907 -12.384 -19.925 1.00 0.00 N ATOM 565 CZ ARG A 485 15.227 -12.618 -19.872 1.00 0.00 C ATOM 566 NH1 ARG A 485 15.887 -12.546 -18.724 1.00 0.00 N ATOM 567 NH2 ARG A 485 15.880 -12.903 -20.985 1.00 0.00 N ATOM 0 H ARG A 485 7.964 -11.796 -16.794 1.00 0.00 H new ATOM 0 HA ARG A 485 9.506 -9.957 -18.500 1.00 0.00 H new ATOM 0 HB2 ARG A 485 11.213 -10.998 -17.092 1.00 0.00 H new ATOM 0 HB3 ARG A 485 10.591 -12.593 -17.466 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.207 -12.305 -19.859 1.00 0.00 H new ATOM 0 HG3 ARG A 485 11.751 -10.669 -19.546 1.00 0.00 H new ATOM 0 HD2 ARG A 485 13.527 -11.494 -18.061 1.00 0.00 H new ATOM 0 HD3 ARG A 485 12.940 -13.138 -18.219 1.00 0.00 H new ATOM 0 HE ARG A 485 13.470 -12.337 -20.846 1.00 0.00 H new ATOM 0 HH11 ARG A 485 15.391 -12.310 -17.865 1.00 0.00 H new ATOM 0 HH12 ARG A 485 16.891 -12.727 -18.700 1.00 0.00 H new ATOM 0 HH21 ARG A 485 15.380 -12.943 -21.873 1.00 0.00 H new ATOM 0 HH22 ARG A 485 16.884 -13.083 -20.956 1.00 0.00 H new ATOM 581 N GLN A 486 7.926 -11.000 -20.119 1.00 0.00 N ATOM 582 CA GLN A 486 7.164 -11.510 -21.264 1.00 0.00 C ATOM 583 C GLN A 486 8.018 -11.392 -22.542 1.00 0.00 C ATOM 584 O GLN A 486 8.219 -10.296 -23.073 1.00 0.00 O ATOM 585 CB GLN A 486 5.812 -10.727 -21.385 1.00 0.00 C ATOM 586 CG GLN A 486 5.913 -9.208 -21.126 1.00 0.00 C ATOM 587 CD GLN A 486 4.605 -8.444 -21.327 1.00 0.00 C ATOM 588 OE1 GLN A 486 4.328 -7.937 -22.417 1.00 0.00 O ATOM 589 NE2 GLN A 486 3.785 -8.363 -20.284 1.00 0.00 N ATOM 0 H GLN A 486 7.894 -9.983 -20.043 1.00 0.00 H new ATOM 0 HA GLN A 486 6.924 -12.563 -21.121 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.407 -10.884 -22.385 1.00 0.00 H new ATOM 0 HB3 GLN A 486 5.098 -11.154 -20.681 1.00 0.00 H new ATOM 0 HG2 GLN A 486 6.259 -9.048 -20.105 1.00 0.00 H new ATOM 0 HG3 GLN A 486 6.670 -8.788 -21.789 1.00 0.00 H new ATOM 0 HE21 GLN A 486 4.045 -8.794 -19.397 1.00 0.00 H new ATOM 0 HE22 GLN A 486 2.896 -7.870 -20.371 1.00 0.00 H new ATOM 598 N VAL A 487 8.561 -12.532 -22.996 1.00 0.00 N ATOM 599 CA VAL A 487 9.363 -12.620 -24.237 1.00 0.00 C ATOM 600 C VAL A 487 8.412 -12.765 -25.447 1.00 0.00 C ATOM 601 O VAL A 487 7.312 -13.287 -25.288 1.00 0.00 O ATOM 602 CB VAL A 487 10.370 -13.833 -24.182 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.358 -13.800 -25.371 1.00 0.00 C ATOM 604 CG2 VAL A 487 11.139 -13.879 -22.834 1.00 0.00 C ATOM 0 H VAL A 487 8.459 -13.425 -22.514 1.00 0.00 H new ATOM 0 HA VAL A 487 9.952 -11.708 -24.340 1.00 0.00 H new ATOM 0 HB VAL A 487 9.776 -14.744 -24.259 1.00 0.00 H new ATOM 0 HG11 VAL A 487 12.038 -14.649 -25.303 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.802 -13.854 -26.307 1.00 0.00 H new ATOM 0 HG13 VAL A 487 11.931 -12.873 -25.342 1.00 0.00 H new ATOM 0 HG21 VAL A 487 11.823 -14.728 -22.834 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.706 -12.957 -22.707 1.00 0.00 H new ATOM 0 HG23 VAL A 487 10.429 -13.985 -22.014 1.00 0.00 H new ATOM 614 N LEU A 488 8.838 -12.322 -26.662 1.00 0.00 N ATOM 615 CA LEU A 488 7.979 -12.370 -27.879 1.00 0.00 C ATOM 616 C LEU A 488 7.681 -13.825 -28.311 1.00 0.00 C ATOM 617 O LEU A 488 6.778 -14.061 -29.124 1.00 0.00 O ATOM 618 CB LEU A 488 8.601 -11.530 -29.048 1.00 0.00 C ATOM 619 CG LEU A 488 9.819 -12.145 -29.848 1.00 0.00 C ATOM 620 CD1 LEU A 488 9.370 -13.001 -31.065 1.00 0.00 C ATOM 621 CD2 LEU A 488 10.814 -11.050 -30.312 1.00 0.00 C ATOM 0 H LEU A 488 9.765 -11.930 -26.824 1.00 0.00 H new ATOM 0 HA LEU A 488 7.023 -11.913 -27.624 1.00 0.00 H new ATOM 0 HB2 LEU A 488 7.807 -11.317 -29.764 1.00 0.00 H new ATOM 0 HB3 LEU A 488 8.923 -10.574 -28.636 1.00 0.00 H new ATOM 0 HG LEU A 488 10.327 -12.807 -29.147 1.00 0.00 H new ATOM 0 HD11 LEU A 488 10.248 -13.397 -31.575 1.00 0.00 H new ATOM 0 HD12 LEU A 488 8.748 -13.827 -30.719 1.00 0.00 H new ATOM 0 HD13 LEU A 488 8.798 -12.381 -31.755 1.00 0.00 H new ATOM 0 HD21 LEU A 488 11.636 -11.513 -30.858 1.00 0.00 H new ATOM 0 HD22 LEU A 488 10.299 -10.343 -30.963 1.00 0.00 H new ATOM 0 HD23 LEU A 488 11.207 -10.523 -29.442 1.00 0.00 H new ATOM 633 N GLU A 489 8.448 -14.788 -27.752 1.00 0.00 N ATOM 634 CA GLU A 489 8.202 -16.241 -27.930 1.00 0.00 C ATOM 635 C GLU A 489 6.822 -16.643 -27.355 1.00 0.00 C ATOM 636 O GLU A 489 6.224 -17.643 -27.771 1.00 0.00 O ATOM 637 CB GLU A 489 9.316 -17.074 -27.220 1.00 0.00 C ATOM 638 CG GLU A 489 10.769 -16.669 -27.556 1.00 0.00 C ATOM 639 CD GLU A 489 11.087 -16.684 -29.059 1.00 0.00 C ATOM 640 OE1 GLU A 489 11.347 -17.778 -29.613 1.00 0.00 O ATOM 641 OE2 GLU A 489 11.085 -15.606 -29.690 1.00 0.00 O ATOM 0 H GLU A 489 9.256 -14.582 -27.164 1.00 0.00 H new ATOM 0 HA GLU A 489 8.216 -16.451 -28.999 1.00 0.00 H new ATOM 0 HB2 GLU A 489 9.175 -16.992 -26.142 1.00 0.00 H new ATOM 0 HB3 GLU A 489 9.181 -18.124 -27.480 1.00 0.00 H new ATOM 0 HG2 GLU A 489 10.957 -15.669 -27.165 1.00 0.00 H new ATOM 0 HG3 GLU A 489 11.452 -17.346 -27.043 1.00 0.00 H new ATOM 648 N GLY A 490 6.332 -15.823 -26.414 1.00 0.00 N ATOM 649 CA GLY A 490 5.112 -16.098 -25.658 1.00 0.00 C ATOM 650 C GLY A 490 5.420 -16.555 -24.239 1.00 0.00 C ATOM 651 O GLY A 490 4.511 -16.678 -23.410 1.00 0.00 O ATOM 0 H GLY A 490 6.779 -14.943 -26.158 1.00 0.00 H new ATOM 0 HA2 GLY A 490 4.494 -15.201 -25.625 1.00 0.00 H new ATOM 0 HA3 GLY A 490 4.532 -16.866 -26.170 1.00 0.00 H new ATOM 655 N GLU A 491 6.716 -16.805 -23.962 1.00 0.00 N ATOM 656 CA GLU A 491 7.184 -17.297 -22.663 1.00 0.00 C ATOM 657 C GLU A 491 7.243 -16.149 -21.642 1.00 0.00 C ATOM 658 O GLU A 491 8.117 -15.276 -21.720 1.00 0.00 O ATOM 659 CB GLU A 491 8.568 -17.980 -22.808 1.00 0.00 C ATOM 660 CG GLU A 491 8.590 -19.141 -23.820 1.00 0.00 C ATOM 661 CD GLU A 491 9.933 -19.882 -23.851 1.00 0.00 C ATOM 662 OE1 GLU A 491 10.830 -19.495 -24.633 1.00 0.00 O ATOM 663 OE2 GLU A 491 10.099 -20.857 -23.081 1.00 0.00 O ATOM 0 H GLU A 491 7.466 -16.669 -24.640 1.00 0.00 H new ATOM 0 HA GLU A 491 6.475 -18.040 -22.297 1.00 0.00 H new ATOM 0 HB2 GLU A 491 9.301 -17.232 -23.112 1.00 0.00 H new ATOM 0 HB3 GLU A 491 8.881 -18.355 -21.833 1.00 0.00 H new ATOM 0 HG2 GLU A 491 7.797 -19.847 -23.572 1.00 0.00 H new ATOM 0 HG3 GLU A 491 8.372 -18.753 -24.815 1.00 0.00 H new ATOM 670 N GLU A 492 6.273 -16.141 -20.720 1.00 0.00 N ATOM 671 CA GLU A 492 6.246 -15.208 -19.587 1.00 0.00 C ATOM 672 C GLU A 492 6.615 -15.957 -18.296 1.00 0.00 C ATOM 673 O GLU A 492 6.123 -17.069 -18.040 1.00 0.00 O ATOM 674 CB GLU A 492 4.863 -14.510 -19.435 1.00 0.00 C ATOM 675 CG GLU A 492 3.644 -15.455 -19.266 1.00 0.00 C ATOM 676 CD GLU A 492 2.380 -14.748 -18.729 1.00 0.00 C ATOM 677 OE1 GLU A 492 2.131 -13.572 -19.091 1.00 0.00 O ATOM 678 OE2 GLU A 492 1.639 -15.350 -17.921 1.00 0.00 O ATOM 0 H GLU A 492 5.481 -16.784 -20.739 1.00 0.00 H new ATOM 0 HA GLU A 492 6.978 -14.424 -19.779 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.906 -13.845 -18.572 1.00 0.00 H new ATOM 0 HB3 GLU A 492 4.695 -13.884 -20.312 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.413 -15.911 -20.229 1.00 0.00 H new ATOM 0 HG3 GLU A 492 3.914 -16.263 -18.587 1.00 0.00 H new ATOM 685 N ILE A 493 7.515 -15.353 -17.513 1.00 0.00 N ATOM 686 CA ILE A 493 7.917 -15.844 -16.185 1.00 0.00 C ATOM 687 C ILE A 493 7.792 -14.689 -15.174 1.00 0.00 C ATOM 688 O ILE A 493 7.827 -13.511 -15.558 1.00 0.00 O ATOM 689 CB ILE A 493 9.394 -16.410 -16.189 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.395 -15.324 -16.708 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.498 -17.725 -17.013 1.00 0.00 C ATOM 692 CD1 ILE A 493 11.845 -15.756 -16.760 1.00 0.00 C ATOM 0 H ILE A 493 7.994 -14.495 -17.786 1.00 0.00 H new ATOM 0 HA ILE A 493 7.260 -16.667 -15.903 1.00 0.00 H new ATOM 0 HB ILE A 493 9.666 -16.656 -15.163 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.088 -15.018 -17.708 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.317 -14.445 -16.068 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.526 -18.086 -16.994 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.841 -18.479 -16.579 1.00 0.00 H new ATOM 0 HG23 ILE A 493 9.200 -17.533 -18.044 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.456 -14.934 -17.132 1.00 0.00 H new ATOM 0 HD12 ILE A 493 12.178 -16.032 -15.760 1.00 0.00 H new ATOM 0 HD13 ILE A 493 11.946 -16.613 -17.425 1.00 0.00 H new ATOM 704 N ALA A 494 7.633 -15.034 -13.890 1.00 0.00 N ATOM 705 CA ALA A 494 7.557 -14.050 -12.802 1.00 0.00 C ATOM 706 C ALA A 494 8.508 -14.461 -11.674 1.00 0.00 C ATOM 707 O ALA A 494 8.249 -15.447 -10.975 1.00 0.00 O ATOM 708 CB ALA A 494 6.110 -13.930 -12.291 1.00 0.00 C ATOM 0 H ALA A 494 7.554 -16.001 -13.576 1.00 0.00 H new ATOM 0 HA ALA A 494 7.861 -13.072 -13.175 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.068 -13.197 -11.485 1.00 0.00 H new ATOM 0 HB2 ALA A 494 5.462 -13.610 -13.106 1.00 0.00 H new ATOM 0 HB3 ALA A 494 5.774 -14.898 -11.919 1.00 0.00 H new ATOM 714 N TYR A 495 9.622 -13.720 -11.520 1.00 0.00 N ATOM 715 CA TYR A 495 10.525 -13.905 -10.377 1.00 0.00 C ATOM 716 C TYR A 495 10.045 -13.030 -9.221 1.00 0.00 C ATOM 717 O TYR A 495 10.267 -11.822 -9.215 1.00 0.00 O ATOM 718 CB TYR A 495 11.995 -13.542 -10.736 1.00 0.00 C ATOM 719 CG TYR A 495 12.969 -13.642 -9.538 1.00 0.00 C ATOM 720 CD1 TYR A 495 13.288 -14.878 -8.971 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.549 -12.503 -8.965 1.00 0.00 C ATOM 722 CE1 TYR A 495 14.145 -14.979 -7.890 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.409 -12.602 -7.883 1.00 0.00 C ATOM 724 CZ TYR A 495 14.704 -13.837 -7.350 1.00 0.00 C ATOM 725 OH TYR A 495 15.566 -13.932 -6.272 1.00 0.00 O ATOM 0 H TYR A 495 9.914 -12.992 -12.172 1.00 0.00 H new ATOM 0 HA TYR A 495 10.508 -14.957 -10.092 1.00 0.00 H new ATOM 0 HB2 TYR A 495 12.340 -14.204 -11.530 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.023 -12.527 -11.132 1.00 0.00 H new ATOM 0 HD1 TYR A 495 12.855 -15.776 -9.386 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.322 -11.530 -9.374 1.00 0.00 H new ATOM 0 HE1 TYR A 495 14.376 -15.947 -7.470 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.848 -11.711 -7.458 1.00 0.00 H new ATOM 0 HH TYR A 495 15.870 -13.036 -6.016 1.00 0.00 H new ATOM 735 N LYS A 496 9.408 -13.650 -8.232 1.00 0.00 N ATOM 736 CA LYS A 496 9.079 -12.979 -6.978 1.00 0.00 C ATOM 737 C LYS A 496 10.279 -13.117 -6.035 1.00 0.00 C ATOM 738 O LYS A 496 11.010 -14.112 -6.087 1.00 0.00 O ATOM 739 CB LYS A 496 7.748 -13.533 -6.383 1.00 0.00 C ATOM 740 CG LYS A 496 7.691 -15.060 -6.066 1.00 0.00 C ATOM 741 CD LYS A 496 8.167 -15.418 -4.636 1.00 0.00 C ATOM 742 CE LYS A 496 7.311 -14.756 -3.535 1.00 0.00 C ATOM 743 NZ LYS A 496 7.838 -15.043 -2.179 1.00 0.00 N ATOM 0 H LYS A 496 9.107 -14.624 -8.276 1.00 0.00 H new ATOM 0 HA LYS A 496 8.897 -11.917 -7.140 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.537 -12.989 -5.463 1.00 0.00 H new ATOM 0 HB3 LYS A 496 6.944 -13.302 -7.082 1.00 0.00 H new ATOM 0 HG2 LYS A 496 6.667 -15.411 -6.197 1.00 0.00 H new ATOM 0 HG3 LYS A 496 8.307 -15.595 -6.789 1.00 0.00 H new ATOM 0 HD2 LYS A 496 8.139 -16.500 -4.509 1.00 0.00 H new ATOM 0 HD3 LYS A 496 9.206 -15.110 -4.516 1.00 0.00 H new ATOM 0 HE2 LYS A 496 7.285 -13.678 -3.694 1.00 0.00 H new ATOM 0 HE3 LYS A 496 6.284 -15.114 -3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 7.142 -14.744 -1.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 8.015 -16.063 -2.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 8.727 -14.523 -2.035 1.00 0.00 H new ATOM 757 N PHE A 497 10.496 -12.097 -5.210 1.00 0.00 N ATOM 758 CA PHE A 497 11.632 -12.046 -4.279 1.00 0.00 C ATOM 759 C PHE A 497 11.316 -12.816 -2.982 1.00 0.00 C ATOM 760 O PHE A 497 10.177 -13.246 -2.756 1.00 0.00 O ATOM 761 CB PHE A 497 11.982 -10.562 -3.993 1.00 0.00 C ATOM 762 CG PHE A 497 12.565 -9.820 -5.193 1.00 0.00 C ATOM 763 CD1 PHE A 497 13.938 -9.830 -5.428 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.750 -9.117 -6.083 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.480 -9.161 -6.508 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.294 -8.446 -7.162 1.00 0.00 C ATOM 767 CZ PHE A 497 13.659 -8.470 -7.372 1.00 0.00 C ATOM 0 H PHE A 497 9.891 -11.277 -5.164 1.00 0.00 H new ATOM 0 HA PHE A 497 12.497 -12.532 -4.730 1.00 0.00 H new ATOM 0 HB2 PHE A 497 11.082 -10.044 -3.661 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.696 -10.520 -3.170 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.589 -10.369 -4.755 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.682 -9.097 -5.926 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.547 -9.180 -6.675 1.00 0.00 H new ATOM 0 HE2 PHE A 497 11.652 -7.903 -7.840 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.084 -7.946 -8.215 1.00 0.00 H new ATOM 777 N THR A 498 12.342 -13.009 -2.150 1.00 0.00 N ATOM 778 CA THR A 498 12.204 -13.658 -0.839 1.00 0.00 C ATOM 779 C THR A 498 11.773 -12.610 0.208 1.00 0.00 C ATOM 780 O THR A 498 12.377 -11.539 0.264 1.00 0.00 O ATOM 781 CB THR A 498 13.552 -14.340 -0.427 1.00 0.00 C ATOM 782 OG1 THR A 498 14.608 -13.366 -0.367 1.00 0.00 O ATOM 783 CG2 THR A 498 13.950 -15.437 -1.426 1.00 0.00 C ATOM 0 H THR A 498 13.296 -12.719 -2.365 1.00 0.00 H new ATOM 0 HA THR A 498 11.440 -14.433 -0.895 1.00 0.00 H new ATOM 0 HB THR A 498 13.403 -14.789 0.555 1.00 0.00 H new ATOM 0 HG1 THR A 498 15.444 -13.806 -0.107 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.890 -15.891 -1.112 1.00 0.00 H new ATOM 0 HG22 THR A 498 13.172 -16.199 -1.459 1.00 0.00 H new ATOM 0 HG23 THR A 498 14.071 -15.000 -2.417 1.00 0.00 H new ATOM 791 N PRO A 499 10.698 -12.873 1.032 1.00 0.00 N ATOM 792 CA PRO A 499 10.189 -11.893 2.041 1.00 0.00 C ATOM 793 C PRO A 499 11.223 -11.543 3.135 1.00 0.00 C ATOM 794 O PRO A 499 11.047 -10.569 3.869 1.00 0.00 O ATOM 795 CB PRO A 499 8.933 -12.594 2.630 1.00 0.00 C ATOM 796 CG PRO A 499 9.152 -14.051 2.357 1.00 0.00 C ATOM 797 CD PRO A 499 9.871 -14.113 1.027 1.00 0.00 C ATOM 0 HA PRO A 499 9.968 -10.927 1.588 1.00 0.00 H new ATOM 0 HB2 PRO A 499 8.835 -12.401 3.698 1.00 0.00 H new ATOM 0 HB3 PRO A 499 8.019 -12.235 2.156 1.00 0.00 H new ATOM 0 HG2 PRO A 499 9.746 -14.512 3.146 1.00 0.00 H new ATOM 0 HG3 PRO A 499 8.205 -14.589 2.316 1.00 0.00 H new ATOM 0 HD2 PRO A 499 10.487 -15.008 0.943 1.00 0.00 H new ATOM 0 HD3 PRO A 499 9.172 -14.128 0.191 1.00 0.00 H new ATOM 805 N LYS A 500 12.292 -12.354 3.222 1.00 0.00 N ATOM 806 CA LYS A 500 13.420 -12.135 4.148 1.00 0.00 C ATOM 807 C LYS A 500 14.466 -11.146 3.566 1.00 0.00 C ATOM 808 O LYS A 500 15.503 -10.908 4.191 1.00 0.00 O ATOM 809 CB LYS A 500 14.088 -13.504 4.455 1.00 0.00 C ATOM 810 CG LYS A 500 14.769 -14.179 3.238 1.00 0.00 C ATOM 811 CD LYS A 500 15.302 -15.614 3.523 1.00 0.00 C ATOM 812 CE LYS A 500 16.499 -15.679 4.503 1.00 0.00 C ATOM 813 NZ LYS A 500 16.130 -15.379 5.913 1.00 0.00 N ATOM 0 H LYS A 500 12.399 -13.189 2.646 1.00 0.00 H new ATOM 0 HA LYS A 500 13.034 -11.688 5.064 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.833 -13.362 5.238 1.00 0.00 H new ATOM 0 HB3 LYS A 500 13.332 -14.181 4.853 1.00 0.00 H new ATOM 0 HG2 LYS A 500 14.056 -14.225 2.415 1.00 0.00 H new ATOM 0 HG3 LYS A 500 15.598 -13.554 2.906 1.00 0.00 H new ATOM 0 HD2 LYS A 500 14.487 -16.216 3.926 1.00 0.00 H new ATOM 0 HD3 LYS A 500 15.598 -16.071 2.579 1.00 0.00 H new ATOM 0 HE2 LYS A 500 16.943 -16.673 4.456 1.00 0.00 H new ATOM 0 HE3 LYS A 500 17.263 -14.973 4.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 16.577 -16.074 6.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 16.458 -14.424 6.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 15.097 -15.429 6.020 1.00 0.00 H new ATOM 827 N TYR A 501 14.204 -10.607 2.360 1.00 0.00 N ATOM 828 CA TYR A 501 15.113 -9.672 1.668 1.00 0.00 C ATOM 829 C TYR A 501 14.601 -8.217 1.779 1.00 0.00 C ATOM 830 O TYR A 501 13.404 -7.955 1.633 1.00 0.00 O ATOM 831 CB TYR A 501 15.246 -10.093 0.177 1.00 0.00 C ATOM 832 CG TYR A 501 16.218 -9.228 -0.641 1.00 0.00 C ATOM 833 CD1 TYR A 501 17.596 -9.357 -0.484 1.00 0.00 C ATOM 834 CD2 TYR A 501 15.757 -8.257 -1.535 1.00 0.00 C ATOM 835 CE1 TYR A 501 18.471 -8.559 -1.186 1.00 0.00 C ATOM 836 CE2 TYR A 501 16.636 -7.452 -2.234 1.00 0.00 C ATOM 837 CZ TYR A 501 17.987 -7.608 -2.056 1.00 0.00 C ATOM 838 OH TYR A 501 18.861 -6.803 -2.745 1.00 0.00 O ATOM 0 H TYR A 501 13.352 -10.808 1.836 1.00 0.00 H new ATOM 0 HA TYR A 501 16.093 -9.714 2.144 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.577 -11.131 0.133 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.261 -10.052 -0.289 1.00 0.00 H new ATOM 0 HD1 TYR A 501 17.985 -10.096 0.201 1.00 0.00 H new ATOM 0 HD2 TYR A 501 14.694 -8.134 -1.682 1.00 0.00 H new ATOM 0 HE1 TYR A 501 19.536 -8.679 -1.054 1.00 0.00 H new ATOM 0 HE2 TYR A 501 16.261 -6.704 -2.917 1.00 0.00 H new ATOM 0 HH TYR A 501 19.743 -7.229 -2.776 1.00 0.00 H new ATOM 848 N ILE A 502 15.522 -7.278 2.051 1.00 0.00 N ATOM 849 CA ILE A 502 15.273 -5.827 1.934 1.00 0.00 C ATOM 850 C ILE A 502 16.229 -5.255 0.875 1.00 0.00 C ATOM 851 O ILE A 502 17.411 -5.616 0.841 1.00 0.00 O ATOM 852 CB ILE A 502 15.481 -5.058 3.301 1.00 0.00 C ATOM 853 CG1 ILE A 502 14.501 -5.585 4.399 1.00 0.00 C ATOM 854 CG2 ILE A 502 15.315 -3.525 3.114 1.00 0.00 C ATOM 855 CD1 ILE A 502 14.652 -4.924 5.769 1.00 0.00 C ATOM 0 H ILE A 502 16.467 -7.503 2.361 1.00 0.00 H new ATOM 0 HA ILE A 502 14.231 -5.686 1.647 1.00 0.00 H new ATOM 0 HB ILE A 502 16.501 -5.251 3.633 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.478 -5.439 4.052 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.649 -6.659 4.512 1.00 0.00 H new ATOM 0 HG21 ILE A 502 15.464 -3.024 4.070 1.00 0.00 H new ATOM 0 HG22 ILE A 502 16.052 -3.164 2.397 1.00 0.00 H new ATOM 0 HG23 ILE A 502 14.313 -3.310 2.744 1.00 0.00 H new ATOM 0 HD11 ILE A 502 13.930 -5.355 6.463 1.00 0.00 H new ATOM 0 HD12 ILE A 502 15.661 -5.092 6.145 1.00 0.00 H new ATOM 0 HD13 ILE A 502 14.472 -3.853 5.678 1.00 0.00 H new ATOM 867 N LEU A 503 15.706 -4.383 0.005 1.00 0.00 N ATOM 868 CA LEU A 503 16.512 -3.636 -0.975 1.00 0.00 C ATOM 869 C LEU A 503 16.733 -2.208 -0.429 1.00 0.00 C ATOM 870 O LEU A 503 15.772 -1.479 -0.178 1.00 0.00 O ATOM 871 CB LEU A 503 15.801 -3.659 -2.368 1.00 0.00 C ATOM 872 CG LEU A 503 16.605 -3.134 -3.615 1.00 0.00 C ATOM 873 CD1 LEU A 503 16.575 -1.605 -3.731 1.00 0.00 C ATOM 874 CD2 LEU A 503 18.061 -3.644 -3.610 1.00 0.00 C ATOM 0 H LEU A 503 14.709 -4.173 -0.041 1.00 0.00 H new ATOM 0 HA LEU A 503 17.490 -4.094 -1.121 1.00 0.00 H new ATOM 0 HB2 LEU A 503 15.500 -4.686 -2.573 1.00 0.00 H new ATOM 0 HB3 LEU A 503 14.888 -3.070 -2.287 1.00 0.00 H new ATOM 0 HG LEU A 503 16.101 -3.540 -4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 503 17.144 -1.295 -4.607 1.00 0.00 H new ATOM 0 HD12 LEU A 503 15.543 -1.268 -3.831 1.00 0.00 H new ATOM 0 HD13 LEU A 503 17.016 -1.164 -2.837 1.00 0.00 H new ATOM 0 HD21 LEU A 503 18.584 -3.261 -4.486 1.00 0.00 H new ATOM 0 HD22 LEU A 503 18.564 -3.299 -2.707 1.00 0.00 H new ATOM 0 HD23 LEU A 503 18.065 -4.734 -3.633 1.00 0.00 H new ATOM 886 N ARG A 504 18.011 -1.824 -0.258 1.00 0.00 N ATOM 887 CA ARG A 504 18.399 -0.569 0.430 1.00 0.00 C ATOM 888 C ARG A 504 18.273 0.670 -0.479 1.00 0.00 C ATOM 889 O ARG A 504 18.244 0.562 -1.710 1.00 0.00 O ATOM 890 CB ARG A 504 19.844 -0.670 1.010 1.00 0.00 C ATOM 891 CG ARG A 504 19.992 -1.515 2.301 1.00 0.00 C ATOM 892 CD ARG A 504 19.702 -3.012 2.113 1.00 0.00 C ATOM 893 NE ARG A 504 19.866 -3.755 3.376 1.00 0.00 N ATOM 894 CZ ARG A 504 19.860 -5.089 3.503 1.00 0.00 C ATOM 895 NH1 ARG A 504 19.632 -5.875 2.459 1.00 0.00 N ATOM 896 NH2 ARG A 504 20.063 -5.629 4.695 1.00 0.00 N ATOM 0 H ARG A 504 18.806 -2.370 -0.590 1.00 0.00 H new ATOM 0 HA ARG A 504 17.696 -0.439 1.253 1.00 0.00 H new ATOM 0 HB2 ARG A 504 20.494 -1.093 0.244 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.205 0.338 1.214 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.006 -1.398 2.683 1.00 0.00 H new ATOM 0 HG3 ARG A 504 19.318 -1.119 3.060 1.00 0.00 H new ATOM 0 HD2 ARG A 504 18.686 -3.143 1.741 1.00 0.00 H new ATOM 0 HD3 ARG A 504 20.373 -3.422 1.358 1.00 0.00 H new ATOM 0 HE ARG A 504 19.995 -3.206 4.226 1.00 0.00 H new ATOM 0 HH11 ARG A 504 19.458 -5.466 1.541 1.00 0.00 H new ATOM 0 HH12 ARG A 504 19.631 -6.888 2.574 1.00 0.00 H new ATOM 0 HH21 ARG A 504 20.222 -5.031 5.506 1.00 0.00 H new ATOM 0 HH22 ARG A 504 20.060 -6.643 4.803 1.00 0.00 H new ATOM 910 N ALA A 505 18.238 1.850 0.172 1.00 0.00 N ATOM 911 CA ALA A 505 18.056 3.150 -0.489 1.00 0.00 C ATOM 912 C ALA A 505 19.321 3.599 -1.240 1.00 0.00 C ATOM 913 O ALA A 505 20.435 3.506 -0.703 1.00 0.00 O ATOM 914 CB ALA A 505 17.650 4.198 0.539 1.00 0.00 C ATOM 0 H ALA A 505 18.337 1.924 1.185 1.00 0.00 H new ATOM 0 HA ALA A 505 17.264 3.039 -1.230 1.00 0.00 H new ATOM 0 HB1 ALA A 505 17.516 5.160 0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 505 16.714 3.900 1.012 1.00 0.00 H new ATOM 0 HB3 ALA A 505 18.428 4.285 1.297 1.00 0.00 H new ATOM 920 N GLY A 506 19.134 4.070 -2.489 1.00 0.00 N ATOM 921 CA GLY A 506 20.240 4.498 -3.354 1.00 0.00 C ATOM 922 C GLY A 506 21.118 3.345 -3.852 1.00 0.00 C ATOM 923 O GLY A 506 22.096 3.574 -4.571 1.00 0.00 O ATOM 0 H GLY A 506 18.214 4.162 -2.921 1.00 0.00 H new ATOM 0 HA2 GLY A 506 19.832 5.029 -4.214 1.00 0.00 H new ATOM 0 HA3 GLY A 506 20.863 5.207 -2.808 1.00 0.00 H new ATOM 927 N GLN A 507 20.762 2.104 -3.467 1.00 0.00 N ATOM 928 CA GLN A 507 21.533 0.893 -3.784 1.00 0.00 C ATOM 929 C GLN A 507 20.876 0.130 -4.942 1.00 0.00 C ATOM 930 O GLN A 507 19.787 0.489 -5.396 1.00 0.00 O ATOM 931 CB GLN A 507 21.651 -0.008 -2.521 1.00 0.00 C ATOM 932 CG GLN A 507 22.379 0.642 -1.322 1.00 0.00 C ATOM 933 CD GLN A 507 23.807 1.097 -1.638 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.756 0.324 -1.512 1.00 0.00 O ATOM 935 NE2 GLN A 507 23.970 2.356 -2.037 1.00 0.00 N ATOM 0 H GLN A 507 19.921 1.916 -2.921 1.00 0.00 H new ATOM 0 HA GLN A 507 22.537 1.182 -4.096 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.649 -0.298 -2.205 1.00 0.00 H new ATOM 0 HB3 GLN A 507 22.177 -0.923 -2.794 1.00 0.00 H new ATOM 0 HG2 GLN A 507 21.801 1.501 -0.980 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.409 -0.070 -0.498 1.00 0.00 H new ATOM 0 HE21 GLN A 507 23.161 2.970 -2.131 1.00 0.00 H new ATOM 0 HE22 GLN A 507 24.904 2.707 -2.249 1.00 0.00 H new ATOM 944 N MET A 508 21.540 -0.936 -5.402 1.00 0.00 N ATOM 945 CA MET A 508 21.110 -1.700 -6.586 1.00 0.00 C ATOM 946 C MET A 508 21.312 -3.214 -6.383 1.00 0.00 C ATOM 947 O MET A 508 22.275 -3.644 -5.734 1.00 0.00 O ATOM 948 CB MET A 508 21.859 -1.182 -7.853 1.00 0.00 C ATOM 949 CG MET A 508 23.380 -1.126 -7.739 1.00 0.00 C ATOM 950 SD MET A 508 24.172 -0.579 -9.274 1.00 0.00 S ATOM 951 CE MET A 508 25.899 -0.517 -8.793 1.00 0.00 C ATOM 0 H MET A 508 22.390 -1.296 -4.967 1.00 0.00 H new ATOM 0 HA MET A 508 20.041 -1.544 -6.732 1.00 0.00 H new ATOM 0 HB2 MET A 508 21.598 -1.823 -8.695 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.492 -0.183 -8.087 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.656 -0.449 -6.931 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.757 -2.113 -7.471 1.00 0.00 H new ATOM 0 HE1 MET A 508 26.502 -0.195 -9.642 1.00 0.00 H new ATOM 0 HE2 MET A 508 26.023 0.189 -7.972 1.00 0.00 H new ATOM 0 HE3 MET A 508 26.223 -1.507 -8.473 1.00 0.00 H new ATOM 961 N VAL A 509 20.374 -4.013 -6.932 1.00 0.00 N ATOM 962 CA VAL A 509 20.420 -5.487 -6.884 1.00 0.00 C ATOM 963 C VAL A 509 20.469 -6.029 -8.316 1.00 0.00 C ATOM 964 O VAL A 509 19.666 -5.642 -9.167 1.00 0.00 O ATOM 965 CB VAL A 509 19.200 -6.110 -6.096 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.828 -5.681 -6.681 1.00 0.00 C ATOM 967 CG2 VAL A 509 19.311 -7.655 -6.014 1.00 0.00 C ATOM 0 H VAL A 509 19.558 -3.650 -7.424 1.00 0.00 H new ATOM 0 HA VAL A 509 21.317 -5.779 -6.339 1.00 0.00 H new ATOM 0 HB VAL A 509 19.250 -5.710 -5.083 1.00 0.00 H new ATOM 0 HG11 VAL A 509 17.026 -6.138 -6.101 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.736 -4.596 -6.635 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.757 -6.007 -7.719 1.00 0.00 H new ATOM 0 HG21 VAL A 509 18.457 -8.053 -5.466 1.00 0.00 H new ATOM 0 HG22 VAL A 509 19.323 -8.073 -7.021 1.00 0.00 H new ATOM 0 HG23 VAL A 509 20.232 -7.927 -5.498 1.00 0.00 H new ATOM 977 N THR A 510 21.431 -6.910 -8.583 1.00 0.00 N ATOM 978 CA THR A 510 21.616 -7.512 -9.900 1.00 0.00 C ATOM 979 C THR A 510 21.078 -8.951 -9.849 1.00 0.00 C ATOM 980 O THR A 510 21.693 -9.832 -9.238 1.00 0.00 O ATOM 981 CB THR A 510 23.132 -7.465 -10.310 1.00 0.00 C ATOM 982 OG1 THR A 510 23.727 -6.266 -9.788 1.00 0.00 O ATOM 983 CG2 THR A 510 23.319 -7.473 -11.837 1.00 0.00 C ATOM 0 H THR A 510 22.107 -7.227 -7.888 1.00 0.00 H new ATOM 0 HA THR A 510 21.066 -6.956 -10.659 1.00 0.00 H new ATOM 0 HB THR A 510 23.610 -8.355 -9.900 1.00 0.00 H new ATOM 0 HG1 THR A 510 24.673 -6.234 -10.041 1.00 0.00 H new ATOM 0 HG21 THR A 510 24.383 -7.440 -12.074 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.883 -8.382 -12.252 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.824 -6.603 -12.269 1.00 0.00 H new ATOM 991 N VAL A 511 19.883 -9.160 -10.418 1.00 0.00 N ATOM 992 CA VAL A 511 19.205 -10.462 -10.389 1.00 0.00 C ATOM 993 C VAL A 511 19.663 -11.327 -11.582 1.00 0.00 C ATOM 994 O VAL A 511 19.157 -11.186 -12.695 1.00 0.00 O ATOM 995 CB VAL A 511 17.641 -10.293 -10.373 1.00 0.00 C ATOM 996 CG1 VAL A 511 16.923 -11.665 -10.294 1.00 0.00 C ATOM 997 CG2 VAL A 511 17.198 -9.361 -9.212 1.00 0.00 C ATOM 0 H VAL A 511 19.361 -8.434 -10.909 1.00 0.00 H new ATOM 0 HA VAL A 511 19.483 -10.973 -9.467 1.00 0.00 H new ATOM 0 HB VAL A 511 17.348 -9.825 -11.313 1.00 0.00 H new ATOM 0 HG11 VAL A 511 15.844 -11.511 -10.285 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.196 -12.269 -11.159 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.224 -12.181 -9.382 1.00 0.00 H new ATOM 0 HG21 VAL A 511 16.113 -9.259 -9.221 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.514 -9.789 -8.261 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.656 -8.380 -9.338 1.00 0.00 H new ATOM 1007 N TRP A 512 20.627 -12.226 -11.319 1.00 0.00 N ATOM 1008 CA TRP A 512 21.260 -13.079 -12.347 1.00 0.00 C ATOM 1009 C TRP A 512 20.526 -14.425 -12.513 1.00 0.00 C ATOM 1010 O TRP A 512 19.575 -14.724 -11.785 1.00 0.00 O ATOM 1011 CB TRP A 512 22.747 -13.340 -11.985 1.00 0.00 C ATOM 1012 CG TRP A 512 23.705 -12.193 -12.236 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.847 -11.056 -11.499 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.674 -12.096 -13.295 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.854 -10.282 -12.011 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.369 -10.892 -13.114 1.00 0.00 C ATOM 1017 CE3 TRP A 512 25.024 -12.917 -14.369 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.381 -10.480 -13.968 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.037 -12.513 -15.217 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.711 -11.303 -15.009 1.00 0.00 C ATOM 0 H TRP A 512 20.994 -12.384 -10.380 1.00 0.00 H new ATOM 0 HA TRP A 512 21.198 -12.544 -13.294 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.801 -13.608 -10.930 1.00 0.00 H new ATOM 0 HB3 TRP A 512 23.091 -14.205 -12.552 1.00 0.00 H new ATOM 0 HD1 TRP A 512 23.251 -10.802 -10.635 1.00 0.00 H new ATOM 0 HE1 TRP A 512 25.168 -9.391 -11.627 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.511 -13.853 -14.534 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.891 -9.540 -13.816 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.313 -13.139 -16.052 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.505 -11.015 -15.682 1.00 0.00 H new ATOM 1031 N ALA A 513 20.990 -15.218 -13.502 1.00 0.00 N ATOM 1032 CA ALA A 513 20.511 -16.591 -13.764 1.00 0.00 C ATOM 1033 C ALA A 513 21.540 -17.621 -13.262 1.00 0.00 C ATOM 1034 O ALA A 513 22.738 -17.330 -13.204 1.00 0.00 O ATOM 1035 CB ALA A 513 20.252 -16.781 -15.268 1.00 0.00 C ATOM 0 H ALA A 513 21.718 -14.918 -14.150 1.00 0.00 H new ATOM 0 HA ALA A 513 19.576 -16.746 -13.225 1.00 0.00 H new ATOM 0 HB1 ALA A 513 19.899 -17.796 -15.451 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.496 -16.069 -15.600 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.176 -16.613 -15.820 1.00 0.00 H new ATOM 1041 N ALA A 514 21.058 -18.828 -12.907 1.00 0.00 N ATOM 1042 CA ALA A 514 21.915 -19.944 -12.436 1.00 0.00 C ATOM 1043 C ALA A 514 22.895 -20.416 -13.528 1.00 0.00 C ATOM 1044 O ALA A 514 24.062 -20.718 -13.250 1.00 0.00 O ATOM 1045 CB ALA A 514 21.036 -21.111 -11.968 1.00 0.00 C ATOM 0 H ALA A 514 20.065 -19.061 -12.937 1.00 0.00 H new ATOM 0 HA ALA A 514 22.512 -19.579 -11.600 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.670 -21.928 -11.623 1.00 0.00 H new ATOM 0 HB2 ALA A 514 20.395 -20.779 -11.151 1.00 0.00 H new ATOM 0 HB3 ALA A 514 20.418 -21.456 -12.797 1.00 0.00 H new ATOM 1051 N GLY A 515 22.397 -20.446 -14.774 1.00 0.00 N ATOM 1052 CA GLY A 515 23.188 -20.883 -15.931 1.00 0.00 C ATOM 1053 C GLY A 515 24.080 -19.785 -16.503 1.00 0.00 C ATOM 1054 O GLY A 515 24.813 -20.022 -17.468 1.00 0.00 O ATOM 0 H GLY A 515 21.443 -20.170 -15.005 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.809 -21.730 -15.639 1.00 0.00 H new ATOM 0 HA3 GLY A 515 22.513 -21.236 -16.711 1.00 0.00 H new ATOM 1058 N ALA A 516 24.022 -18.583 -15.901 1.00 0.00 N ATOM 1059 CA ALA A 516 24.847 -17.428 -16.310 1.00 0.00 C ATOM 1060 C ALA A 516 26.261 -17.483 -15.677 1.00 0.00 C ATOM 1061 O ALA A 516 27.037 -16.527 -15.806 1.00 0.00 O ATOM 1062 CB ALA A 516 24.121 -16.123 -15.942 1.00 0.00 C ATOM 0 H ALA A 516 23.402 -18.384 -15.116 1.00 0.00 H new ATOM 0 HA ALA A 516 24.985 -17.464 -17.391 1.00 0.00 H new ATOM 0 HB1 ALA A 516 24.730 -15.271 -16.244 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.161 -16.083 -16.456 1.00 0.00 H new ATOM 0 HB3 ALA A 516 23.957 -16.089 -14.865 1.00 0.00 H new ATOM 1068 N GLY A 517 26.583 -18.607 -14.991 1.00 0.00 N ATOM 1069 CA GLY A 517 27.936 -18.862 -14.477 1.00 0.00 C ATOM 1070 C GLY A 517 28.269 -18.070 -13.215 1.00 0.00 C ATOM 1071 O GLY A 517 29.402 -17.597 -13.044 1.00 0.00 O ATOM 0 H GLY A 517 25.915 -19.350 -14.784 1.00 0.00 H new ATOM 0 HA2 GLY A 517 28.041 -19.926 -14.266 1.00 0.00 H new ATOM 0 HA3 GLY A 517 28.662 -18.617 -15.252 1.00 0.00 H new ATOM 1075 N VAL A 518 27.271 -17.937 -12.329 1.00 0.00 N ATOM 1076 CA VAL A 518 27.335 -17.051 -11.150 1.00 0.00 C ATOM 1077 C VAL A 518 26.547 -17.663 -9.964 1.00 0.00 C ATOM 1078 O VAL A 518 25.454 -18.216 -10.151 1.00 0.00 O ATOM 1079 CB VAL A 518 26.783 -15.625 -11.537 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.374 -15.733 -12.161 1.00 0.00 C ATOM 1081 CG2 VAL A 518 26.795 -14.631 -10.343 1.00 0.00 C ATOM 0 H VAL A 518 26.389 -18.443 -12.408 1.00 0.00 H new ATOM 0 HA VAL A 518 28.372 -16.946 -10.830 1.00 0.00 H new ATOM 0 HB VAL A 518 27.462 -15.215 -12.284 1.00 0.00 H new ATOM 0 HG11 VAL A 518 25.013 -14.737 -12.420 1.00 0.00 H new ATOM 0 HG12 VAL A 518 25.420 -16.347 -13.060 1.00 0.00 H new ATOM 0 HG13 VAL A 518 24.693 -16.190 -11.444 1.00 0.00 H new ATOM 0 HG21 VAL A 518 26.405 -13.667 -10.668 1.00 0.00 H new ATOM 0 HG22 VAL A 518 26.172 -15.022 -9.538 1.00 0.00 H new ATOM 0 HG23 VAL A 518 27.816 -14.506 -9.984 1.00 0.00 H new ATOM 1091 N ALA A 519 27.136 -17.580 -8.750 1.00 0.00 N ATOM 1092 CA ALA A 519 26.533 -18.088 -7.500 1.00 0.00 C ATOM 1093 C ALA A 519 25.703 -16.996 -6.800 1.00 0.00 C ATOM 1094 O ALA A 519 26.000 -15.799 -6.935 1.00 0.00 O ATOM 1095 CB ALA A 519 27.638 -18.599 -6.561 1.00 0.00 C ATOM 0 H ALA A 519 28.052 -17.154 -8.611 1.00 0.00 H new ATOM 0 HA ALA A 519 25.862 -18.910 -7.750 1.00 0.00 H new ATOM 0 HB1 ALA A 519 27.189 -18.973 -5.641 1.00 0.00 H new ATOM 0 HB2 ALA A 519 28.187 -19.404 -7.050 1.00 0.00 H new ATOM 0 HB3 ALA A 519 28.322 -17.783 -6.326 1.00 0.00 H new ATOM 1101 N HIS A 520 24.667 -17.420 -6.043 1.00 0.00 N ATOM 1102 CA HIS A 520 23.789 -16.497 -5.297 1.00 0.00 C ATOM 1103 C HIS A 520 24.587 -15.820 -4.170 1.00 0.00 C ATOM 1104 O HIS A 520 25.021 -16.484 -3.216 1.00 0.00 O ATOM 1105 CB HIS A 520 22.551 -17.254 -4.735 1.00 0.00 C ATOM 1106 CG HIS A 520 21.559 -16.386 -3.978 1.00 0.00 C ATOM 1107 ND1 HIS A 520 20.864 -16.795 -2.860 1.00 0.00 N ATOM 1108 CD2 HIS A 520 21.155 -15.110 -4.207 1.00 0.00 C ATOM 1109 CE1 HIS A 520 20.085 -15.783 -2.459 1.00 0.00 C ATOM 1110 NE2 HIS A 520 20.223 -14.737 -3.244 1.00 0.00 N ATOM 0 H HIS A 520 24.419 -18.403 -5.934 1.00 0.00 H new ATOM 0 HA HIS A 520 23.423 -15.725 -5.974 1.00 0.00 H new ATOM 0 HB2 HIS A 520 22.032 -17.736 -5.563 1.00 0.00 H new ATOM 0 HB3 HIS A 520 22.898 -18.046 -4.072 1.00 0.00 H new ATOM 0 HD1 HIS A 520 20.932 -17.710 -2.415 1.00 0.00 H new ATOM 0 HD2 HIS A 520 21.504 -14.481 -5.013 1.00 0.00 H new ATOM 0 HE1 HIS A 520 19.429 -15.821 -1.602 1.00 0.00 H new ATOM 1118 N SER A 521 24.797 -14.500 -4.311 1.00 0.00 N ATOM 1119 CA SER A 521 25.587 -13.695 -3.368 1.00 0.00 C ATOM 1120 C SER A 521 24.806 -12.408 -2.989 1.00 0.00 C ATOM 1121 O SER A 521 25.042 -11.335 -3.564 1.00 0.00 O ATOM 1122 CB SER A 521 26.966 -13.371 -3.993 1.00 0.00 C ATOM 1123 OG SER A 521 27.653 -14.562 -4.363 1.00 0.00 O ATOM 0 H SER A 521 24.420 -13.959 -5.089 1.00 0.00 H new ATOM 0 HA SER A 521 25.759 -14.257 -2.450 1.00 0.00 H new ATOM 0 HB2 SER A 521 26.832 -12.738 -4.870 1.00 0.00 H new ATOM 0 HB3 SER A 521 27.568 -12.806 -3.281 1.00 0.00 H new ATOM 0 HG SER A 521 27.192 -14.985 -5.117 1.00 0.00 H new ATOM 1129 N PRO A 522 23.809 -12.512 -2.052 1.00 0.00 N ATOM 1130 CA PRO A 522 22.991 -11.354 -1.621 1.00 0.00 C ATOM 1131 C PRO A 522 23.808 -10.364 -0.735 1.00 0.00 C ATOM 1132 O PRO A 522 24.802 -10.771 -0.112 1.00 0.00 O ATOM 1133 CB PRO A 522 21.822 -12.022 -0.845 1.00 0.00 C ATOM 1134 CG PRO A 522 22.404 -13.292 -0.304 1.00 0.00 C ATOM 1135 CD PRO A 522 23.397 -13.766 -1.345 1.00 0.00 C ATOM 0 HA PRO A 522 22.645 -10.738 -2.451 1.00 0.00 H new ATOM 0 HB2 PRO A 522 21.460 -11.379 -0.043 1.00 0.00 H new ATOM 0 HB3 PRO A 522 20.974 -12.222 -1.500 1.00 0.00 H new ATOM 0 HG2 PRO A 522 22.894 -13.121 0.655 1.00 0.00 H new ATOM 0 HG3 PRO A 522 21.627 -14.038 -0.136 1.00 0.00 H new ATOM 0 HD2 PRO A 522 24.251 -14.263 -0.885 1.00 0.00 H new ATOM 0 HD3 PRO A 522 22.944 -14.481 -2.032 1.00 0.00 H new ATOM 1143 N PRO A 523 23.420 -9.042 -0.646 1.00 0.00 N ATOM 1144 CA PRO A 523 22.225 -8.454 -1.295 1.00 0.00 C ATOM 1145 C PRO A 523 22.520 -7.829 -2.682 1.00 0.00 C ATOM 1146 O PRO A 523 21.626 -7.261 -3.315 1.00 0.00 O ATOM 1147 CB PRO A 523 21.806 -7.386 -0.250 1.00 0.00 C ATOM 1148 CG PRO A 523 23.094 -6.920 0.388 1.00 0.00 C ATOM 1149 CD PRO A 523 24.149 -7.997 0.127 1.00 0.00 C ATOM 0 HA PRO A 523 21.455 -9.190 -1.524 1.00 0.00 H new ATOM 0 HB2 PRO A 523 21.281 -6.557 -0.725 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.130 -7.808 0.493 1.00 0.00 H new ATOM 0 HG2 PRO A 523 23.408 -5.965 -0.034 1.00 0.00 H new ATOM 0 HG3 PRO A 523 22.959 -6.767 1.459 1.00 0.00 H new ATOM 0 HD2 PRO A 523 24.993 -7.600 -0.437 1.00 0.00 H new ATOM 0 HD3 PRO A 523 24.549 -8.397 1.059 1.00 0.00 H new ATOM 1157 N SER A 524 23.766 -7.979 -3.147 1.00 0.00 N ATOM 1158 CA SER A 524 24.259 -7.339 -4.378 1.00 0.00 C ATOM 1159 C SER A 524 23.870 -8.148 -5.634 1.00 0.00 C ATOM 1160 O SER A 524 23.682 -7.580 -6.717 1.00 0.00 O ATOM 1161 CB SER A 524 25.796 -7.199 -4.279 1.00 0.00 C ATOM 1162 OG SER A 524 26.167 -6.579 -3.053 1.00 0.00 O ATOM 0 H SER A 524 24.468 -8.552 -2.678 1.00 0.00 H new ATOM 0 HA SER A 524 23.798 -6.356 -4.476 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.261 -8.182 -4.350 1.00 0.00 H new ATOM 0 HB3 SER A 524 26.167 -6.609 -5.117 1.00 0.00 H new ATOM 0 HG SER A 524 27.143 -6.501 -3.008 1.00 0.00 H new ATOM 1168 N THR A 525 23.755 -9.477 -5.474 1.00 0.00 N ATOM 1169 CA THR A 525 23.512 -10.408 -6.587 1.00 0.00 C ATOM 1170 C THR A 525 22.533 -11.513 -6.165 1.00 0.00 C ATOM 1171 O THR A 525 22.901 -12.447 -5.437 1.00 0.00 O ATOM 1172 CB THR A 525 24.871 -11.021 -7.086 1.00 0.00 C ATOM 1173 OG1 THR A 525 25.708 -9.969 -7.589 1.00 0.00 O ATOM 1174 CG2 THR A 525 24.689 -12.094 -8.177 1.00 0.00 C ATOM 0 H THR A 525 23.828 -9.936 -4.566 1.00 0.00 H new ATOM 0 HA THR A 525 23.059 -9.857 -7.412 1.00 0.00 H new ATOM 0 HB THR A 525 25.332 -11.514 -6.230 1.00 0.00 H new ATOM 0 HG1 THR A 525 26.557 -10.347 -7.900 1.00 0.00 H new ATOM 0 HG21 THR A 525 25.664 -12.476 -8.478 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.083 -12.912 -7.786 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.190 -11.654 -9.040 1.00 0.00 H new ATOM 1182 N LEU A 526 21.266 -11.390 -6.602 1.00 0.00 N ATOM 1183 CA LEU A 526 20.245 -12.424 -6.366 1.00 0.00 C ATOM 1184 C LEU A 526 20.140 -13.306 -7.615 1.00 0.00 C ATOM 1185 O LEU A 526 19.557 -12.916 -8.613 1.00 0.00 O ATOM 1186 CB LEU A 526 18.869 -11.787 -5.974 1.00 0.00 C ATOM 1187 CG LEU A 526 18.653 -11.507 -4.447 1.00 0.00 C ATOM 1188 CD1 LEU A 526 19.776 -10.632 -3.842 1.00 0.00 C ATOM 1189 CD2 LEU A 526 17.259 -10.890 -4.190 1.00 0.00 C ATOM 0 H LEU A 526 20.925 -10.581 -7.122 1.00 0.00 H new ATOM 0 HA LEU A 526 20.541 -13.046 -5.521 1.00 0.00 H new ATOM 0 HB2 LEU A 526 18.759 -10.847 -6.515 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.074 -12.448 -6.318 1.00 0.00 H new ATOM 0 HG LEU A 526 18.699 -12.469 -3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 526 19.579 -10.468 -2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 526 20.734 -11.138 -3.958 1.00 0.00 H new ATOM 0 HD13 LEU A 526 19.808 -9.672 -4.358 1.00 0.00 H new ATOM 0 HD21 LEU A 526 17.134 -10.705 -3.123 1.00 0.00 H new ATOM 0 HD22 LEU A 526 17.172 -9.949 -4.734 1.00 0.00 H new ATOM 0 HD23 LEU A 526 16.487 -11.580 -4.532 1.00 0.00 H new ATOM 1201 N VAL A 527 20.713 -14.510 -7.541 1.00 0.00 N ATOM 1202 CA VAL A 527 20.688 -15.480 -8.641 1.00 0.00 C ATOM 1203 C VAL A 527 19.437 -16.358 -8.513 1.00 0.00 C ATOM 1204 O VAL A 527 19.223 -16.987 -7.463 1.00 0.00 O ATOM 1205 CB VAL A 527 21.992 -16.361 -8.635 1.00 0.00 C ATOM 1206 CG1 VAL A 527 21.928 -17.528 -9.647 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.238 -15.486 -8.892 1.00 0.00 C ATOM 0 H VAL A 527 21.209 -14.842 -6.714 1.00 0.00 H new ATOM 0 HA VAL A 527 20.654 -14.946 -9.591 1.00 0.00 H new ATOM 0 HB VAL A 527 22.068 -16.808 -7.644 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.854 -18.102 -9.600 1.00 0.00 H new ATOM 0 HG12 VAL A 527 21.086 -18.176 -9.402 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.799 -17.130 -10.654 1.00 0.00 H new ATOM 0 HG21 VAL A 527 24.130 -16.112 -8.884 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.146 -14.998 -9.862 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.319 -14.730 -8.111 1.00 0.00 H new ATOM 1217 N TRP A 528 18.596 -16.359 -9.566 1.00 0.00 N ATOM 1218 CA TRP A 528 17.458 -17.274 -9.675 1.00 0.00 C ATOM 1219 C TRP A 528 18.012 -18.690 -9.934 1.00 0.00 C ATOM 1220 O TRP A 528 18.218 -19.104 -11.085 1.00 0.00 O ATOM 1221 CB TRP A 528 16.468 -16.815 -10.791 1.00 0.00 C ATOM 1222 CG TRP A 528 15.093 -17.485 -10.754 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.662 -18.492 -9.917 1.00 0.00 C ATOM 1224 CD2 TRP A 528 13.968 -17.168 -11.591 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.357 -18.808 -10.189 1.00 0.00 N ATOM 1226 CE2 TRP A 528 12.906 -18.014 -11.208 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.754 -16.246 -12.619 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.655 -17.961 -11.817 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 12.518 -16.203 -13.230 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.480 -17.054 -12.826 1.00 0.00 C ATOM 0 H TRP A 528 18.692 -15.725 -10.359 1.00 0.00 H new ATOM 0 HA TRP A 528 16.883 -17.275 -8.749 1.00 0.00 H new ATOM 0 HB2 TRP A 528 16.332 -15.736 -10.713 1.00 0.00 H new ATOM 0 HB3 TRP A 528 16.924 -17.009 -11.762 1.00 0.00 H new ATOM 0 HD1 TRP A 528 15.266 -18.964 -9.156 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.809 -19.521 -9.708 1.00 0.00 H new ATOM 0 HE3 TRP A 528 14.543 -15.578 -12.930 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 10.852 -18.612 -11.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.347 -15.502 -14.033 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.522 -16.992 -13.322 1.00 0.00 H new ATOM 1241 N LYS A 529 18.316 -19.379 -8.822 1.00 0.00 N ATOM 1242 CA LYS A 529 18.895 -20.724 -8.823 1.00 0.00 C ATOM 1243 C LYS A 529 17.845 -21.713 -9.361 1.00 0.00 C ATOM 1244 O LYS A 529 16.772 -21.860 -8.766 1.00 0.00 O ATOM 1245 CB LYS A 529 19.342 -21.084 -7.371 1.00 0.00 C ATOM 1246 CG LYS A 529 20.408 -22.201 -7.249 1.00 0.00 C ATOM 1247 CD LYS A 529 21.809 -21.747 -7.743 1.00 0.00 C ATOM 1248 CE LYS A 529 22.911 -22.790 -7.456 1.00 0.00 C ATOM 1249 NZ LYS A 529 22.685 -24.072 -8.176 1.00 0.00 N ATOM 0 H LYS A 529 18.162 -19.008 -7.885 1.00 0.00 H new ATOM 0 HA LYS A 529 19.772 -20.774 -9.468 1.00 0.00 H new ATOM 0 HB2 LYS A 529 19.732 -20.183 -6.898 1.00 0.00 H new ATOM 0 HB3 LYS A 529 18.461 -21.386 -6.805 1.00 0.00 H new ATOM 0 HG2 LYS A 529 20.479 -22.518 -6.209 1.00 0.00 H new ATOM 0 HG3 LYS A 529 20.087 -23.069 -7.826 1.00 0.00 H new ATOM 0 HD2 LYS A 529 21.767 -21.555 -8.815 1.00 0.00 H new ATOM 0 HD3 LYS A 529 22.072 -20.805 -7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 529 23.879 -22.380 -7.746 1.00 0.00 H new ATOM 0 HE3 LYS A 529 22.954 -22.982 -6.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 23.452 -24.737 -7.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 21.775 -24.480 -7.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 22.670 -23.897 -9.201 1.00 0.00 H new ATOM 1263 N GLY A 530 18.147 -22.344 -10.505 1.00 0.00 N ATOM 1264 CA GLY A 530 17.199 -23.190 -11.229 1.00 0.00 C ATOM 1265 C GLY A 530 16.959 -22.681 -12.649 1.00 0.00 C ATOM 1266 O GLY A 530 16.964 -23.466 -13.603 1.00 0.00 O ATOM 0 H GLY A 530 19.061 -22.279 -10.953 1.00 0.00 H new ATOM 0 HA2 GLY A 530 17.578 -24.211 -11.268 1.00 0.00 H new ATOM 0 HA3 GLY A 530 16.253 -23.221 -10.689 1.00 0.00 H new ATOM 1270 N GLN A 531 16.753 -21.355 -12.791 1.00 0.00 N ATOM 1271 CA GLN A 531 16.561 -20.716 -14.113 1.00 0.00 C ATOM 1272 C GLN A 531 17.937 -20.491 -14.765 1.00 0.00 C ATOM 1273 O GLN A 531 18.691 -19.611 -14.353 1.00 0.00 O ATOM 1274 CB GLN A 531 15.743 -19.378 -13.995 1.00 0.00 C ATOM 1275 CG GLN A 531 14.328 -19.422 -14.637 1.00 0.00 C ATOM 1276 CD GLN A 531 14.315 -19.428 -16.176 1.00 0.00 C ATOM 1277 OE1 GLN A 531 15.241 -19.909 -16.838 1.00 0.00 O ATOM 1278 NE2 GLN A 531 13.251 -18.896 -16.762 1.00 0.00 N ATOM 0 H GLN A 531 16.715 -20.704 -12.007 1.00 0.00 H new ATOM 0 HA GLN A 531 15.972 -21.377 -14.749 1.00 0.00 H new ATOM 0 HB2 GLN A 531 15.641 -19.123 -12.940 1.00 0.00 H new ATOM 0 HB3 GLN A 531 16.314 -18.576 -14.463 1.00 0.00 H new ATOM 0 HG2 GLN A 531 13.811 -20.313 -14.280 1.00 0.00 H new ATOM 0 HG3 GLN A 531 13.759 -18.561 -14.287 1.00 0.00 H new ATOM 0 HE21 GLN A 531 12.499 -18.505 -16.195 1.00 0.00 H new ATOM 0 HE22 GLN A 531 13.185 -18.878 -17.780 1.00 0.00 H new ATOM 1287 N SER A 532 18.246 -21.319 -15.771 1.00 0.00 N ATOM 1288 CA SER A 532 19.536 -21.303 -16.463 1.00 0.00 C ATOM 1289 C SER A 532 19.670 -20.061 -17.366 1.00 0.00 C ATOM 1290 O SER A 532 20.689 -19.369 -17.343 1.00 0.00 O ATOM 1291 CB SER A 532 19.684 -22.602 -17.285 1.00 0.00 C ATOM 1292 OG SER A 532 18.561 -22.794 -18.130 1.00 0.00 O ATOM 0 H SER A 532 17.601 -22.024 -16.129 1.00 0.00 H new ATOM 0 HA SER A 532 20.336 -21.250 -15.724 1.00 0.00 H new ATOM 0 HB2 SER A 532 20.593 -22.556 -17.885 1.00 0.00 H new ATOM 0 HB3 SER A 532 19.789 -23.453 -16.612 1.00 0.00 H new ATOM 0 HG SER A 532 18.675 -23.621 -18.643 1.00 0.00 H new ATOM 1298 N SER A 533 18.619 -19.794 -18.151 1.00 0.00 N ATOM 1299 CA SER A 533 18.615 -18.727 -19.173 1.00 0.00 C ATOM 1300 C SER A 533 17.915 -17.443 -18.676 1.00 0.00 C ATOM 1301 O SER A 533 18.052 -16.393 -19.306 1.00 0.00 O ATOM 1302 CB SER A 533 17.916 -19.260 -20.444 1.00 0.00 C ATOM 1303 OG SER A 533 18.592 -20.405 -20.953 1.00 0.00 O ATOM 0 H SER A 533 17.741 -20.311 -18.099 1.00 0.00 H new ATOM 0 HA SER A 533 19.648 -18.457 -19.392 1.00 0.00 H new ATOM 0 HB2 SER A 533 16.881 -19.515 -20.215 1.00 0.00 H new ATOM 0 HB3 SER A 533 17.891 -18.480 -21.205 1.00 0.00 H new ATOM 0 HG SER A 533 18.132 -20.727 -21.756 1.00 0.00 H new ATOM 1309 N TRP A 534 17.163 -17.554 -17.554 1.00 0.00 N ATOM 1310 CA TRP A 534 16.266 -16.477 -17.039 1.00 0.00 C ATOM 1311 C TRP A 534 15.160 -16.170 -18.093 1.00 0.00 C ATOM 1312 O TRP A 534 14.570 -15.095 -18.080 1.00 0.00 O ATOM 1313 CB TRP A 534 17.069 -15.171 -16.636 1.00 0.00 C ATOM 1314 CG TRP A 534 16.693 -14.541 -15.291 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.358 -14.706 -14.110 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.591 -13.657 -14.989 1.00 0.00 C ATOM 1317 NE1 TRP A 534 16.767 -13.981 -13.115 1.00 0.00 N ATOM 1318 CE2 TRP A 534 15.678 -13.334 -13.623 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.551 -13.102 -15.730 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 14.763 -12.495 -12.990 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.642 -12.270 -15.104 1.00 0.00 C ATOM 1322 CH2 TRP A 534 13.756 -11.970 -13.745 1.00 0.00 C ATOM 0 H TRP A 534 17.158 -18.394 -16.975 1.00 0.00 H new ATOM 0 HA TRP A 534 15.792 -16.834 -16.125 1.00 0.00 H new ATOM 0 HB2 TRP A 534 18.132 -15.413 -16.617 1.00 0.00 H new ATOM 0 HB3 TRP A 534 16.926 -14.425 -17.417 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.233 -15.326 -13.980 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.088 -13.931 -12.148 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.456 -13.319 -16.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 14.848 -12.268 -11.938 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 12.830 -11.845 -15.675 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.035 -11.311 -13.284 1.00 0.00 H new ATOM 1333 N GLY A 535 14.870 -17.158 -18.970 1.00 0.00 N ATOM 1334 CA GLY A 535 13.907 -16.989 -20.063 1.00 0.00 C ATOM 1335 C GLY A 535 14.404 -16.025 -21.146 1.00 0.00 C ATOM 1336 O GLY A 535 13.816 -14.959 -21.350 1.00 0.00 O ATOM 0 H GLY A 535 15.297 -18.084 -18.934 1.00 0.00 H new ATOM 0 HA2 GLY A 535 13.701 -17.960 -20.513 1.00 0.00 H new ATOM 0 HA3 GLY A 535 12.965 -16.619 -19.658 1.00 0.00 H new ATOM 1340 N THR A 536 15.490 -16.421 -21.844 1.00 0.00 N ATOM 1341 CA THR A 536 16.153 -15.601 -22.896 1.00 0.00 C ATOM 1342 C THR A 536 15.217 -15.234 -24.082 1.00 0.00 C ATOM 1343 O THR A 536 14.127 -15.801 -24.249 1.00 0.00 O ATOM 1344 CB THR A 536 17.430 -16.334 -23.451 1.00 0.00 C ATOM 1345 OG1 THR A 536 17.128 -17.723 -23.685 1.00 0.00 O ATOM 1346 CG2 THR A 536 18.648 -16.212 -22.510 1.00 0.00 C ATOM 0 H THR A 536 15.939 -17.325 -21.697 1.00 0.00 H new ATOM 0 HA THR A 536 16.435 -14.668 -22.407 1.00 0.00 H new ATOM 0 HB THR A 536 17.702 -15.844 -24.386 1.00 0.00 H new ATOM 0 HG1 THR A 536 17.924 -18.177 -24.032 1.00 0.00 H new ATOM 0 HG21 THR A 536 19.498 -16.737 -22.945 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.901 -15.160 -22.376 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.406 -16.653 -21.543 1.00 0.00 H new ATOM 1354 N GLY A 537 15.680 -14.269 -24.891 1.00 0.00 N ATOM 1355 CA GLY A 537 14.984 -13.851 -26.103 1.00 0.00 C ATOM 1356 C GLY A 537 15.694 -12.707 -26.801 1.00 0.00 C ATOM 1357 O GLY A 537 16.510 -12.012 -26.179 1.00 0.00 O ATOM 0 H GLY A 537 16.547 -13.761 -24.718 1.00 0.00 H new ATOM 0 HA2 GLY A 537 14.904 -14.698 -26.785 1.00 0.00 H new ATOM 0 HA3 GLY A 537 13.968 -13.547 -25.851 1.00 0.00 H new ATOM 1361 N GLU A 538 15.400 -12.511 -28.100 1.00 0.00 N ATOM 1362 CA GLU A 538 15.958 -11.387 -28.879 1.00 0.00 C ATOM 1363 C GLU A 538 15.202 -10.081 -28.556 1.00 0.00 C ATOM 1364 O GLU A 538 15.762 -9.007 -28.697 1.00 0.00 O ATOM 1365 CB GLU A 538 15.944 -11.683 -30.404 1.00 0.00 C ATOM 1366 CG GLU A 538 16.570 -10.578 -31.290 1.00 0.00 C ATOM 1367 CD GLU A 538 16.593 -10.936 -32.791 1.00 0.00 C ATOM 1368 OE1 GLU A 538 15.526 -10.879 -33.443 1.00 0.00 O ATOM 1369 OE2 GLU A 538 17.675 -11.268 -33.330 1.00 0.00 O ATOM 0 H GLU A 538 14.778 -13.118 -28.634 1.00 0.00 H new ATOM 0 HA GLU A 538 17.001 -11.262 -28.588 1.00 0.00 H new ATOM 0 HB2 GLU A 538 16.477 -12.617 -30.583 1.00 0.00 H new ATOM 0 HB3 GLU A 538 14.912 -11.840 -30.719 1.00 0.00 H new ATOM 0 HG2 GLU A 538 16.011 -9.653 -31.153 1.00 0.00 H new ATOM 0 HG3 GLU A 538 17.589 -10.387 -30.954 1.00 0.00 H new ATOM 1376 N SER A 539 13.920 -10.171 -28.145 1.00 0.00 N ATOM 1377 CA SER A 539 13.183 -9.017 -27.575 1.00 0.00 C ATOM 1378 C SER A 539 12.207 -9.514 -26.485 1.00 0.00 C ATOM 1379 O SER A 539 11.443 -10.465 -26.715 1.00 0.00 O ATOM 1380 CB SER A 539 12.419 -8.196 -28.668 1.00 0.00 C ATOM 1381 OG SER A 539 13.193 -8.027 -29.847 1.00 0.00 O ATOM 0 H SER A 539 13.371 -11.029 -28.196 1.00 0.00 H new ATOM 0 HA SER A 539 13.914 -8.341 -27.132 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.487 -8.703 -28.916 1.00 0.00 H new ATOM 0 HB3 SER A 539 12.153 -7.218 -28.266 1.00 0.00 H new ATOM 0 HG SER A 539 12.680 -7.511 -30.504 1.00 0.00 H new ATOM 1387 N PHE A 540 12.263 -8.875 -25.296 1.00 0.00 N ATOM 1388 CA PHE A 540 11.414 -9.218 -24.137 1.00 0.00 C ATOM 1389 C PHE A 540 11.140 -7.976 -23.271 1.00 0.00 C ATOM 1390 O PHE A 540 12.039 -7.179 -23.018 1.00 0.00 O ATOM 1391 CB PHE A 540 12.057 -10.356 -23.282 1.00 0.00 C ATOM 1392 CG PHE A 540 13.499 -10.120 -22.829 1.00 0.00 C ATOM 1393 CD1 PHE A 540 14.571 -10.533 -23.622 1.00 0.00 C ATOM 1394 CD2 PHE A 540 13.786 -9.497 -21.615 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.874 -10.328 -23.218 1.00 0.00 C ATOM 1396 CE2 PHE A 540 15.091 -9.293 -21.212 1.00 0.00 C ATOM 1397 CZ PHE A 540 16.136 -9.706 -22.014 1.00 0.00 C ATOM 0 H PHE A 540 12.903 -8.102 -25.114 1.00 0.00 H new ATOM 0 HA PHE A 540 10.462 -9.584 -24.521 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.440 -10.512 -22.397 1.00 0.00 H new ATOM 0 HB3 PHE A 540 12.025 -11.280 -23.860 1.00 0.00 H new ATOM 0 HD1 PHE A 540 14.377 -11.020 -24.566 1.00 0.00 H new ATOM 0 HD2 PHE A 540 12.976 -9.169 -20.981 1.00 0.00 H new ATOM 0 HE1 PHE A 540 16.690 -10.655 -23.845 1.00 0.00 H new ATOM 0 HE2 PHE A 540 15.294 -8.810 -20.268 1.00 0.00 H new ATOM 0 HZ PHE A 540 17.156 -9.543 -21.700 1.00 0.00 H new ATOM 1407 N ARG A 541 9.886 -7.835 -22.818 1.00 0.00 N ATOM 1408 CA ARG A 541 9.456 -6.732 -21.948 1.00 0.00 C ATOM 1409 C ARG A 541 9.609 -7.179 -20.489 1.00 0.00 C ATOM 1410 O ARG A 541 8.956 -8.141 -20.066 1.00 0.00 O ATOM 1411 CB ARG A 541 7.975 -6.321 -22.224 1.00 0.00 C ATOM 1412 CG ARG A 541 7.591 -6.095 -23.709 1.00 0.00 C ATOM 1413 CD ARG A 541 7.281 -7.398 -24.469 1.00 0.00 C ATOM 1414 NE ARG A 541 6.846 -7.142 -25.855 1.00 0.00 N ATOM 1415 CZ ARG A 541 5.644 -7.463 -26.371 1.00 0.00 C ATOM 1416 NH1 ARG A 541 4.709 -8.051 -25.623 1.00 0.00 N ATOM 1417 NH2 ARG A 541 5.379 -7.171 -27.638 1.00 0.00 N ATOM 0 H ARG A 541 9.137 -8.488 -23.047 1.00 0.00 H new ATOM 0 HA ARG A 541 10.078 -5.860 -22.152 1.00 0.00 H new ATOM 0 HB2 ARG A 541 7.324 -7.094 -21.816 1.00 0.00 H new ATOM 0 HB3 ARG A 541 7.766 -5.404 -21.673 1.00 0.00 H new ATOM 0 HG2 ARG A 541 6.720 -5.441 -23.755 1.00 0.00 H new ATOM 0 HG3 ARG A 541 8.407 -5.576 -24.212 1.00 0.00 H new ATOM 0 HD2 ARG A 541 8.168 -8.031 -24.479 1.00 0.00 H new ATOM 0 HD3 ARG A 541 6.502 -7.949 -23.941 1.00 0.00 H new ATOM 0 HE ARG A 541 7.512 -6.683 -26.476 1.00 0.00 H new ATOM 0 HH11 ARG A 541 4.899 -8.264 -24.644 1.00 0.00 H new ATOM 0 HH12 ARG A 541 3.804 -8.287 -26.030 1.00 0.00 H new ATOM 0 HH21 ARG A 541 6.083 -6.707 -28.212 1.00 0.00 H new ATOM 0 HH22 ARG A 541 4.471 -7.410 -28.037 1.00 0.00 H new ATOM 1431 N THR A 542 10.488 -6.512 -19.737 1.00 0.00 N ATOM 1432 CA THR A 542 10.713 -6.809 -18.317 1.00 0.00 C ATOM 1433 C THR A 542 10.118 -5.678 -17.464 1.00 0.00 C ATOM 1434 O THR A 542 10.500 -4.516 -17.622 1.00 0.00 O ATOM 1435 CB THR A 542 12.235 -6.982 -18.030 1.00 0.00 C ATOM 1436 OG1 THR A 542 12.769 -8.019 -18.871 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.537 -7.309 -16.558 1.00 0.00 C ATOM 0 H THR A 542 11.065 -5.750 -20.094 1.00 0.00 H new ATOM 0 HA THR A 542 10.219 -7.746 -18.059 1.00 0.00 H new ATOM 0 HB THR A 542 12.710 -6.026 -18.249 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.726 -8.126 -18.691 1.00 0.00 H new ATOM 0 HG21 THR A 542 13.613 -7.417 -16.423 1.00 0.00 H new ATOM 0 HG22 THR A 542 12.171 -6.502 -15.923 1.00 0.00 H new ATOM 0 HG23 THR A 542 12.041 -8.240 -16.283 1.00 0.00 H new ATOM 1445 N VAL A 543 9.147 -6.023 -16.604 1.00 0.00 N ATOM 1446 CA VAL A 543 8.468 -5.075 -15.704 1.00 0.00 C ATOM 1447 C VAL A 543 8.773 -5.439 -14.239 1.00 0.00 C ATOM 1448 O VAL A 543 8.514 -6.569 -13.820 1.00 0.00 O ATOM 1449 CB VAL A 543 6.903 -5.089 -15.914 1.00 0.00 C ATOM 1450 CG1 VAL A 543 6.224 -3.943 -15.125 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.523 -5.035 -17.411 1.00 0.00 C ATOM 0 H VAL A 543 8.806 -6.980 -16.512 1.00 0.00 H new ATOM 0 HA VAL A 543 8.841 -4.077 -15.937 1.00 0.00 H new ATOM 0 HB VAL A 543 6.533 -6.036 -15.520 1.00 0.00 H new ATOM 0 HG11 VAL A 543 5.147 -3.977 -15.288 1.00 0.00 H new ATOM 0 HG12 VAL A 543 6.434 -4.059 -14.062 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.613 -2.984 -15.469 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.438 -5.047 -17.512 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.919 -4.121 -17.854 1.00 0.00 H new ATOM 0 HG23 VAL A 543 6.944 -5.899 -17.925 1.00 0.00 H new ATOM 1461 N LEU A 544 9.329 -4.489 -13.475 1.00 0.00 N ATOM 1462 CA LEU A 544 9.406 -4.598 -12.012 1.00 0.00 C ATOM 1463 C LEU A 544 8.044 -4.173 -11.430 1.00 0.00 C ATOM 1464 O LEU A 544 7.536 -3.082 -11.732 1.00 0.00 O ATOM 1465 CB LEU A 544 10.563 -3.733 -11.449 1.00 0.00 C ATOM 1466 CG LEU A 544 10.769 -3.773 -9.899 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.962 -5.219 -9.380 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.944 -2.866 -9.473 1.00 0.00 C ATOM 0 H LEU A 544 9.734 -3.631 -13.849 1.00 0.00 H new ATOM 0 HA LEU A 544 9.621 -5.627 -11.723 1.00 0.00 H new ATOM 0 HB2 LEU A 544 11.490 -4.051 -11.925 1.00 0.00 H new ATOM 0 HB3 LEU A 544 10.391 -2.698 -11.744 1.00 0.00 H new ATOM 0 HG LEU A 544 9.859 -3.386 -9.440 1.00 0.00 H new ATOM 0 HD11 LEU A 544 11.102 -5.202 -8.299 1.00 0.00 H new ATOM 0 HD12 LEU A 544 10.081 -5.813 -9.623 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.839 -5.661 -9.852 1.00 0.00 H new ATOM 0 HD21 LEU A 544 12.066 -2.912 -8.391 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.860 -3.206 -9.956 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.737 -1.838 -9.771 1.00 0.00 H new ATOM 1480 N VAL A 545 7.438 -5.059 -10.633 1.00 0.00 N ATOM 1481 CA VAL A 545 6.069 -4.889 -10.106 1.00 0.00 C ATOM 1482 C VAL A 545 6.085 -5.035 -8.571 1.00 0.00 C ATOM 1483 O VAL A 545 6.857 -5.826 -8.027 1.00 0.00 O ATOM 1484 CB VAL A 545 5.087 -5.966 -10.738 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.627 -5.794 -10.256 1.00 0.00 C ATOM 1486 CG2 VAL A 545 5.149 -5.953 -12.281 1.00 0.00 C ATOM 0 H VAL A 545 7.884 -5.925 -10.329 1.00 0.00 H new ATOM 0 HA VAL A 545 5.712 -3.895 -10.376 1.00 0.00 H new ATOM 0 HB VAL A 545 5.434 -6.937 -10.385 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.999 -6.555 -10.719 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.587 -5.900 -9.172 1.00 0.00 H new ATOM 0 HG13 VAL A 545 3.265 -4.805 -10.538 1.00 0.00 H new ATOM 0 HG21 VAL A 545 4.465 -6.702 -12.679 1.00 0.00 H new ATOM 0 HG22 VAL A 545 4.862 -4.968 -12.648 1.00 0.00 H new ATOM 0 HG23 VAL A 545 6.164 -6.180 -12.606 1.00 0.00 H new ATOM 1496 N ASN A 546 5.236 -4.250 -7.888 1.00 0.00 N ATOM 1497 CA ASN A 546 4.968 -4.388 -6.437 1.00 0.00 C ATOM 1498 C ASN A 546 3.887 -5.474 -6.200 1.00 0.00 C ATOM 1499 O ASN A 546 3.155 -5.845 -7.125 1.00 0.00 O ATOM 1500 CB ASN A 546 4.567 -2.994 -5.861 1.00 0.00 C ATOM 1501 CG ASN A 546 3.926 -2.998 -4.474 1.00 0.00 C ATOM 1502 OD1 ASN A 546 4.604 -2.958 -3.450 1.00 0.00 O ATOM 1503 ND2 ASN A 546 2.606 -3.046 -4.446 1.00 0.00 N ATOM 0 H ASN A 546 4.709 -3.494 -8.326 1.00 0.00 H new ATOM 0 HA ASN A 546 5.862 -4.719 -5.908 1.00 0.00 H new ATOM 0 HB2 ASN A 546 5.459 -2.368 -5.825 1.00 0.00 H new ATOM 0 HB3 ASN A 546 3.874 -2.521 -6.558 1.00 0.00 H new ATOM 0 HD21 ASN A 546 2.115 -3.051 -3.552 1.00 0.00 H new ATOM 0 HD22 ASN A 546 2.078 -3.078 -5.318 1.00 0.00 H new ATOM 1510 N ALA A 547 3.800 -5.960 -4.952 1.00 0.00 N ATOM 1511 CA ALA A 547 2.904 -7.067 -4.517 1.00 0.00 C ATOM 1512 C ALA A 547 1.457 -6.961 -5.040 1.00 0.00 C ATOM 1513 O ALA A 547 0.855 -7.960 -5.457 1.00 0.00 O ATOM 1514 CB ALA A 547 2.880 -7.075 -2.990 1.00 0.00 C ATOM 0 H ALA A 547 4.364 -5.589 -4.187 1.00 0.00 H new ATOM 0 HA ALA A 547 3.306 -7.988 -4.938 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.230 -7.877 -2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 547 3.889 -7.235 -2.611 1.00 0.00 H new ATOM 0 HB3 ALA A 547 2.503 -6.119 -2.627 1.00 0.00 H new ATOM 1520 N ASP A 548 0.934 -5.733 -5.012 1.00 0.00 N ATOM 1521 CA ASP A 548 -0.458 -5.404 -5.395 1.00 0.00 C ATOM 1522 C ASP A 548 -0.795 -5.814 -6.845 1.00 0.00 C ATOM 1523 O ASP A 548 -1.934 -6.200 -7.155 1.00 0.00 O ATOM 1524 CB ASP A 548 -0.648 -3.882 -5.211 1.00 0.00 C ATOM 1525 CG ASP A 548 -2.044 -3.370 -5.600 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -2.999 -3.566 -4.815 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -2.192 -2.768 -6.688 1.00 0.00 O ATOM 0 H ASP A 548 1.470 -4.917 -4.718 1.00 0.00 H new ATOM 0 HA ASP A 548 -1.138 -5.969 -4.758 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -0.457 -3.627 -4.169 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.098 -3.359 -5.809 1.00 0.00 H new ATOM 1532 N GLY A 549 0.214 -5.748 -7.715 1.00 0.00 N ATOM 1533 CA GLY A 549 0.021 -5.862 -9.162 1.00 0.00 C ATOM 1534 C GLY A 549 0.267 -4.524 -9.846 1.00 0.00 C ATOM 1535 O GLY A 549 0.252 -4.436 -11.081 1.00 0.00 O ATOM 0 H GLY A 549 1.186 -5.614 -7.437 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.700 -6.613 -9.566 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -0.993 -6.203 -9.373 1.00 0.00 H new ATOM 1539 N GLU A 550 0.478 -3.471 -9.025 1.00 0.00 N ATOM 1540 CA GLU A 550 0.852 -2.137 -9.499 1.00 0.00 C ATOM 1541 C GLU A 550 2.280 -2.178 -10.095 1.00 0.00 C ATOM 1542 O GLU A 550 3.244 -2.543 -9.409 1.00 0.00 O ATOM 1543 CB GLU A 550 0.712 -1.096 -8.338 1.00 0.00 C ATOM 1544 CG GLU A 550 1.638 -1.317 -7.134 1.00 0.00 C ATOM 1545 CD GLU A 550 1.417 -0.325 -5.975 1.00 0.00 C ATOM 1546 OE1 GLU A 550 1.874 0.829 -6.067 1.00 0.00 O ATOM 1547 OE2 GLU A 550 0.795 -0.707 -4.959 1.00 0.00 O ATOM 0 H GLU A 550 0.391 -3.532 -8.011 1.00 0.00 H new ATOM 0 HA GLU A 550 0.177 -1.819 -10.294 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.901 -0.101 -8.741 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.320 -1.107 -7.987 1.00 0.00 H new ATOM 0 HG2 GLU A 550 1.495 -2.331 -6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 550 2.673 -1.243 -7.468 1.00 0.00 H new ATOM 1554 N GLU A 551 2.384 -1.874 -11.401 1.00 0.00 N ATOM 1555 CA GLU A 551 3.666 -1.842 -12.127 1.00 0.00 C ATOM 1556 C GLU A 551 4.437 -0.575 -11.715 1.00 0.00 C ATOM 1557 O GLU A 551 3.956 0.544 -11.925 1.00 0.00 O ATOM 1558 CB GLU A 551 3.394 -1.877 -13.657 1.00 0.00 C ATOM 1559 CG GLU A 551 2.578 -3.105 -14.120 1.00 0.00 C ATOM 1560 CD GLU A 551 2.312 -3.132 -15.641 1.00 0.00 C ATOM 1561 OE1 GLU A 551 1.399 -2.418 -16.110 1.00 0.00 O ATOM 1562 OE2 GLU A 551 3.017 -3.869 -16.374 1.00 0.00 O ATOM 0 H GLU A 551 1.579 -1.643 -11.984 1.00 0.00 H new ATOM 0 HA GLU A 551 4.274 -2.712 -11.877 1.00 0.00 H new ATOM 0 HB2 GLU A 551 2.861 -0.970 -13.942 1.00 0.00 H new ATOM 0 HB3 GLU A 551 4.347 -1.866 -14.186 1.00 0.00 H new ATOM 0 HG2 GLU A 551 3.111 -4.013 -13.836 1.00 0.00 H new ATOM 0 HG3 GLU A 551 1.624 -3.117 -13.592 1.00 0.00 H new ATOM 1569 N VAL A 552 5.611 -0.760 -11.086 1.00 0.00 N ATOM 1570 CA VAL A 552 6.385 0.352 -10.496 1.00 0.00 C ATOM 1571 C VAL A 552 7.464 0.867 -11.466 1.00 0.00 C ATOM 1572 O VAL A 552 7.830 2.051 -11.429 1.00 0.00 O ATOM 1573 CB VAL A 552 7.038 -0.071 -9.130 1.00 0.00 C ATOM 1574 CG1 VAL A 552 5.968 -0.620 -8.157 1.00 0.00 C ATOM 1575 CG2 VAL A 552 8.190 -1.089 -9.315 1.00 0.00 C ATOM 0 H VAL A 552 6.049 -1.674 -10.972 1.00 0.00 H new ATOM 0 HA VAL A 552 5.684 1.165 -10.306 1.00 0.00 H new ATOM 0 HB VAL A 552 7.477 0.827 -8.696 1.00 0.00 H new ATOM 0 HG11 VAL A 552 6.442 -0.907 -7.218 1.00 0.00 H new ATOM 0 HG12 VAL A 552 5.221 0.150 -7.966 1.00 0.00 H new ATOM 0 HG13 VAL A 552 5.486 -1.491 -8.600 1.00 0.00 H new ATOM 0 HG21 VAL A 552 8.606 -1.348 -8.342 1.00 0.00 H new ATOM 0 HG22 VAL A 552 7.807 -1.989 -9.797 1.00 0.00 H new ATOM 0 HG23 VAL A 552 8.969 -0.648 -9.937 1.00 0.00 H new ATOM 1585 N ALA A 553 7.950 -0.041 -12.331 1.00 0.00 N ATOM 1586 CA ALA A 553 9.015 0.235 -13.306 1.00 0.00 C ATOM 1587 C ALA A 553 8.918 -0.767 -14.455 1.00 0.00 C ATOM 1588 O ALA A 553 8.540 -1.916 -14.237 1.00 0.00 O ATOM 1589 CB ALA A 553 10.398 0.158 -12.635 1.00 0.00 C ATOM 0 H ALA A 553 7.607 -1.001 -12.371 1.00 0.00 H new ATOM 0 HA ALA A 553 8.890 1.244 -13.698 1.00 0.00 H new ATOM 0 HB1 ALA A 553 11.173 0.365 -13.373 1.00 0.00 H new ATOM 0 HB2 ALA A 553 10.455 0.894 -11.833 1.00 0.00 H new ATOM 0 HB3 ALA A 553 10.547 -0.840 -12.223 1.00 0.00 H new ATOM 1595 N MET A 554 9.279 -0.333 -15.665 1.00 0.00 N ATOM 1596 CA MET A 554 9.204 -1.171 -16.878 1.00 0.00 C ATOM 1597 C MET A 554 10.340 -0.793 -17.839 1.00 0.00 C ATOM 1598 O MET A 554 10.759 0.371 -17.887 1.00 0.00 O ATOM 1599 CB MET A 554 7.813 -1.032 -17.568 1.00 0.00 C ATOM 1600 CG MET A 554 7.476 0.377 -18.094 1.00 0.00 C ATOM 1601 SD MET A 554 7.448 1.635 -16.794 1.00 0.00 S ATOM 1602 CE MET A 554 7.198 3.136 -17.740 1.00 0.00 C ATOM 0 H MET A 554 9.632 0.608 -15.838 1.00 0.00 H new ATOM 0 HA MET A 554 9.321 -2.216 -16.592 1.00 0.00 H new ATOM 0 HB2 MET A 554 7.768 -1.733 -18.401 1.00 0.00 H new ATOM 0 HB3 MET A 554 7.042 -1.331 -16.858 1.00 0.00 H new ATOM 0 HG2 MET A 554 8.209 0.661 -18.849 1.00 0.00 H new ATOM 0 HG3 MET A 554 6.504 0.351 -18.587 1.00 0.00 H new ATOM 0 HE1 MET A 554 7.161 3.990 -17.064 1.00 0.00 H new ATOM 0 HE2 MET A 554 8.021 3.265 -18.443 1.00 0.00 H new ATOM 0 HE3 MET A 554 6.259 3.068 -18.290 1.00 0.00 H new ATOM 1612 N ARG A 555 10.834 -1.789 -18.590 1.00 0.00 N ATOM 1613 CA ARG A 555 11.944 -1.618 -19.536 1.00 0.00 C ATOM 1614 C ARG A 555 11.916 -2.791 -20.533 1.00 0.00 C ATOM 1615 O ARG A 555 12.204 -3.940 -20.167 1.00 0.00 O ATOM 1616 CB ARG A 555 13.314 -1.517 -18.769 1.00 0.00 C ATOM 1617 CG ARG A 555 14.544 -1.023 -19.594 1.00 0.00 C ATOM 1618 CD ARG A 555 15.212 -2.111 -20.458 1.00 0.00 C ATOM 1619 NE ARG A 555 16.251 -1.553 -21.347 1.00 0.00 N ATOM 1620 CZ ARG A 555 17.340 -2.204 -21.777 1.00 0.00 C ATOM 1621 NH1 ARG A 555 17.624 -3.419 -21.328 1.00 0.00 N ATOM 1622 NH2 ARG A 555 18.153 -1.618 -22.636 1.00 0.00 N ATOM 0 H ARG A 555 10.471 -2.742 -18.557 1.00 0.00 H new ATOM 0 HA ARG A 555 11.833 -0.686 -20.090 1.00 0.00 H new ATOM 0 HB2 ARG A 555 13.181 -0.845 -17.921 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.550 -2.500 -18.362 1.00 0.00 H new ATOM 0 HG2 ARG A 555 14.227 -0.206 -20.242 1.00 0.00 H new ATOM 0 HG3 ARG A 555 15.286 -0.615 -18.908 1.00 0.00 H new ATOM 0 HD2 ARG A 555 15.657 -2.866 -19.810 1.00 0.00 H new ATOM 0 HD3 ARG A 555 14.453 -2.613 -21.058 1.00 0.00 H new ATOM 0 HE ARG A 555 16.129 -0.590 -21.660 1.00 0.00 H new ATOM 0 HH11 ARG A 555 17.010 -3.868 -20.648 1.00 0.00 H new ATOM 0 HH12 ARG A 555 18.456 -3.905 -21.663 1.00 0.00 H new ATOM 0 HH21 ARG A 555 17.950 -0.675 -22.968 1.00 0.00 H new ATOM 0 HH22 ARG A 555 18.984 -2.108 -22.967 1.00 0.00 H new ATOM 1636 N THR A 556 11.531 -2.492 -21.781 1.00 0.00 N ATOM 1637 CA THR A 556 11.554 -3.451 -22.889 1.00 0.00 C ATOM 1638 C THR A 556 12.980 -3.539 -23.466 1.00 0.00 C ATOM 1639 O THR A 556 13.667 -2.524 -23.614 1.00 0.00 O ATOM 1640 CB THR A 556 10.530 -3.049 -24.004 1.00 0.00 C ATOM 1641 OG1 THR A 556 9.221 -2.941 -23.418 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.492 -4.058 -25.178 1.00 0.00 C ATOM 0 H THR A 556 11.192 -1.568 -22.050 1.00 0.00 H new ATOM 0 HA THR A 556 11.260 -4.430 -22.510 1.00 0.00 H new ATOM 0 HB THR A 556 10.852 -2.094 -24.418 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.573 -2.688 -24.109 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.765 -3.727 -25.919 1.00 0.00 H new ATOM 0 HG22 THR A 556 11.478 -4.118 -25.639 1.00 0.00 H new ATOM 0 HG23 THR A 556 10.206 -5.041 -24.804 1.00 0.00 H new ATOM 1650 N VAL A 557 13.408 -4.767 -23.767 1.00 0.00 N ATOM 1651 CA VAL A 557 14.754 -5.085 -24.268 1.00 0.00 C ATOM 1652 C VAL A 557 14.641 -5.651 -25.683 1.00 0.00 C ATOM 1653 O VAL A 557 13.649 -6.303 -26.011 1.00 0.00 O ATOM 1654 CB VAL A 557 15.462 -6.154 -23.349 1.00 0.00 C ATOM 1655 CG1 VAL A 557 16.940 -6.413 -23.764 1.00 0.00 C ATOM 1656 CG2 VAL A 557 15.361 -5.750 -21.868 1.00 0.00 C ATOM 0 H VAL A 557 12.816 -5.591 -23.668 1.00 0.00 H new ATOM 0 HA VAL A 557 15.348 -4.171 -24.265 1.00 0.00 H new ATOM 0 HB VAL A 557 14.932 -7.097 -23.487 1.00 0.00 H new ATOM 0 HG11 VAL A 557 17.380 -7.156 -23.099 1.00 0.00 H new ATOM 0 HG12 VAL A 557 16.971 -6.780 -24.790 1.00 0.00 H new ATOM 0 HG13 VAL A 557 17.506 -5.484 -23.694 1.00 0.00 H new ATOM 0 HG21 VAL A 557 15.856 -6.501 -21.252 1.00 0.00 H new ATOM 0 HG22 VAL A 557 15.844 -4.784 -21.721 1.00 0.00 H new ATOM 0 HG23 VAL A 557 14.312 -5.679 -21.581 1.00 0.00 H new ATOM 1666 N LYS A 558 15.647 -5.359 -26.515 1.00 0.00 N ATOM 1667 CA LYS A 558 15.867 -6.025 -27.796 1.00 0.00 C ATOM 1668 C LYS A 558 17.386 -6.121 -28.053 1.00 0.00 C ATOM 1669 O LYS A 558 18.083 -5.104 -28.170 1.00 0.00 O ATOM 1670 CB LYS A 558 15.096 -5.375 -28.998 1.00 0.00 C ATOM 1671 CG LYS A 558 15.156 -3.839 -29.138 1.00 0.00 C ATOM 1672 CD LYS A 558 14.255 -3.099 -28.116 1.00 0.00 C ATOM 1673 CE LYS A 558 14.119 -1.610 -28.431 1.00 0.00 C ATOM 1674 NZ LYS A 558 13.353 -0.880 -27.391 1.00 0.00 N ATOM 0 H LYS A 558 16.341 -4.640 -26.310 1.00 0.00 H new ATOM 0 HA LYS A 558 15.443 -7.027 -27.727 1.00 0.00 H new ATOM 0 HB2 LYS A 558 15.481 -5.812 -29.920 1.00 0.00 H new ATOM 0 HB3 LYS A 558 14.048 -5.665 -28.921 1.00 0.00 H new ATOM 0 HG2 LYS A 558 16.187 -3.509 -29.010 1.00 0.00 H new ATOM 0 HG3 LYS A 558 14.855 -3.560 -30.148 1.00 0.00 H new ATOM 0 HD2 LYS A 558 13.266 -3.558 -28.108 1.00 0.00 H new ATOM 0 HD3 LYS A 558 14.670 -3.220 -27.115 1.00 0.00 H new ATOM 0 HE2 LYS A 558 15.111 -1.169 -28.524 1.00 0.00 H new ATOM 0 HE3 LYS A 558 13.625 -1.489 -29.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 13.288 0.125 -27.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 12.396 -1.281 -27.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 13.837 -0.971 -26.475 1.00 0.00 H new ATOM 1688 N LYS A 559 17.876 -7.375 -28.041 1.00 0.00 N ATOM 1689 CA LYS A 559 19.263 -7.760 -28.321 1.00 0.00 C ATOM 1690 C LYS A 559 19.736 -7.209 -29.683 1.00 0.00 C ATOM 1691 O LYS A 559 19.325 -7.699 -30.745 1.00 0.00 O ATOM 1692 CB LYS A 559 19.361 -9.312 -28.275 1.00 0.00 C ATOM 1693 CG LYS A 559 20.758 -9.896 -28.554 1.00 0.00 C ATOM 1694 CD LYS A 559 20.810 -11.433 -28.359 1.00 0.00 C ATOM 1695 CE LYS A 559 22.149 -12.033 -28.809 1.00 0.00 C ATOM 1696 NZ LYS A 559 22.407 -11.778 -30.250 1.00 0.00 N ATOM 0 H LYS A 559 17.286 -8.179 -27.826 1.00 0.00 H new ATOM 0 HA LYS A 559 19.920 -7.329 -27.566 1.00 0.00 H new ATOM 0 HB2 LYS A 559 19.035 -9.650 -27.292 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.662 -9.725 -29.002 1.00 0.00 H new ATOM 0 HG2 LYS A 559 21.052 -9.653 -29.575 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.484 -9.424 -27.892 1.00 0.00 H new ATOM 0 HD2 LYS A 559 20.644 -11.669 -27.308 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.000 -11.896 -28.922 1.00 0.00 H new ATOM 0 HE2 LYS A 559 22.957 -11.608 -28.214 1.00 0.00 H new ATOM 0 HE3 LYS A 559 22.147 -13.107 -28.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 23.162 -12.410 -30.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 21.539 -11.956 -30.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 22.701 -10.789 -30.380 1.00 0.00 H new