USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 679 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 479 HIS : no HD1:sc= -0.0418 K(o=1.7,f=-0.57) USER MOD Set 1.2: A 483 LYS NZ :NH3+ 176:sc= 0.617 (180deg=0) USER MOD Set 1.3: A 522 THR OG1 : rot 69:sc= 1.16 USER MOD Single : A 470 SER OG : rot 80:sc= 1.16 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 477 LYS NZ :NH3+ 173:sc= 0.174 (180deg=0.161) USER MOD Single : A 480 SER OG : rot 96:sc= 1.28 USER MOD Single : A 487 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 496 CYS SG : rot 180:sc= -0.689 USER MOD Single : A 498 ASN : amide:sc= 0.184 X(o=0.18,f=0) USER MOD Single : A 505 THR OG1 : rot -32:sc= 0.0733 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.99!) USER MOD Single : A 509 THR OG1 : rot 180:sc=0.000773 USER MOD Single : A 510 SER OG : rot 180:sc= 0.0111 USER MOD Single : A 511 GLN : amide:sc=-0.00565 K(o=-0.0057,f=-1.2) USER MOD Single : A 514 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 515 LYS NZ :NH3+ 153:sc= 0.495 (180deg=-0.347!) USER MOD Single : A 516 ASN : amide:sc= -0.784 K(o=-0.78,f=-2.5!) USER MOD Single : A 517 THR OG1 : rot 180:sc= 0.0037 USER MOD Single : A 524 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 525 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 529 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 LYS NZ :NH3+ 139:sc= 0.302 (180deg=0.19) USER MOD Single : A 532 ASN : amide:sc= -0.234 K(o=-0.23,f=-1.4!) USER MOD Single : A 533 LYS NZ :NH3+ -169:sc= -0.108 (180deg=-0.309) USER MOD Single : A 536 MET CE :methyl 180:sc= -0.0914 (180deg=-0.0914) USER MOD Single : A 538 LYS NZ :NH3+ -116:sc= 0.535 (180deg=-0.442) USER MOD Single : A 543 TYR OH : rot 180:sc= 0 USER MOD Single : A 544 THR OG1 : rot 104:sc= 1.23 USER MOD Single : A 547 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 548 SER OG : rot -27:sc= 0.173 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 470 6.805 -7.958 -4.147 1.00 0.00 N ATOM 49 CA SER A 470 8.130 -8.347 -4.631 1.00 0.00 C ATOM 50 C SER A 470 8.065 -9.635 -5.447 1.00 0.00 C ATOM 51 O SER A 470 7.054 -10.326 -5.455 1.00 0.00 O ATOM 52 CB SER A 470 9.061 -8.563 -3.437 1.00 0.00 C ATOM 53 OG SER A 470 8.974 -7.468 -2.543 1.00 0.00 O ATOM 0 HA SER A 470 8.506 -7.549 -5.271 1.00 0.00 H new ATOM 0 HB2 SER A 470 8.794 -9.485 -2.921 1.00 0.00 H new ATOM 0 HB3 SER A 470 10.088 -8.678 -3.784 1.00 0.00 H new ATOM 0 HG SER A 470 8.171 -7.561 -1.989 1.00 0.00 H new ATOM 59 N VAL A 471 9.155 -9.967 -6.126 1.00 0.00 N ATOM 60 CA VAL A 471 9.205 -11.175 -6.954 1.00 0.00 C ATOM 61 C VAL A 471 8.900 -12.425 -6.157 1.00 0.00 C ATOM 62 O VAL A 471 8.133 -13.253 -6.592 1.00 0.00 O ATOM 63 CB VAL A 471 10.610 -11.356 -7.579 1.00 0.00 C ATOM 64 CG1 VAL A 471 10.757 -12.720 -8.260 1.00 0.00 C ATOM 65 CG2 VAL A 471 10.863 -10.278 -8.576 1.00 0.00 C ATOM 0 H VAL A 471 10.017 -9.421 -6.123 1.00 0.00 H new ATOM 0 HA VAL A 471 8.449 -11.042 -7.728 1.00 0.00 H new ATOM 0 HB VAL A 471 11.340 -11.299 -6.771 1.00 0.00 H new ATOM 0 HG11 VAL A 471 11.756 -12.808 -8.686 1.00 0.00 H new ATOM 0 HG12 VAL A 471 10.604 -13.511 -7.526 1.00 0.00 H new ATOM 0 HG13 VAL A 471 10.015 -12.813 -9.053 1.00 0.00 H new ATOM 0 HG21 VAL A 471 11.853 -10.411 -9.012 1.00 0.00 H new ATOM 0 HG22 VAL A 471 10.110 -10.326 -9.363 1.00 0.00 H new ATOM 0 HG23 VAL A 471 10.811 -9.307 -8.083 1.00 0.00 H new ATOM 75 N GLU A 472 9.507 -12.564 -4.996 1.00 0.00 N ATOM 76 CA GLU A 472 9.304 -13.749 -4.165 1.00 0.00 C ATOM 77 C GLU A 472 7.864 -13.850 -3.655 1.00 0.00 C ATOM 78 O GLU A 472 7.327 -14.944 -3.530 1.00 0.00 O ATOM 79 CB GLU A 472 10.272 -13.727 -2.990 1.00 0.00 C ATOM 80 CG GLU A 472 10.714 -12.331 -2.604 1.00 0.00 C ATOM 81 CD GLU A 472 11.573 -12.358 -1.359 1.00 0.00 C ATOM 82 OE1 GLU A 472 11.080 -12.758 -0.289 1.00 0.00 O ATOM 83 OE2 GLU A 472 12.767 -12.005 -1.457 1.00 0.00 O ATOM 0 H GLU A 472 10.146 -11.875 -4.600 1.00 0.00 H new ATOM 0 HA GLU A 472 9.496 -14.625 -4.784 1.00 0.00 H new ATOM 0 HB2 GLU A 472 9.800 -14.202 -2.130 1.00 0.00 H new ATOM 0 HB3 GLU A 472 11.150 -14.322 -3.240 1.00 0.00 H new ATOM 0 HG2 GLU A 472 11.273 -11.883 -3.426 1.00 0.00 H new ATOM 0 HG3 GLU A 472 9.839 -11.703 -2.433 1.00 0.00 H new ATOM 90 N GLU A 473 7.235 -12.717 -3.382 1.00 0.00 N ATOM 91 CA GLU A 473 5.837 -12.711 -2.943 1.00 0.00 C ATOM 92 C GLU A 473 4.982 -13.232 -4.094 1.00 0.00 C ATOM 93 O GLU A 473 4.070 -14.036 -3.915 1.00 0.00 O ATOM 94 CB GLU A 473 5.385 -11.286 -2.611 1.00 0.00 C ATOM 95 CG GLU A 473 6.086 -10.648 -1.420 1.00 0.00 C ATOM 96 CD GLU A 473 5.742 -9.167 -1.299 1.00 0.00 C ATOM 97 OE1 GLU A 473 6.678 -8.334 -1.337 1.00 0.00 O ATOM 98 OE2 GLU A 473 4.554 -8.824 -1.198 1.00 0.00 O ATOM 0 H GLU A 473 7.662 -11.793 -3.454 1.00 0.00 H new ATOM 0 HA GLU A 473 5.732 -13.332 -2.054 1.00 0.00 H new ATOM 0 HB2 GLU A 473 5.545 -10.657 -3.487 1.00 0.00 H new ATOM 0 HB3 GLU A 473 4.312 -11.297 -2.418 1.00 0.00 H new ATOM 0 HG2 GLU A 473 5.797 -11.166 -0.506 1.00 0.00 H new ATOM 0 HG3 GLU A 473 7.165 -10.765 -1.525 1.00 0.00 H new ATOM 105 N LYS A 474 5.298 -12.768 -5.295 1.00 0.00 N ATOM 106 CA LYS A 474 4.549 -13.171 -6.486 1.00 0.00 C ATOM 107 C LYS A 474 4.832 -14.617 -6.810 1.00 0.00 C ATOM 108 O LYS A 474 3.968 -15.344 -7.285 1.00 0.00 O ATOM 109 CB LYS A 474 4.960 -12.325 -7.677 1.00 0.00 C ATOM 110 CG LYS A 474 4.435 -10.923 -7.647 1.00 0.00 C ATOM 111 CD LYS A 474 5.327 -10.024 -8.466 1.00 0.00 C ATOM 112 CE LYS A 474 4.542 -8.881 -9.064 1.00 0.00 C ATOM 113 NZ LYS A 474 5.326 -7.606 -8.994 1.00 0.00 N ATOM 0 H LYS A 474 6.062 -12.116 -5.474 1.00 0.00 H new ATOM 0 HA LYS A 474 3.487 -13.033 -6.283 1.00 0.00 H new ATOM 0 HB2 LYS A 474 6.048 -12.292 -7.726 1.00 0.00 H new ATOM 0 HB3 LYS A 474 4.614 -12.811 -8.590 1.00 0.00 H new ATOM 0 HG2 LYS A 474 3.419 -10.897 -8.040 1.00 0.00 H new ATOM 0 HG3 LYS A 474 4.388 -10.565 -6.619 1.00 0.00 H new ATOM 0 HD2 LYS A 474 6.127 -9.631 -7.839 1.00 0.00 H new ATOM 0 HD3 LYS A 474 5.799 -10.601 -9.261 1.00 0.00 H new ATOM 0 HE2 LYS A 474 4.296 -9.106 -10.102 1.00 0.00 H new ATOM 0 HE3 LYS A 474 3.598 -8.763 -8.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 4.769 -6.833 -9.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 5.539 -7.384 -8.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 6.215 -7.716 -9.523 1.00 0.00 H new ATOM 127 N LEU A 475 6.058 -15.030 -6.551 1.00 0.00 N ATOM 128 CA LEU A 475 6.497 -16.379 -6.833 1.00 0.00 C ATOM 129 C LEU A 475 5.606 -17.359 -6.103 1.00 0.00 C ATOM 130 O LEU A 475 5.247 -18.384 -6.663 1.00 0.00 O ATOM 131 CB LEU A 475 7.970 -16.562 -6.415 1.00 0.00 C ATOM 132 CG LEU A 475 8.634 -17.945 -6.552 1.00 0.00 C ATOM 133 CD1 LEU A 475 8.267 -18.883 -5.382 1.00 0.00 C ATOM 134 CD2 LEU A 475 8.310 -18.557 -7.894 1.00 0.00 C ATOM 0 H LEU A 475 6.778 -14.436 -6.138 1.00 0.00 H new ATOM 0 HA LEU A 475 6.426 -16.566 -7.904 1.00 0.00 H new ATOM 0 HB2 LEU A 475 8.564 -15.856 -6.996 1.00 0.00 H new ATOM 0 HB3 LEU A 475 8.052 -16.263 -5.370 1.00 0.00 H new ATOM 0 HG LEU A 475 9.714 -17.805 -6.501 1.00 0.00 H new ATOM 0 HD11 LEU A 475 8.757 -19.847 -5.521 1.00 0.00 H new ATOM 0 HD12 LEU A 475 8.597 -18.439 -4.443 1.00 0.00 H new ATOM 0 HD13 LEU A 475 7.187 -19.026 -5.356 1.00 0.00 H new ATOM 0 HD21 LEU A 475 8.787 -19.534 -7.973 1.00 0.00 H new ATOM 0 HD22 LEU A 475 7.230 -18.672 -7.990 1.00 0.00 H new ATOM 0 HD23 LEU A 475 8.678 -17.908 -8.688 1.00 0.00 H new ATOM 146 N GLN A 476 5.232 -17.060 -4.868 1.00 0.00 N ATOM 147 CA GLN A 476 4.387 -17.980 -4.115 1.00 0.00 C ATOM 148 C GLN A 476 3.109 -18.300 -4.897 1.00 0.00 C ATOM 149 O GLN A 476 2.675 -19.451 -4.930 1.00 0.00 O ATOM 150 CB GLN A 476 4.046 -17.409 -2.738 1.00 0.00 C ATOM 151 CG GLN A 476 5.265 -17.265 -1.838 1.00 0.00 C ATOM 152 CD GLN A 476 4.899 -16.840 -0.431 1.00 0.00 C ATOM 153 OE1 GLN A 476 4.217 -15.857 -0.229 1.00 0.00 O ATOM 154 NE2 GLN A 476 5.348 -17.589 0.544 1.00 0.00 N ATOM 0 H GLN A 476 5.492 -16.207 -4.373 1.00 0.00 H new ATOM 0 HA GLN A 476 4.943 -18.906 -3.968 1.00 0.00 H new ATOM 0 HB2 GLN A 476 3.574 -16.434 -2.861 1.00 0.00 H new ATOM 0 HB3 GLN A 476 3.316 -18.057 -2.252 1.00 0.00 H new ATOM 0 HG2 GLN A 476 5.799 -18.214 -1.800 1.00 0.00 H new ATOM 0 HG3 GLN A 476 5.947 -16.533 -2.270 1.00 0.00 H new ATOM 0 HE21 GLN A 476 5.919 -18.408 0.336 1.00 0.00 H new ATOM 0 HE22 GLN A 476 5.127 -17.353 1.511 1.00 0.00 H new ATOM 163 N LYS A 477 2.530 -17.298 -5.549 1.00 0.00 N ATOM 164 CA LYS A 477 1.342 -17.514 -6.385 1.00 0.00 C ATOM 165 C LYS A 477 1.697 -18.346 -7.613 1.00 0.00 C ATOM 166 O LYS A 477 1.127 -19.406 -7.821 1.00 0.00 O ATOM 167 CB LYS A 477 0.779 -16.166 -6.847 1.00 0.00 C ATOM 168 CG LYS A 477 -0.399 -16.252 -7.832 1.00 0.00 C ATOM 169 CD LYS A 477 -0.556 -14.921 -8.566 1.00 0.00 C ATOM 170 CE LYS A 477 -1.450 -15.058 -9.806 1.00 0.00 C ATOM 171 NZ LYS A 477 -1.269 -13.882 -10.750 1.00 0.00 N ATOM 0 H LYS A 477 2.857 -16.332 -5.519 1.00 0.00 H new ATOM 0 HA LYS A 477 0.598 -18.045 -5.792 1.00 0.00 H new ATOM 0 HB2 LYS A 477 0.458 -15.604 -5.970 1.00 0.00 H new ATOM 0 HB3 LYS A 477 1.582 -15.596 -7.314 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -0.228 -17.055 -8.549 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -1.317 -16.493 -7.296 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.983 -14.181 -7.890 1.00 0.00 H new ATOM 0 HD3 LYS A 477 0.425 -14.552 -8.864 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -1.213 -15.985 -10.327 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -2.494 -15.123 -9.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -1.794 -14.059 -11.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -1.630 -13.017 -10.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -0.259 -13.764 -10.967 1.00 0.00 H new ATOM 185 N LEU A 478 2.641 -17.882 -8.425 1.00 0.00 N ATOM 186 CA LEU A 478 2.986 -18.564 -9.660 1.00 0.00 C ATOM 187 C LEU A 478 3.444 -19.985 -9.470 1.00 0.00 C ATOM 188 O LEU A 478 3.019 -20.873 -10.189 1.00 0.00 O ATOM 189 CB LEU A 478 4.105 -17.796 -10.342 1.00 0.00 C ATOM 190 CG LEU A 478 3.777 -16.504 -11.092 1.00 0.00 C ATOM 191 CD1 LEU A 478 2.308 -16.085 -11.107 1.00 0.00 C ATOM 192 CD2 LEU A 478 4.643 -15.366 -10.590 1.00 0.00 C ATOM 0 H LEU A 478 3.180 -17.035 -8.247 1.00 0.00 H new ATOM 0 HA LEU A 478 2.075 -18.599 -10.258 1.00 0.00 H new ATOM 0 HB2 LEU A 478 4.847 -17.554 -9.581 1.00 0.00 H new ATOM 0 HB3 LEU A 478 4.583 -18.473 -11.050 1.00 0.00 H new ATOM 0 HG LEU A 478 4.002 -16.735 -12.133 1.00 0.00 H new ATOM 0 HD11 LEU A 478 2.200 -15.156 -11.667 1.00 0.00 H new ATOM 0 HD12 LEU A 478 1.712 -16.865 -11.580 1.00 0.00 H new ATOM 0 HD13 LEU A 478 1.962 -15.934 -10.084 1.00 0.00 H new ATOM 0 HD21 LEU A 478 4.397 -14.454 -11.134 1.00 0.00 H new ATOM 0 HD22 LEU A 478 4.463 -15.214 -9.526 1.00 0.00 H new ATOM 0 HD23 LEU A 478 5.693 -15.611 -10.748 1.00 0.00 H new ATOM 204 N HIS A 479 4.316 -20.213 -8.507 1.00 0.00 N ATOM 205 CA HIS A 479 4.820 -21.551 -8.266 1.00 0.00 C ATOM 206 C HIS A 479 3.652 -22.450 -7.930 1.00 0.00 C ATOM 207 O HIS A 479 3.594 -23.562 -8.424 1.00 0.00 O ATOM 208 CB HIS A 479 5.838 -21.557 -7.125 1.00 0.00 C ATOM 209 CG HIS A 479 6.559 -22.860 -6.961 1.00 0.00 C ATOM 210 ND1 HIS A 479 7.080 -23.305 -5.772 1.00 0.00 N ATOM 211 CD2 HIS A 479 6.873 -23.830 -7.868 1.00 0.00 C ATOM 212 CE1 HIS A 479 7.676 -24.472 -5.987 1.00 0.00 C ATOM 213 NE2 HIS A 479 7.572 -24.848 -7.246 1.00 0.00 N ATOM 0 H HIS A 479 4.688 -19.496 -7.884 1.00 0.00 H new ATOM 0 HA HIS A 479 5.327 -21.913 -9.161 1.00 0.00 H new ATOM 0 HB2 HIS A 479 6.569 -20.768 -7.300 1.00 0.00 H new ATOM 0 HB3 HIS A 479 5.326 -21.317 -6.193 1.00 0.00 H new ATOM 0 HD2 HIS A 479 6.614 -23.806 -8.916 1.00 0.00 H new ATOM 0 HE1 HIS A 479 8.184 -25.043 -5.224 1.00 0.00 H new ATOM 0 HE2 HIS A 479 7.930 -25.704 -7.670 1.00 0.00 H new ATOM 221 N SER A 480 2.717 -21.973 -7.112 1.00 0.00 N ATOM 222 CA SER A 480 1.567 -22.792 -6.729 1.00 0.00 C ATOM 223 C SER A 480 0.723 -23.148 -7.943 1.00 0.00 C ATOM 224 O SER A 480 0.254 -24.274 -8.059 1.00 0.00 O ATOM 225 CB SER A 480 0.706 -22.072 -5.693 1.00 0.00 C ATOM 226 OG SER A 480 1.459 -21.819 -4.519 1.00 0.00 O ATOM 0 H SER A 480 2.730 -21.037 -6.706 1.00 0.00 H new ATOM 0 HA SER A 480 1.951 -23.712 -6.288 1.00 0.00 H new ATOM 0 HB2 SER A 480 0.337 -21.133 -6.106 1.00 0.00 H new ATOM 0 HB3 SER A 480 -0.167 -22.679 -5.450 1.00 0.00 H new ATOM 0 HG SER A 480 1.826 -20.911 -4.555 1.00 0.00 H new ATOM 232 N GLU A 481 0.543 -22.211 -8.861 1.00 0.00 N ATOM 233 CA GLU A 481 -0.228 -22.493 -10.070 1.00 0.00 C ATOM 234 C GLU A 481 0.444 -23.552 -10.907 1.00 0.00 C ATOM 235 O GLU A 481 -0.236 -24.391 -11.481 1.00 0.00 O ATOM 236 CB GLU A 481 -0.367 -21.269 -10.954 1.00 0.00 C ATOM 237 CG GLU A 481 -1.076 -20.121 -10.362 1.00 0.00 C ATOM 238 CD GLU A 481 -2.517 -20.436 -9.994 1.00 0.00 C ATOM 239 OE1 GLU A 481 -2.779 -20.923 -8.874 1.00 0.00 O ATOM 240 OE2 GLU A 481 -3.401 -20.211 -10.836 1.00 0.00 O ATOM 0 H GLU A 481 0.912 -21.262 -8.798 1.00 0.00 H new ATOM 0 HA GLU A 481 -1.207 -22.824 -9.725 1.00 0.00 H new ATOM 0 HB2 GLU A 481 0.631 -20.942 -11.248 1.00 0.00 H new ATOM 0 HB3 GLU A 481 -0.888 -21.561 -11.866 1.00 0.00 H new ATOM 0 HG2 GLU A 481 -0.543 -19.793 -9.470 1.00 0.00 H new ATOM 0 HG3 GLU A 481 -1.061 -19.289 -11.066 1.00 0.00 H new ATOM 247 N ILE A 482 1.774 -23.537 -10.981 1.00 0.00 N ATOM 248 CA ILE A 482 2.470 -24.541 -11.761 1.00 0.00 C ATOM 249 C ILE A 482 2.114 -25.897 -11.165 1.00 0.00 C ATOM 250 O ILE A 482 1.849 -26.839 -11.876 1.00 0.00 O ATOM 251 CB ILE A 482 4.034 -24.369 -11.735 1.00 0.00 C ATOM 252 CG1 ILE A 482 4.449 -23.020 -12.346 1.00 0.00 C ATOM 253 CG2 ILE A 482 4.730 -25.496 -12.508 1.00 0.00 C ATOM 254 CD1 ILE A 482 5.934 -22.666 -12.129 1.00 0.00 C ATOM 0 H ILE A 482 2.374 -22.854 -10.519 1.00 0.00 H new ATOM 0 HA ILE A 482 2.162 -24.444 -12.802 1.00 0.00 H new ATOM 0 HB ILE A 482 4.342 -24.407 -10.690 1.00 0.00 H new ATOM 0 HG12 ILE A 482 4.243 -23.038 -13.416 1.00 0.00 H new ATOM 0 HG13 ILE A 482 3.831 -22.232 -11.916 1.00 0.00 H new ATOM 0 HG21 ILE A 482 5.809 -25.349 -12.472 1.00 0.00 H new ATOM 0 HG22 ILE A 482 4.479 -26.456 -12.057 1.00 0.00 H new ATOM 0 HG23 ILE A 482 4.397 -25.485 -13.546 1.00 0.00 H new ATOM 0 HD11 ILE A 482 6.149 -21.701 -12.588 1.00 0.00 H new ATOM 0 HD12 ILE A 482 6.143 -22.614 -11.061 1.00 0.00 H new ATOM 0 HD13 ILE A 482 6.561 -23.432 -12.584 1.00 0.00 H new ATOM 266 N LYS A 483 2.101 -25.985 -9.843 1.00 0.00 N ATOM 267 CA LYS A 483 1.781 -27.255 -9.165 1.00 0.00 C ATOM 268 C LYS A 483 0.346 -27.687 -9.434 1.00 0.00 C ATOM 269 O LYS A 483 0.086 -28.851 -9.719 1.00 0.00 O ATOM 270 CB LYS A 483 1.952 -27.152 -7.645 1.00 0.00 C ATOM 271 CG LYS A 483 3.242 -26.578 -7.185 1.00 0.00 C ATOM 272 CD LYS A 483 4.437 -27.389 -7.551 1.00 0.00 C ATOM 273 CE LYS A 483 5.388 -27.310 -6.389 1.00 0.00 C ATOM 274 NZ LYS A 483 6.704 -27.973 -6.647 1.00 0.00 N ATOM 0 H LYS A 483 2.304 -25.207 -9.215 1.00 0.00 H new ATOM 0 HA LYS A 483 2.479 -27.988 -9.569 1.00 0.00 H new ATOM 0 HB2 LYS A 483 1.141 -26.544 -7.246 1.00 0.00 H new ATOM 0 HB3 LYS A 483 1.844 -28.148 -7.216 1.00 0.00 H new ATOM 0 HG2 LYS A 483 3.353 -25.579 -7.606 1.00 0.00 H new ATOM 0 HG3 LYS A 483 3.211 -26.466 -6.101 1.00 0.00 H new ATOM 0 HD2 LYS A 483 4.156 -28.423 -7.751 1.00 0.00 H new ATOM 0 HD3 LYS A 483 4.902 -27.004 -8.458 1.00 0.00 H new ATOM 0 HE2 LYS A 483 5.560 -26.263 -6.142 1.00 0.00 H new ATOM 0 HE3 LYS A 483 4.923 -27.771 -5.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 7.334 -27.823 -5.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 6.557 -28.993 -6.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 7.137 -27.565 -7.500 1.00 0.00 H new ATOM 288 N PHE A 484 -0.581 -26.749 -9.333 1.00 0.00 N ATOM 289 CA PHE A 484 -2.001 -27.036 -9.527 1.00 0.00 C ATOM 290 C PHE A 484 -2.289 -27.437 -10.964 1.00 0.00 C ATOM 291 O PHE A 484 -3.188 -28.220 -11.225 1.00 0.00 O ATOM 292 CB PHE A 484 -2.833 -25.805 -9.167 1.00 0.00 C ATOM 293 CG PHE A 484 -2.734 -25.396 -7.713 1.00 0.00 C ATOM 294 CD1 PHE A 484 -2.609 -26.356 -6.681 1.00 0.00 C ATOM 295 CD2 PHE A 484 -2.778 -24.033 -7.366 1.00 0.00 C ATOM 296 CE1 PHE A 484 -2.518 -25.952 -5.323 1.00 0.00 C ATOM 297 CE2 PHE A 484 -2.693 -23.621 -6.016 1.00 0.00 C ATOM 298 CZ PHE A 484 -2.562 -24.582 -4.994 1.00 0.00 C ATOM 0 H PHE A 484 -0.378 -25.773 -9.116 1.00 0.00 H new ATOM 0 HA PHE A 484 -2.269 -27.868 -8.876 1.00 0.00 H new ATOM 0 HB2 PHE A 484 -2.515 -24.970 -9.791 1.00 0.00 H new ATOM 0 HB3 PHE A 484 -3.878 -26.003 -9.407 1.00 0.00 H new ATOM 0 HD1 PHE A 484 -2.583 -27.407 -6.929 1.00 0.00 H new ATOM 0 HD2 PHE A 484 -2.878 -23.290 -8.143 1.00 0.00 H new ATOM 0 HE1 PHE A 484 -2.415 -26.693 -4.544 1.00 0.00 H new ATOM 0 HE2 PHE A 484 -2.728 -22.570 -5.768 1.00 0.00 H new ATOM 0 HZ PHE A 484 -2.496 -24.270 -3.962 1.00 0.00 H new ATOM 308 N ALA A 485 -1.509 -26.907 -11.890 1.00 0.00 N ATOM 309 CA ALA A 485 -1.649 -27.223 -13.302 1.00 0.00 C ATOM 310 C ALA A 485 -1.274 -28.668 -13.617 1.00 0.00 C ATOM 311 O ALA A 485 -1.625 -29.183 -14.668 1.00 0.00 O ATOM 312 CB ALA A 485 -0.772 -26.302 -14.090 1.00 0.00 C ATOM 0 H ALA A 485 -0.760 -26.245 -11.685 1.00 0.00 H new ATOM 0 HA ALA A 485 -2.697 -27.094 -13.571 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -0.868 -26.529 -15.152 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -1.074 -25.270 -13.910 1.00 0.00 H new ATOM 0 HB3 ALA A 485 0.265 -26.435 -13.782 1.00 0.00 H new ATOM 318 N LEU A 486 -0.546 -29.308 -12.714 1.00 0.00 N ATOM 319 CA LEU A 486 -0.087 -30.684 -12.922 1.00 0.00 C ATOM 320 C LEU A 486 -0.839 -31.669 -12.043 1.00 0.00 C ATOM 321 O LEU A 486 -0.430 -32.823 -11.906 1.00 0.00 O ATOM 322 CB LEU A 486 1.409 -30.785 -12.644 1.00 0.00 C ATOM 323 CG LEU A 486 2.264 -29.731 -13.355 1.00 0.00 C ATOM 324 CD1 LEU A 486 3.700 -29.868 -12.857 1.00 0.00 C ATOM 325 CD2 LEU A 486 2.194 -29.788 -14.888 1.00 0.00 C ATOM 0 H LEU A 486 -0.257 -28.899 -11.825 1.00 0.00 H new ATOM 0 HA LEU A 486 -0.286 -30.943 -13.962 1.00 0.00 H new ATOM 0 HB2 LEU A 486 1.572 -30.701 -11.570 1.00 0.00 H new ATOM 0 HB3 LEU A 486 1.754 -31.775 -12.942 1.00 0.00 H new ATOM 0 HG LEU A 486 1.858 -28.751 -13.105 1.00 0.00 H new ATOM 0 HD11 LEU A 486 4.328 -29.126 -13.350 1.00 0.00 H new ATOM 0 HD12 LEU A 486 3.728 -29.708 -11.779 1.00 0.00 H new ATOM 0 HD13 LEU A 486 4.071 -30.867 -13.085 1.00 0.00 H new ATOM 0 HD21 LEU A 486 2.828 -29.008 -15.310 1.00 0.00 H new ATOM 0 HD22 LEU A 486 2.540 -30.763 -15.232 1.00 0.00 H new ATOM 0 HD23 LEU A 486 1.165 -29.633 -15.211 1.00 0.00 H new ATOM 337 N LYS A 487 -1.924 -31.204 -11.438 1.00 0.00 N ATOM 338 CA LYS A 487 -2.761 -32.054 -10.598 1.00 0.00 C ATOM 339 C LYS A 487 -3.202 -33.255 -11.369 1.00 0.00 C ATOM 340 O LYS A 487 -3.615 -33.166 -12.510 1.00 0.00 O ATOM 341 CB LYS A 487 -4.001 -31.292 -10.149 1.00 0.00 C ATOM 342 CG LYS A 487 -3.834 -30.555 -8.844 1.00 0.00 C ATOM 343 CD LYS A 487 -5.133 -29.862 -8.495 1.00 0.00 C ATOM 344 CE LYS A 487 -5.130 -29.362 -7.067 1.00 0.00 C ATOM 345 NZ LYS A 487 -6.505 -28.918 -6.667 1.00 0.00 N ATOM 0 H LYS A 487 -2.247 -30.239 -11.513 1.00 0.00 H new ATOM 0 HA LYS A 487 -2.177 -32.358 -9.729 1.00 0.00 H new ATOM 0 HB2 LYS A 487 -4.275 -30.577 -10.925 1.00 0.00 H new ATOM 0 HB3 LYS A 487 -4.830 -31.993 -10.054 1.00 0.00 H new ATOM 0 HG2 LYS A 487 -3.555 -31.251 -8.053 1.00 0.00 H new ATOM 0 HG3 LYS A 487 -3.029 -29.825 -8.925 1.00 0.00 H new ATOM 0 HD2 LYS A 487 -5.293 -29.025 -9.174 1.00 0.00 H new ATOM 0 HD3 LYS A 487 -5.964 -30.552 -8.638 1.00 0.00 H new ATOM 0 HE2 LYS A 487 -4.787 -30.152 -6.399 1.00 0.00 H new ATOM 0 HE3 LYS A 487 -4.429 -28.533 -6.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 487 -6.488 -28.577 -5.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 487 -6.818 -28.150 -7.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 487 -7.164 -29.718 -6.744 1.00 0.00 H new ATOM 359 N VAL A 488 -3.119 -34.388 -10.709 1.00 0.00 N ATOM 360 CA VAL A 488 -3.527 -35.646 -11.295 1.00 0.00 C ATOM 361 C VAL A 488 -5.026 -35.721 -11.368 1.00 0.00 C ATOM 362 O VAL A 488 -5.603 -36.462 -12.148 1.00 0.00 O ATOM 363 CB VAL A 488 -2.999 -36.818 -10.456 1.00 0.00 C ATOM 364 CG1 VAL A 488 -1.476 -36.951 -10.622 1.00 0.00 C ATOM 365 CG2 VAL A 488 -3.352 -36.658 -8.954 1.00 0.00 C ATOM 0 H VAL A 488 -2.768 -34.464 -9.754 1.00 0.00 H new ATOM 0 HA VAL A 488 -3.113 -35.709 -12.301 1.00 0.00 H new ATOM 0 HB VAL A 488 -3.485 -37.723 -10.820 1.00 0.00 H new ATOM 0 HG11 VAL A 488 -1.116 -37.786 -10.021 1.00 0.00 H new ATOM 0 HG12 VAL A 488 -1.239 -37.130 -11.671 1.00 0.00 H new ATOM 0 HG13 VAL A 488 -0.992 -36.032 -10.292 1.00 0.00 H new ATOM 0 HG21 VAL A 488 -2.960 -37.508 -8.396 1.00 0.00 H new ATOM 0 HG22 VAL A 488 -2.909 -35.738 -8.572 1.00 0.00 H new ATOM 0 HG23 VAL A 488 -4.435 -36.615 -8.837 1.00 0.00 H new ATOM 375 N ASP A 489 -5.638 -34.915 -10.532 1.00 0.00 N ATOM 376 CA ASP A 489 -7.066 -34.839 -10.415 1.00 0.00 C ATOM 377 C ASP A 489 -7.670 -34.014 -11.546 1.00 0.00 C ATOM 378 O ASP A 489 -8.798 -34.243 -11.968 1.00 0.00 O ATOM 379 CB ASP A 489 -7.368 -34.136 -9.105 1.00 0.00 C ATOM 380 CG ASP A 489 -6.284 -34.344 -8.058 1.00 0.00 C ATOM 381 OD1 ASP A 489 -6.384 -35.276 -7.245 1.00 0.00 O ATOM 382 OD2 ASP A 489 -5.314 -33.538 -8.055 1.00 0.00 O ATOM 0 H ASP A 489 -5.142 -34.283 -9.904 1.00 0.00 H new ATOM 0 HA ASP A 489 -7.488 -35.843 -10.457 1.00 0.00 H new ATOM 0 HB2 ASP A 489 -7.487 -33.068 -9.290 1.00 0.00 H new ATOM 0 HB3 ASP A 489 -8.318 -34.500 -8.714 1.00 0.00 H new ATOM 387 N SER A 490 -6.902 -33.034 -12.010 1.00 0.00 N ATOM 388 CA SER A 490 -7.358 -32.089 -13.032 1.00 0.00 C ATOM 389 C SER A 490 -6.189 -31.256 -13.567 1.00 0.00 C ATOM 390 O SER A 490 -5.963 -30.133 -13.097 1.00 0.00 O ATOM 391 CB SER A 490 -8.391 -31.129 -12.423 1.00 0.00 C ATOM 392 OG SER A 490 -8.827 -30.169 -13.372 1.00 0.00 O ATOM 0 H SER A 490 -5.947 -32.870 -11.691 1.00 0.00 H new ATOM 0 HA SER A 490 -7.798 -32.662 -13.848 1.00 0.00 H new ATOM 0 HB2 SER A 490 -9.247 -31.697 -12.058 1.00 0.00 H new ATOM 0 HB3 SER A 490 -7.955 -30.621 -11.563 1.00 0.00 H new ATOM 0 HG SER A 490 -9.485 -29.573 -12.956 1.00 0.00 H new ATOM 398 N PRO A 491 -5.425 -31.784 -14.539 1.00 0.00 N ATOM 399 CA PRO A 491 -4.351 -30.917 -15.038 1.00 0.00 C ATOM 400 C PRO A 491 -4.895 -29.753 -15.871 1.00 0.00 C ATOM 401 O PRO A 491 -5.907 -29.885 -16.558 1.00 0.00 O ATOM 402 CB PRO A 491 -3.504 -31.873 -15.881 1.00 0.00 C ATOM 403 CG PRO A 491 -4.476 -32.885 -16.373 1.00 0.00 C ATOM 404 CD PRO A 491 -5.439 -33.091 -15.226 1.00 0.00 C ATOM 0 HA PRO A 491 -3.787 -30.435 -14.239 1.00 0.00 H new ATOM 0 HB2 PRO A 491 -3.019 -31.352 -16.707 1.00 0.00 H new ATOM 0 HB3 PRO A 491 -2.715 -32.335 -15.288 1.00 0.00 H new ATOM 0 HG2 PRO A 491 -4.994 -32.534 -17.265 1.00 0.00 H new ATOM 0 HG3 PRO A 491 -3.976 -33.816 -16.641 1.00 0.00 H new ATOM 0 HD2 PRO A 491 -6.437 -33.350 -15.579 1.00 0.00 H new ATOM 0 HD3 PRO A 491 -5.115 -33.896 -14.567 1.00 0.00 H new ATOM 412 N ASP A 492 -4.229 -28.609 -15.798 1.00 0.00 N ATOM 413 CA ASP A 492 -4.655 -27.409 -16.524 1.00 0.00 C ATOM 414 C ASP A 492 -3.471 -26.695 -17.161 1.00 0.00 C ATOM 415 O ASP A 492 -2.739 -25.947 -16.514 1.00 0.00 O ATOM 416 CB ASP A 492 -5.402 -26.447 -15.601 1.00 0.00 C ATOM 417 CG ASP A 492 -5.997 -25.257 -16.359 1.00 0.00 C ATOM 418 OD1 ASP A 492 -5.685 -25.076 -17.565 1.00 0.00 O ATOM 419 OD2 ASP A 492 -6.768 -24.496 -15.747 1.00 0.00 O ATOM 0 H ASP A 492 -3.385 -28.481 -15.240 1.00 0.00 H new ATOM 0 HA ASP A 492 -5.329 -27.735 -17.316 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -6.200 -26.985 -15.089 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -4.720 -26.081 -14.833 1.00 0.00 H new ATOM 424 N VAL A 493 -3.291 -26.916 -18.447 1.00 0.00 N ATOM 425 CA VAL A 493 -2.197 -26.298 -19.182 1.00 0.00 C ATOM 426 C VAL A 493 -2.234 -24.791 -19.136 1.00 0.00 C ATOM 427 O VAL A 493 -1.210 -24.161 -18.916 1.00 0.00 O ATOM 428 CB VAL A 493 -2.199 -26.779 -20.645 1.00 0.00 C ATOM 429 CG1 VAL A 493 -3.629 -26.953 -21.206 1.00 0.00 C ATOM 430 CG2 VAL A 493 -1.367 -25.866 -21.577 1.00 0.00 C ATOM 0 H VAL A 493 -3.889 -27.521 -19.010 1.00 0.00 H new ATOM 0 HA VAL A 493 -1.275 -26.609 -18.690 1.00 0.00 H new ATOM 0 HB VAL A 493 -1.720 -27.758 -20.626 1.00 0.00 H new ATOM 0 HG11 VAL A 493 -3.575 -27.293 -22.240 1.00 0.00 H new ATOM 0 HG12 VAL A 493 -4.167 -27.689 -20.609 1.00 0.00 H new ATOM 0 HG13 VAL A 493 -4.155 -25.999 -21.165 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -1.405 -26.254 -22.595 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -1.777 -24.856 -21.558 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -0.332 -25.844 -21.235 1.00 0.00 H new ATOM 440 N LYS A 494 -3.406 -24.206 -19.322 1.00 0.00 N ATOM 441 CA LYS A 494 -3.544 -22.750 -19.343 1.00 0.00 C ATOM 442 C LYS A 494 -3.102 -22.187 -18.021 1.00 0.00 C ATOM 443 O LYS A 494 -2.576 -21.083 -17.954 1.00 0.00 O ATOM 444 CB LYS A 494 -4.991 -22.339 -19.599 1.00 0.00 C ATOM 445 CG LYS A 494 -5.418 -22.533 -21.030 1.00 0.00 C ATOM 446 CD LYS A 494 -6.875 -22.136 -21.214 1.00 0.00 C ATOM 447 CE LYS A 494 -7.330 -22.370 -22.649 1.00 0.00 C ATOM 448 NZ LYS A 494 -8.764 -21.958 -22.831 1.00 0.00 N ATOM 0 H LYS A 494 -4.280 -24.714 -19.461 1.00 0.00 H new ATOM 0 HA LYS A 494 -2.922 -22.360 -20.149 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -5.647 -22.918 -18.949 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -5.118 -21.291 -19.328 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -4.787 -21.935 -21.687 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -5.281 -23.575 -21.318 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -7.501 -22.712 -20.532 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -7.004 -21.085 -20.955 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -6.696 -21.805 -23.332 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -7.215 -23.423 -22.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -9.051 -22.127 -23.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -9.369 -22.515 -22.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -8.866 -20.947 -22.609 1.00 0.00 H new ATOM 462 N ARG A 495 -3.310 -22.952 -16.966 1.00 0.00 N ATOM 463 CA ARG A 495 -2.972 -22.465 -15.628 1.00 0.00 C ATOM 464 C ARG A 495 -1.466 -22.423 -15.477 1.00 0.00 C ATOM 465 O ARG A 495 -0.909 -21.467 -14.946 1.00 0.00 O ATOM 466 CB ARG A 495 -3.612 -23.338 -14.559 1.00 0.00 C ATOM 467 CG ARG A 495 -3.557 -22.741 -13.183 1.00 0.00 C ATOM 468 CD ARG A 495 -4.470 -23.488 -12.236 1.00 0.00 C ATOM 469 NE ARG A 495 -4.588 -22.748 -10.975 1.00 0.00 N ATOM 470 CZ ARG A 495 -5.398 -23.045 -9.972 1.00 0.00 C ATOM 471 NH1 ARG A 495 -6.232 -24.056 -10.017 1.00 0.00 N ATOM 472 NH2 ARG A 495 -5.368 -22.296 -8.908 1.00 0.00 N ATOM 0 H ARG A 495 -3.702 -23.893 -16.999 1.00 0.00 H new ATOM 0 HA ARG A 495 -3.366 -21.457 -15.500 1.00 0.00 H new ATOM 0 HB2 ARG A 495 -4.653 -23.520 -14.826 1.00 0.00 H new ATOM 0 HB3 ARG A 495 -3.112 -24.307 -14.546 1.00 0.00 H new ATOM 0 HG2 ARG A 495 -2.534 -22.772 -12.809 1.00 0.00 H new ATOM 0 HG3 ARG A 495 -3.849 -21.692 -13.225 1.00 0.00 H new ATOM 0 HD2 ARG A 495 -5.454 -23.614 -12.688 1.00 0.00 H new ATOM 0 HD3 ARG A 495 -4.076 -24.486 -12.047 1.00 0.00 H new ATOM 0 HE ARG A 495 -3.991 -21.929 -10.861 1.00 0.00 H new ATOM 0 HH11 ARG A 495 -6.273 -24.647 -10.847 1.00 0.00 H new ATOM 0 HH12 ARG A 495 -6.840 -24.251 -9.222 1.00 0.00 H new ATOM 0 HH21 ARG A 495 -4.730 -21.501 -8.861 1.00 0.00 H new ATOM 0 HH22 ARG A 495 -5.982 -22.504 -8.121 1.00 0.00 H new ATOM 486 N CYS A 496 -0.799 -23.454 -15.973 1.00 0.00 N ATOM 487 CA CYS A 496 0.655 -23.478 -15.951 1.00 0.00 C ATOM 488 C CYS A 496 1.161 -22.338 -16.826 1.00 0.00 C ATOM 489 O CYS A 496 2.012 -21.577 -16.401 1.00 0.00 O ATOM 490 CB CYS A 496 1.187 -24.817 -16.489 1.00 0.00 C ATOM 491 SG CYS A 496 2.587 -25.481 -15.558 1.00 0.00 S ATOM 0 H CYS A 496 -1.235 -24.276 -16.391 1.00 0.00 H new ATOM 0 HA CYS A 496 1.006 -23.362 -14.926 1.00 0.00 H new ATOM 0 HB2 CYS A 496 0.378 -25.548 -16.479 1.00 0.00 H new ATOM 0 HB3 CYS A 496 1.485 -24.686 -17.529 1.00 0.00 H new ATOM 0 HG CYS A 496 2.962 -26.609 -16.084 1.00 0.00 H new ATOM 497 N LEU A 497 0.627 -22.219 -18.038 1.00 0.00 N ATOM 498 CA LEU A 497 1.081 -21.207 -18.997 1.00 0.00 C ATOM 499 C LEU A 497 0.982 -19.801 -18.444 1.00 0.00 C ATOM 500 O LEU A 497 1.904 -19.013 -18.604 1.00 0.00 O ATOM 501 CB LEU A 497 0.259 -21.262 -20.297 1.00 0.00 C ATOM 502 CG LEU A 497 0.407 -22.488 -21.214 1.00 0.00 C ATOM 503 CD1 LEU A 497 -0.473 -22.332 -22.442 1.00 0.00 C ATOM 504 CD2 LEU A 497 1.808 -22.677 -21.655 1.00 0.00 C ATOM 0 H LEU A 497 -0.126 -22.814 -18.385 1.00 0.00 H new ATOM 0 HA LEU A 497 2.127 -21.440 -19.198 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -0.793 -21.177 -20.026 1.00 0.00 H new ATOM 0 HB3 LEU A 497 0.509 -20.378 -20.884 1.00 0.00 H new ATOM 0 HG LEU A 497 0.101 -23.361 -20.637 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -0.360 -23.206 -23.084 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -1.515 -22.240 -22.134 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -0.177 -21.438 -22.991 1.00 0.00 H new ATOM 0 HD21 LEU A 497 1.871 -23.553 -22.301 1.00 0.00 H new ATOM 0 HD22 LEU A 497 2.138 -21.796 -22.205 1.00 0.00 H new ATOM 0 HD23 LEU A 497 2.447 -22.822 -20.784 1.00 0.00 H new ATOM 516 N ASN A 498 -0.124 -19.491 -17.790 1.00 0.00 N ATOM 517 CA ASN A 498 -0.318 -18.160 -17.226 1.00 0.00 C ATOM 518 C ASN A 498 0.686 -17.878 -16.109 1.00 0.00 C ATOM 519 O ASN A 498 1.206 -16.775 -15.983 1.00 0.00 O ATOM 520 CB ASN A 498 -1.743 -18.036 -16.685 1.00 0.00 C ATOM 521 CG ASN A 498 -2.075 -16.624 -16.248 1.00 0.00 C ATOM 522 OD1 ASN A 498 -2.586 -16.413 -15.159 1.00 0.00 O ATOM 523 ND2 ASN A 498 -1.794 -15.660 -17.085 1.00 0.00 N ATOM 0 H ASN A 498 -0.899 -20.136 -17.635 1.00 0.00 H new ATOM 0 HA ASN A 498 -0.157 -17.427 -18.017 1.00 0.00 H new ATOM 0 HB2 ASN A 498 -2.449 -18.351 -17.454 1.00 0.00 H new ATOM 0 HB3 ASN A 498 -1.868 -18.714 -15.840 1.00 0.00 H new ATOM 0 HD21 ASN A 498 -2.002 -14.693 -16.837 1.00 0.00 H new ATOM 0 HD22 ASN A 498 -1.367 -15.875 -17.986 1.00 0.00 H new ATOM 530 N ALA A 499 0.970 -18.885 -15.301 1.00 0.00 N ATOM 531 CA ALA A 499 1.936 -18.730 -14.223 1.00 0.00 C ATOM 532 C ALA A 499 3.323 -18.528 -14.811 1.00 0.00 C ATOM 533 O ALA A 499 4.063 -17.630 -14.414 1.00 0.00 O ATOM 534 CB ALA A 499 1.917 -19.949 -13.359 1.00 0.00 C ATOM 0 H ALA A 499 0.550 -19.812 -15.368 1.00 0.00 H new ATOM 0 HA ALA A 499 1.676 -17.861 -13.619 1.00 0.00 H new ATOM 0 HB1 ALA A 499 2.640 -19.834 -12.551 1.00 0.00 H new ATOM 0 HB2 ALA A 499 0.920 -20.081 -12.938 1.00 0.00 H new ATOM 0 HB3 ALA A 499 2.177 -20.823 -13.957 1.00 0.00 H new ATOM 540 N LEU A 500 3.658 -19.374 -15.772 1.00 0.00 N ATOM 541 CA LEU A 500 4.909 -19.304 -16.464 1.00 0.00 C ATOM 542 C LEU A 500 5.101 -17.933 -17.115 1.00 0.00 C ATOM 543 O LEU A 500 6.185 -17.382 -17.046 1.00 0.00 O ATOM 544 CB LEU A 500 4.921 -20.414 -17.527 1.00 0.00 C ATOM 545 CG LEU A 500 5.413 -21.838 -17.187 1.00 0.00 C ATOM 546 CD1 LEU A 500 5.837 -22.102 -15.812 1.00 0.00 C ATOM 547 CD2 LEU A 500 4.495 -22.949 -17.694 1.00 0.00 C ATOM 0 H LEU A 500 3.053 -20.132 -16.088 1.00 0.00 H new ATOM 0 HA LEU A 500 5.730 -19.443 -15.761 1.00 0.00 H new ATOM 0 HB2 LEU A 500 3.901 -20.509 -17.900 1.00 0.00 H new ATOM 0 HB3 LEU A 500 5.531 -20.055 -18.356 1.00 0.00 H new ATOM 0 HG LEU A 500 6.341 -21.859 -17.759 1.00 0.00 H new ATOM 0 HD11 LEU A 500 6.156 -23.141 -15.723 1.00 0.00 H new ATOM 0 HD12 LEU A 500 6.667 -21.444 -15.555 1.00 0.00 H new ATOM 0 HD13 LEU A 500 5.004 -21.918 -15.133 1.00 0.00 H new ATOM 0 HD21 LEU A 500 4.909 -23.918 -17.416 1.00 0.00 H new ATOM 0 HD22 LEU A 500 3.506 -22.835 -17.249 1.00 0.00 H new ATOM 0 HD23 LEU A 500 4.414 -22.887 -18.779 1.00 0.00 H new ATOM 559 N GLU A 501 4.078 -17.365 -17.732 1.00 0.00 N ATOM 560 CA GLU A 501 4.252 -16.073 -18.401 1.00 0.00 C ATOM 561 C GLU A 501 4.632 -14.949 -17.424 1.00 0.00 C ATOM 562 O GLU A 501 5.468 -14.106 -17.762 1.00 0.00 O ATOM 563 CB GLU A 501 3.026 -15.724 -19.267 1.00 0.00 C ATOM 564 CG GLU A 501 2.021 -14.746 -18.670 1.00 0.00 C ATOM 565 CD GLU A 501 0.762 -14.647 -19.516 1.00 0.00 C ATOM 566 OE1 GLU A 501 -0.060 -15.593 -19.488 1.00 0.00 O ATOM 567 OE2 GLU A 501 0.597 -13.630 -20.218 1.00 0.00 O ATOM 0 H GLU A 501 3.139 -17.760 -17.788 1.00 0.00 H new ATOM 0 HA GLU A 501 5.102 -16.170 -19.077 1.00 0.00 H new ATOM 0 HB2 GLU A 501 3.383 -15.311 -20.211 1.00 0.00 H new ATOM 0 HB3 GLU A 501 2.501 -16.650 -19.502 1.00 0.00 H new ATOM 0 HG2 GLU A 501 1.758 -15.065 -17.662 1.00 0.00 H new ATOM 0 HG3 GLU A 501 2.479 -13.761 -18.583 1.00 0.00 H new ATOM 574 N GLU A 502 4.071 -14.934 -16.216 1.00 0.00 N ATOM 575 CA GLU A 502 4.448 -13.901 -15.246 1.00 0.00 C ATOM 576 C GLU A 502 5.872 -14.195 -14.776 1.00 0.00 C ATOM 577 O GLU A 502 6.716 -13.305 -14.696 1.00 0.00 O ATOM 578 CB GLU A 502 3.497 -13.870 -14.043 1.00 0.00 C ATOM 579 CG GLU A 502 3.317 -12.457 -13.450 1.00 0.00 C ATOM 580 CD GLU A 502 2.670 -12.444 -12.051 1.00 0.00 C ATOM 581 OE1 GLU A 502 1.494 -12.870 -11.894 1.00 0.00 O ATOM 582 OE2 GLU A 502 3.354 -11.989 -11.100 1.00 0.00 O ATOM 0 H GLU A 502 3.374 -15.603 -15.889 1.00 0.00 H new ATOM 0 HA GLU A 502 4.387 -12.924 -15.726 1.00 0.00 H new ATOM 0 HB2 GLU A 502 2.524 -14.257 -14.346 1.00 0.00 H new ATOM 0 HB3 GLU A 502 3.878 -14.537 -13.269 1.00 0.00 H new ATOM 0 HG2 GLU A 502 4.291 -11.971 -13.394 1.00 0.00 H new ATOM 0 HG3 GLU A 502 2.704 -11.864 -14.129 1.00 0.00 H new ATOM 589 N LEU A 503 6.145 -15.460 -14.491 1.00 0.00 N ATOM 590 CA LEU A 503 7.473 -15.894 -14.046 1.00 0.00 C ATOM 591 C LEU A 503 8.546 -15.503 -15.074 1.00 0.00 C ATOM 592 O LEU A 503 9.686 -15.192 -14.728 1.00 0.00 O ATOM 593 CB LEU A 503 7.452 -17.423 -13.869 1.00 0.00 C ATOM 594 CG LEU A 503 8.286 -18.105 -12.774 1.00 0.00 C ATOM 595 CD1 LEU A 503 9.769 -17.850 -12.902 1.00 0.00 C ATOM 596 CD2 LEU A 503 7.819 -17.675 -11.411 1.00 0.00 C ATOM 0 H LEU A 503 5.462 -16.214 -14.559 1.00 0.00 H new ATOM 0 HA LEU A 503 7.716 -15.407 -13.102 1.00 0.00 H new ATOM 0 HB2 LEU A 503 6.414 -17.711 -13.705 1.00 0.00 H new ATOM 0 HB3 LEU A 503 7.757 -17.859 -14.820 1.00 0.00 H new ATOM 0 HG LEU A 503 8.133 -19.176 -12.904 1.00 0.00 H new ATOM 0 HD11 LEU A 503 10.297 -18.361 -12.097 1.00 0.00 H new ATOM 0 HD12 LEU A 503 10.121 -18.226 -13.863 1.00 0.00 H new ATOM 0 HD13 LEU A 503 9.961 -16.779 -12.839 1.00 0.00 H new ATOM 0 HD21 LEU A 503 8.421 -18.168 -10.648 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.924 -16.594 -11.314 1.00 0.00 H new ATOM 0 HD23 LEU A 503 6.772 -17.950 -11.281 1.00 0.00 H new ATOM 608 N GLY A 504 8.166 -15.508 -16.342 1.00 0.00 N ATOM 609 CA GLY A 504 9.077 -15.163 -17.418 1.00 0.00 C ATOM 610 C GLY A 504 9.532 -13.718 -17.425 1.00 0.00 C ATOM 611 O GLY A 504 10.535 -13.404 -18.081 1.00 0.00 O ATOM 0 H GLY A 504 7.224 -15.750 -16.651 1.00 0.00 H new ATOM 0 HA2 GLY A 504 9.955 -15.806 -17.352 1.00 0.00 H new ATOM 0 HA3 GLY A 504 8.593 -15.382 -18.370 1.00 0.00 H new ATOM 615 N THR A 505 8.836 -12.839 -16.715 1.00 0.00 N ATOM 616 CA THR A 505 9.201 -11.419 -16.668 1.00 0.00 C ATOM 617 C THR A 505 9.661 -11.009 -15.260 1.00 0.00 C ATOM 618 O THR A 505 10.288 -9.967 -15.079 1.00 0.00 O ATOM 619 CB THR A 505 8.035 -10.518 -17.196 1.00 0.00 C ATOM 620 OG1 THR A 505 8.498 -9.178 -17.366 1.00 0.00 O ATOM 621 CG2 THR A 505 6.830 -10.503 -16.271 1.00 0.00 C ATOM 0 H THR A 505 8.014 -13.080 -16.161 1.00 0.00 H new ATOM 0 HA THR A 505 10.049 -11.266 -17.336 1.00 0.00 H new ATOM 0 HB THR A 505 7.718 -10.946 -18.147 1.00 0.00 H new ATOM 0 HG1 THR A 505 9.191 -8.984 -16.700 1.00 0.00 H new ATOM 0 HG21 THR A 505 6.056 -9.861 -16.692 1.00 0.00 H new ATOM 0 HG22 THR A 505 6.442 -11.516 -16.163 1.00 0.00 H new ATOM 0 HG23 THR A 505 7.126 -10.121 -15.294 1.00 0.00 H new ATOM 629 N LEU A 506 9.375 -11.840 -14.264 1.00 0.00 N ATOM 630 CA LEU A 506 9.773 -11.547 -12.885 1.00 0.00 C ATOM 631 C LEU A 506 11.302 -11.537 -12.749 1.00 0.00 C ATOM 632 O LEU A 506 11.998 -12.318 -13.403 1.00 0.00 O ATOM 633 CB LEU A 506 9.200 -12.600 -11.925 1.00 0.00 C ATOM 634 CG LEU A 506 7.682 -12.705 -11.661 1.00 0.00 C ATOM 635 CD1 LEU A 506 7.441 -13.096 -10.208 1.00 0.00 C ATOM 636 CD2 LEU A 506 6.906 -11.432 -11.965 1.00 0.00 C ATOM 0 H LEU A 506 8.871 -12.719 -14.381 1.00 0.00 H new ATOM 0 HA LEU A 506 9.380 -10.563 -12.630 1.00 0.00 H new ATOM 0 HB2 LEU A 506 9.527 -13.574 -12.290 1.00 0.00 H new ATOM 0 HB3 LEU A 506 9.680 -12.444 -10.959 1.00 0.00 H new ATOM 0 HG LEU A 506 7.312 -13.467 -12.346 1.00 0.00 H new ATOM 0 HD11 LEU A 506 6.369 -13.169 -10.024 1.00 0.00 H new ATOM 0 HD12 LEU A 506 7.910 -14.059 -10.008 1.00 0.00 H new ATOM 0 HD13 LEU A 506 7.871 -12.339 -9.552 1.00 0.00 H new ATOM 0 HD21 LEU A 506 5.849 -11.591 -11.753 1.00 0.00 H new ATOM 0 HD22 LEU A 506 7.283 -10.619 -11.344 1.00 0.00 H new ATOM 0 HD23 LEU A 506 7.030 -11.173 -13.016 1.00 0.00 H new ATOM 648 N GLN A 507 11.832 -10.669 -11.892 1.00 0.00 N ATOM 649 CA GLN A 507 13.281 -10.618 -11.669 1.00 0.00 C ATOM 650 C GLN A 507 13.694 -11.740 -10.723 1.00 0.00 C ATOM 651 O GLN A 507 13.846 -11.566 -9.529 1.00 0.00 O ATOM 652 CB GLN A 507 13.674 -9.284 -11.039 1.00 0.00 C ATOM 653 CG GLN A 507 15.134 -8.898 -11.260 1.00 0.00 C ATOM 654 CD GLN A 507 15.459 -7.539 -10.667 1.00 0.00 C ATOM 655 OE1 GLN A 507 14.637 -6.929 -10.010 1.00 0.00 O ATOM 656 NE2 GLN A 507 16.653 -7.062 -10.907 1.00 0.00 N ATOM 0 H GLN A 507 11.292 -9.998 -11.345 1.00 0.00 H new ATOM 0 HA GLN A 507 13.782 -10.730 -12.630 1.00 0.00 H new ATOM 0 HB2 GLN A 507 13.036 -8.500 -11.447 1.00 0.00 H new ATOM 0 HB3 GLN A 507 13.479 -9.329 -9.967 1.00 0.00 H new ATOM 0 HG2 GLN A 507 15.780 -9.653 -10.812 1.00 0.00 H new ATOM 0 HG3 GLN A 507 15.349 -8.888 -12.329 1.00 0.00 H new ATOM 0 HE21 GLN A 507 17.316 -7.603 -11.462 1.00 0.00 H new ATOM 0 HE22 GLN A 507 16.921 -6.149 -10.539 1.00 0.00 H new ATOM 665 N VAL A 508 13.902 -12.903 -11.279 1.00 0.00 N ATOM 666 CA VAL A 508 14.273 -14.069 -10.500 1.00 0.00 C ATOM 667 C VAL A 508 15.794 -14.212 -10.549 1.00 0.00 C ATOM 668 O VAL A 508 16.359 -15.261 -10.817 1.00 0.00 O ATOM 669 CB VAL A 508 13.562 -15.270 -11.052 1.00 0.00 C ATOM 670 CG1 VAL A 508 12.039 -15.126 -10.899 1.00 0.00 C ATOM 671 CG2 VAL A 508 13.941 -15.459 -12.515 1.00 0.00 C ATOM 0 H VAL A 508 13.821 -13.076 -12.281 1.00 0.00 H new ATOM 0 HA VAL A 508 13.977 -13.969 -9.456 1.00 0.00 H new ATOM 0 HB VAL A 508 13.869 -16.151 -10.488 1.00 0.00 H new ATOM 0 HG11 VAL A 508 11.547 -16.009 -11.307 1.00 0.00 H new ATOM 0 HG12 VAL A 508 11.787 -15.025 -9.843 1.00 0.00 H new ATOM 0 HG13 VAL A 508 11.701 -14.241 -11.438 1.00 0.00 H new ATOM 0 HG21 VAL A 508 13.424 -16.331 -12.915 1.00 0.00 H new ATOM 0 HG22 VAL A 508 13.653 -14.574 -13.083 1.00 0.00 H new ATOM 0 HG23 VAL A 508 15.018 -15.607 -12.596 1.00 0.00 H new ATOM 681 N THR A 509 16.448 -13.101 -10.297 1.00 0.00 N ATOM 682 CA THR A 509 17.900 -13.030 -10.333 1.00 0.00 C ATOM 683 C THR A 509 18.412 -13.859 -9.165 1.00 0.00 C ATOM 684 O THR A 509 17.610 -14.320 -8.358 1.00 0.00 O ATOM 685 CB THR A 509 18.396 -11.559 -10.282 1.00 0.00 C ATOM 686 OG1 THR A 509 19.814 -11.522 -10.454 1.00 0.00 O ATOM 687 CG2 THR A 509 18.037 -10.879 -8.963 1.00 0.00 C ATOM 0 H THR A 509 15.993 -12.219 -10.061 1.00 0.00 H new ATOM 0 HA THR A 509 18.289 -13.431 -11.269 1.00 0.00 H new ATOM 0 HB THR A 509 17.899 -11.019 -11.088 1.00 0.00 H new ATOM 0 HG1 THR A 509 20.123 -10.593 -10.423 1.00 0.00 H new ATOM 0 HG21 THR A 509 18.403 -9.852 -8.971 1.00 0.00 H new ATOM 0 HG22 THR A 509 16.954 -10.877 -8.838 1.00 0.00 H new ATOM 0 HG23 THR A 509 18.497 -11.421 -8.137 1.00 0.00 H new ATOM 695 N SER A 510 19.719 -14.063 -9.071 1.00 0.00 N ATOM 696 CA SER A 510 20.302 -14.957 -8.066 1.00 0.00 C ATOM 697 C SER A 510 19.798 -14.715 -6.646 1.00 0.00 C ATOM 698 O SER A 510 19.675 -15.650 -5.876 1.00 0.00 O ATOM 699 CB SER A 510 21.821 -14.826 -8.101 1.00 0.00 C ATOM 700 OG SER A 510 22.280 -14.971 -9.434 1.00 0.00 O ATOM 0 H SER A 510 20.405 -13.620 -9.682 1.00 0.00 H new ATOM 0 HA SER A 510 19.985 -15.966 -8.328 1.00 0.00 H new ATOM 0 HB2 SER A 510 22.122 -13.856 -7.706 1.00 0.00 H new ATOM 0 HB3 SER A 510 22.276 -15.585 -7.464 1.00 0.00 H new ATOM 0 HG SER A 510 23.256 -14.885 -9.455 1.00 0.00 H new ATOM 706 N GLN A 511 19.469 -13.474 -6.319 1.00 0.00 N ATOM 707 CA GLN A 511 18.915 -13.138 -5.009 1.00 0.00 C ATOM 708 C GLN A 511 17.659 -13.964 -4.693 1.00 0.00 C ATOM 709 O GLN A 511 17.505 -14.462 -3.590 1.00 0.00 O ATOM 710 CB GLN A 511 18.541 -11.654 -5.009 1.00 0.00 C ATOM 711 CG GLN A 511 18.033 -11.117 -3.673 1.00 0.00 C ATOM 712 CD GLN A 511 17.555 -9.681 -3.784 1.00 0.00 C ATOM 713 OE1 GLN A 511 17.300 -9.183 -4.869 1.00 0.00 O ATOM 714 NE2 GLN A 511 17.422 -9.019 -2.666 1.00 0.00 N ATOM 0 H GLN A 511 19.576 -12.676 -6.945 1.00 0.00 H new ATOM 0 HA GLN A 511 19.665 -13.360 -4.250 1.00 0.00 H new ATOM 0 HB2 GLN A 511 19.414 -11.075 -5.308 1.00 0.00 H new ATOM 0 HB3 GLN A 511 17.774 -11.488 -5.766 1.00 0.00 H new ATOM 0 HG2 GLN A 511 17.216 -11.745 -3.317 1.00 0.00 H new ATOM 0 HG3 GLN A 511 18.829 -11.178 -2.931 1.00 0.00 H new ATOM 0 HE21 GLN A 511 17.645 -9.468 -1.778 1.00 0.00 H new ATOM 0 HE22 GLN A 511 17.095 -8.053 -2.681 1.00 0.00 H new ATOM 723 N ILE A 512 16.765 -14.089 -5.666 1.00 0.00 N ATOM 724 CA ILE A 512 15.518 -14.831 -5.506 1.00 0.00 C ATOM 725 C ILE A 512 15.756 -16.286 -5.867 1.00 0.00 C ATOM 726 O ILE A 512 15.279 -17.195 -5.211 1.00 0.00 O ATOM 727 CB ILE A 512 14.361 -14.230 -6.379 1.00 0.00 C ATOM 728 CG1 ILE A 512 13.991 -12.840 -5.849 1.00 0.00 C ATOM 729 CG2 ILE A 512 13.113 -15.122 -6.320 1.00 0.00 C ATOM 730 CD1 ILE A 512 14.806 -11.724 -6.472 1.00 0.00 C ATOM 0 H ILE A 512 16.884 -13.678 -6.592 1.00 0.00 H new ATOM 0 HA ILE A 512 15.203 -14.754 -4.465 1.00 0.00 H new ATOM 0 HB ILE A 512 14.708 -14.167 -7.410 1.00 0.00 H new ATOM 0 HG12 ILE A 512 12.933 -12.657 -6.037 1.00 0.00 H new ATOM 0 HG13 ILE A 512 14.130 -12.822 -4.768 1.00 0.00 H new ATOM 0 HG21 ILE A 512 12.324 -14.685 -6.933 1.00 0.00 H new ATOM 0 HG22 ILE A 512 13.357 -16.115 -6.697 1.00 0.00 H new ATOM 0 HG23 ILE A 512 12.770 -15.200 -5.288 1.00 0.00 H new ATOM 0 HD11 ILE A 512 14.494 -10.768 -6.053 1.00 0.00 H new ATOM 0 HD12 ILE A 512 15.863 -11.884 -6.261 1.00 0.00 H new ATOM 0 HD13 ILE A 512 14.648 -11.716 -7.550 1.00 0.00 H new ATOM 742 N LEU A 513 16.497 -16.506 -6.934 1.00 0.00 N ATOM 743 CA LEU A 513 16.723 -17.844 -7.442 1.00 0.00 C ATOM 744 C LEU A 513 17.344 -18.777 -6.425 1.00 0.00 C ATOM 745 O LEU A 513 16.974 -19.945 -6.339 1.00 0.00 O ATOM 746 CB LEU A 513 17.657 -17.780 -8.655 1.00 0.00 C ATOM 747 CG LEU A 513 17.186 -18.248 -10.046 1.00 0.00 C ATOM 748 CD1 LEU A 513 17.858 -19.570 -10.367 1.00 0.00 C ATOM 749 CD2 LEU A 513 15.676 -18.376 -10.187 1.00 0.00 C ATOM 0 H LEU A 513 16.956 -15.769 -7.470 1.00 0.00 H new ATOM 0 HA LEU A 513 15.742 -18.240 -7.704 1.00 0.00 H new ATOM 0 HB2 LEU A 513 17.975 -16.743 -8.758 1.00 0.00 H new ATOM 0 HB3 LEU A 513 18.544 -18.362 -8.406 1.00 0.00 H new ATOM 0 HG LEU A 513 17.475 -17.474 -10.757 1.00 0.00 H new ATOM 0 HD11 LEU A 513 17.534 -19.914 -11.349 1.00 0.00 H new ATOM 0 HD12 LEU A 513 18.940 -19.437 -10.368 1.00 0.00 H new ATOM 0 HD13 LEU A 513 17.584 -20.310 -9.615 1.00 0.00 H new ATOM 0 HD21 LEU A 513 15.432 -18.710 -11.195 1.00 0.00 H new ATOM 0 HD22 LEU A 513 15.303 -19.102 -9.464 1.00 0.00 H new ATOM 0 HD23 LEU A 513 15.210 -17.408 -10.002 1.00 0.00 H new ATOM 761 N GLN A 514 18.294 -18.266 -5.660 1.00 0.00 N ATOM 762 CA GLN A 514 19.000 -19.093 -4.682 1.00 0.00 C ATOM 763 C GLN A 514 18.084 -19.481 -3.526 1.00 0.00 C ATOM 764 O GLN A 514 18.224 -20.558 -2.958 1.00 0.00 O ATOM 765 CB GLN A 514 20.228 -18.351 -4.164 1.00 0.00 C ATOM 766 CG GLN A 514 21.367 -18.296 -5.187 1.00 0.00 C ATOM 767 CD GLN A 514 22.538 -17.453 -4.718 1.00 0.00 C ATOM 768 OE1 GLN A 514 22.449 -16.732 -3.744 1.00 0.00 O ATOM 769 NE2 GLN A 514 23.636 -17.540 -5.422 1.00 0.00 N ATOM 0 H GLN A 514 18.596 -17.292 -5.692 1.00 0.00 H new ATOM 0 HA GLN A 514 19.320 -20.011 -5.175 1.00 0.00 H new ATOM 0 HB2 GLN A 514 19.944 -17.335 -3.890 1.00 0.00 H new ATOM 0 HB3 GLN A 514 20.585 -18.838 -3.257 1.00 0.00 H new ATOM 0 HG2 GLN A 514 21.714 -19.309 -5.393 1.00 0.00 H new ATOM 0 HG3 GLN A 514 20.987 -17.892 -6.125 1.00 0.00 H new ATOM 0 HE21 GLN A 514 23.674 -18.156 -6.234 1.00 0.00 H new ATOM 0 HE22 GLN A 514 24.455 -16.992 -5.159 1.00 0.00 H new ATOM 778 N LYS A 515 17.132 -18.619 -3.188 1.00 0.00 N ATOM 779 CA LYS A 515 16.180 -18.926 -2.110 1.00 0.00 C ATOM 780 C LYS A 515 14.950 -19.657 -2.649 1.00 0.00 C ATOM 781 O LYS A 515 14.096 -20.084 -1.884 1.00 0.00 O ATOM 782 CB LYS A 515 15.769 -17.650 -1.348 1.00 0.00 C ATOM 783 CG LYS A 515 15.274 -16.492 -2.224 1.00 0.00 C ATOM 784 CD LYS A 515 14.969 -15.216 -1.426 1.00 0.00 C ATOM 785 CE LYS A 515 13.778 -15.380 -0.479 1.00 0.00 C ATOM 786 NZ LYS A 515 13.536 -14.118 0.298 1.00 0.00 N ATOM 0 H LYS A 515 16.994 -17.712 -3.634 1.00 0.00 H new ATOM 0 HA LYS A 515 16.684 -19.590 -1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 515 14.983 -17.908 -0.638 1.00 0.00 H new ATOM 0 HB3 LYS A 515 16.623 -17.304 -0.766 1.00 0.00 H new ATOM 0 HG2 LYS A 515 16.027 -16.269 -2.979 1.00 0.00 H new ATOM 0 HG3 LYS A 515 14.374 -16.805 -2.754 1.00 0.00 H new ATOM 0 HD2 LYS A 515 15.850 -14.934 -0.849 1.00 0.00 H new ATOM 0 HD3 LYS A 515 14.767 -14.399 -2.119 1.00 0.00 H new ATOM 0 HE2 LYS A 515 12.886 -15.637 -1.050 1.00 0.00 H new ATOM 0 HE3 LYS A 515 13.965 -16.205 0.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 515 12.532 -14.061 0.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 515 14.122 -14.121 1.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 515 13.785 -13.296 -0.288 1.00 0.00 H new ATOM 800 N ASN A 516 14.865 -19.808 -3.964 1.00 0.00 N ATOM 801 CA ASN A 516 13.731 -20.484 -4.597 1.00 0.00 C ATOM 802 C ASN A 516 14.182 -21.582 -5.577 1.00 0.00 C ATOM 803 O ASN A 516 13.661 -21.706 -6.688 1.00 0.00 O ATOM 804 CB ASN A 516 12.849 -19.439 -5.308 1.00 0.00 C ATOM 805 CG ASN A 516 12.013 -18.617 -4.338 1.00 0.00 C ATOM 806 OD1 ASN A 516 11.892 -17.419 -4.478 1.00 0.00 O ATOM 807 ND2 ASN A 516 11.425 -19.263 -3.366 1.00 0.00 N ATOM 0 H ASN A 516 15.570 -19.471 -4.620 1.00 0.00 H new ATOM 0 HA ASN A 516 13.152 -20.982 -3.819 1.00 0.00 H new ATOM 0 HB2 ASN A 516 13.483 -18.771 -5.891 1.00 0.00 H new ATOM 0 HB3 ASN A 516 12.188 -19.946 -6.011 1.00 0.00 H new ATOM 0 HD21 ASN A 516 10.843 -18.759 -2.697 1.00 0.00 H new ATOM 0 HD22 ASN A 516 11.548 -20.272 -3.277 1.00 0.00 H new ATOM 814 N THR A 517 15.141 -22.395 -5.167 1.00 0.00 N ATOM 815 CA THR A 517 15.655 -23.467 -6.026 1.00 0.00 C ATOM 816 C THR A 517 14.605 -24.545 -6.335 1.00 0.00 C ATOM 817 O THR A 517 14.669 -25.191 -7.381 1.00 0.00 O ATOM 818 CB THR A 517 16.867 -24.145 -5.370 1.00 0.00 C ATOM 819 OG1 THR A 517 16.528 -24.496 -4.028 1.00 0.00 O ATOM 820 CG2 THR A 517 18.056 -23.202 -5.325 1.00 0.00 C ATOM 0 H THR A 517 15.583 -22.340 -4.249 1.00 0.00 H new ATOM 0 HA THR A 517 15.938 -22.990 -6.964 1.00 0.00 H new ATOM 0 HB THR A 517 17.130 -25.026 -5.955 1.00 0.00 H new ATOM 0 HG1 THR A 517 17.295 -24.931 -3.600 1.00 0.00 H new ATOM 0 HG21 THR A 517 18.902 -23.705 -4.856 1.00 0.00 H new ATOM 0 HG22 THR A 517 18.326 -22.908 -6.339 1.00 0.00 H new ATOM 0 HG23 THR A 517 17.795 -22.315 -4.747 1.00 0.00 H new ATOM 828 N ASP A 518 13.630 -24.730 -5.454 1.00 0.00 N ATOM 829 CA ASP A 518 12.546 -25.704 -5.675 1.00 0.00 C ATOM 830 C ASP A 518 11.697 -25.347 -6.888 1.00 0.00 C ATOM 831 O ASP A 518 11.101 -26.209 -7.546 1.00 0.00 O ATOM 832 CB ASP A 518 11.629 -25.745 -4.461 1.00 0.00 C ATOM 833 CG ASP A 518 12.306 -26.333 -3.260 1.00 0.00 C ATOM 834 OD1 ASP A 518 12.332 -27.574 -3.144 1.00 0.00 O ATOM 835 OD2 ASP A 518 12.820 -25.554 -2.438 1.00 0.00 O ATOM 0 H ASP A 518 13.560 -24.220 -4.573 1.00 0.00 H new ATOM 0 HA ASP A 518 13.019 -26.671 -5.843 1.00 0.00 H new ATOM 0 HB2 ASP A 518 11.292 -24.735 -4.228 1.00 0.00 H new ATOM 0 HB3 ASP A 518 10.741 -26.330 -4.698 1.00 0.00 H new ATOM 840 N VAL A 519 11.650 -24.064 -7.194 1.00 0.00 N ATOM 841 CA VAL A 519 10.888 -23.575 -8.331 1.00 0.00 C ATOM 842 C VAL A 519 11.615 -24.024 -9.579 1.00 0.00 C ATOM 843 O VAL A 519 11.018 -24.547 -10.513 1.00 0.00 O ATOM 844 CB VAL A 519 10.798 -22.039 -8.291 1.00 0.00 C ATOM 845 CG1 VAL A 519 9.959 -21.491 -9.447 1.00 0.00 C ATOM 846 CG2 VAL A 519 10.213 -21.596 -6.954 1.00 0.00 C ATOM 0 H VAL A 519 12.134 -23.336 -6.668 1.00 0.00 H new ATOM 0 HA VAL A 519 9.871 -23.967 -8.313 1.00 0.00 H new ATOM 0 HB VAL A 519 11.805 -21.636 -8.401 1.00 0.00 H new ATOM 0 HG11 VAL A 519 9.919 -20.404 -9.384 1.00 0.00 H new ATOM 0 HG12 VAL A 519 10.411 -21.783 -10.395 1.00 0.00 H new ATOM 0 HG13 VAL A 519 8.949 -21.895 -9.387 1.00 0.00 H new ATOM 0 HG21 VAL A 519 10.150 -20.508 -6.927 1.00 0.00 H new ATOM 0 HG22 VAL A 519 9.216 -22.020 -6.834 1.00 0.00 H new ATOM 0 HG23 VAL A 519 10.854 -21.942 -6.144 1.00 0.00 H new ATOM 856 N VAL A 520 12.925 -23.842 -9.577 1.00 0.00 N ATOM 857 CA VAL A 520 13.764 -24.243 -10.700 1.00 0.00 C ATOM 858 C VAL A 520 13.677 -25.760 -10.846 1.00 0.00 C ATOM 859 O VAL A 520 13.649 -26.297 -11.957 1.00 0.00 O ATOM 860 CB VAL A 520 15.235 -23.787 -10.475 1.00 0.00 C ATOM 861 CG1 VAL A 520 16.108 -24.128 -11.683 1.00 0.00 C ATOM 862 CG2 VAL A 520 15.284 -22.271 -10.217 1.00 0.00 C ATOM 0 H VAL A 520 13.436 -23.416 -8.804 1.00 0.00 H new ATOM 0 HA VAL A 520 13.414 -23.767 -11.616 1.00 0.00 H new ATOM 0 HB VAL A 520 15.623 -24.319 -9.606 1.00 0.00 H new ATOM 0 HG11 VAL A 520 17.130 -23.798 -11.498 1.00 0.00 H new ATOM 0 HG12 VAL A 520 16.099 -25.206 -11.846 1.00 0.00 H new ATOM 0 HG13 VAL A 520 15.718 -23.624 -12.567 1.00 0.00 H new ATOM 0 HG21 VAL A 520 16.317 -21.962 -10.061 1.00 0.00 H new ATOM 0 HG22 VAL A 520 14.873 -21.742 -11.077 1.00 0.00 H new ATOM 0 HG23 VAL A 520 14.696 -22.034 -9.330 1.00 0.00 H new ATOM 872 N ALA A 521 13.607 -26.456 -9.720 1.00 0.00 N ATOM 873 CA ALA A 521 13.465 -27.901 -9.726 1.00 0.00 C ATOM 874 C ALA A 521 12.151 -28.317 -10.393 1.00 0.00 C ATOM 875 O ALA A 521 12.116 -29.330 -11.089 1.00 0.00 O ATOM 876 CB ALA A 521 13.550 -28.453 -8.296 1.00 0.00 C ATOM 0 H ALA A 521 13.647 -26.040 -8.790 1.00 0.00 H new ATOM 0 HA ALA A 521 14.284 -28.324 -10.307 1.00 0.00 H new ATOM 0 HB1 ALA A 521 13.442 -29.537 -8.318 1.00 0.00 H new ATOM 0 HB2 ALA A 521 14.516 -28.193 -7.863 1.00 0.00 H new ATOM 0 HB3 ALA A 521 12.753 -28.021 -7.691 1.00 0.00 H new ATOM 882 N THR A 522 11.082 -27.552 -10.204 1.00 0.00 N ATOM 883 CA THR A 522 9.807 -27.889 -10.822 1.00 0.00 C ATOM 884 C THR A 522 9.823 -27.536 -12.296 1.00 0.00 C ATOM 885 O THR A 522 9.332 -28.293 -13.117 1.00 0.00 O ATOM 886 CB THR A 522 8.642 -27.163 -10.146 1.00 0.00 C ATOM 887 OG1 THR A 522 8.648 -27.471 -8.748 1.00 0.00 O ATOM 888 CG2 THR A 522 7.323 -27.620 -10.746 1.00 0.00 C ATOM 0 H THR A 522 11.072 -26.705 -9.635 1.00 0.00 H new ATOM 0 HA THR A 522 9.664 -28.963 -10.700 1.00 0.00 H new ATOM 0 HB THR A 522 8.753 -26.089 -10.298 1.00 0.00 H new ATOM 0 HG1 THR A 522 9.431 -27.060 -8.326 1.00 0.00 H new ATOM 0 HG21 THR A 522 6.501 -27.097 -10.258 1.00 0.00 H new ATOM 0 HG22 THR A 522 7.312 -27.397 -11.813 1.00 0.00 H new ATOM 0 HG23 THR A 522 7.209 -28.694 -10.598 1.00 0.00 H new ATOM 896 N LEU A 523 10.403 -26.400 -12.640 1.00 0.00 N ATOM 897 CA LEU A 523 10.494 -25.979 -14.038 1.00 0.00 C ATOM 898 C LEU A 523 11.228 -27.024 -14.881 1.00 0.00 C ATOM 899 O LEU A 523 10.882 -27.264 -16.034 1.00 0.00 O ATOM 900 CB LEU A 523 11.188 -24.627 -14.128 1.00 0.00 C ATOM 901 CG LEU A 523 10.365 -23.470 -13.539 1.00 0.00 C ATOM 902 CD1 LEU A 523 11.259 -22.299 -13.330 1.00 0.00 C ATOM 903 CD2 LEU A 523 9.210 -23.062 -14.430 1.00 0.00 C ATOM 0 H LEU A 523 10.820 -25.748 -11.975 1.00 0.00 H new ATOM 0 HA LEU A 523 9.484 -25.883 -14.438 1.00 0.00 H new ATOM 0 HB2 LEU A 523 12.144 -24.684 -13.607 1.00 0.00 H new ATOM 0 HB3 LEU A 523 11.407 -24.410 -15.173 1.00 0.00 H new ATOM 0 HG LEU A 523 9.941 -23.815 -12.596 1.00 0.00 H new ATOM 0 HD11 LEU A 523 10.684 -21.472 -12.912 1.00 0.00 H new ATOM 0 HD12 LEU A 523 12.059 -22.570 -12.641 1.00 0.00 H new ATOM 0 HD13 LEU A 523 11.690 -21.995 -14.284 1.00 0.00 H new ATOM 0 HD21 LEU A 523 8.664 -22.241 -13.965 1.00 0.00 H new ATOM 0 HD22 LEU A 523 9.593 -22.740 -15.398 1.00 0.00 H new ATOM 0 HD23 LEU A 523 8.540 -23.911 -14.569 1.00 0.00 H new ATOM 915 N LYS A 524 12.222 -27.679 -14.297 1.00 0.00 N ATOM 916 CA LYS A 524 12.924 -28.764 -14.994 1.00 0.00 C ATOM 917 C LYS A 524 11.984 -29.944 -15.288 1.00 0.00 C ATOM 918 O LYS A 524 12.179 -30.655 -16.272 1.00 0.00 O ATOM 919 CB LYS A 524 14.144 -29.229 -14.183 1.00 0.00 C ATOM 920 CG LYS A 524 15.308 -28.227 -14.242 1.00 0.00 C ATOM 921 CD LYS A 524 16.575 -28.694 -13.505 1.00 0.00 C ATOM 922 CE LYS A 524 16.417 -28.644 -11.981 1.00 0.00 C ATOM 923 NZ LYS A 524 17.721 -28.920 -11.262 1.00 0.00 N ATOM 0 H LYS A 524 12.562 -27.487 -13.355 1.00 0.00 H new ATOM 0 HA LYS A 524 13.273 -28.374 -15.950 1.00 0.00 H new ATOM 0 HB2 LYS A 524 13.850 -29.378 -13.144 1.00 0.00 H new ATOM 0 HB3 LYS A 524 14.481 -30.194 -14.561 1.00 0.00 H new ATOM 0 HG2 LYS A 524 15.557 -28.036 -15.286 1.00 0.00 H new ATOM 0 HG3 LYS A 524 14.980 -27.280 -13.814 1.00 0.00 H new ATOM 0 HD2 LYS A 524 16.814 -29.713 -13.809 1.00 0.00 H new ATOM 0 HD3 LYS A 524 17.416 -28.067 -13.801 1.00 0.00 H new ATOM 0 HE2 LYS A 524 16.043 -27.663 -11.688 1.00 0.00 H new ATOM 0 HE3 LYS A 524 15.671 -29.375 -11.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 17.567 -28.876 -10.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 18.066 -29.866 -11.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 18.427 -28.207 -11.537 1.00 0.00 H new ATOM 937 N LYS A 525 10.967 -30.144 -14.455 1.00 0.00 N ATOM 938 CA LYS A 525 9.994 -31.230 -14.661 1.00 0.00 C ATOM 939 C LYS A 525 9.055 -30.920 -15.822 1.00 0.00 C ATOM 940 O LYS A 525 8.802 -31.768 -16.666 1.00 0.00 O ATOM 941 CB LYS A 525 9.139 -31.472 -13.408 1.00 0.00 C ATOM 942 CG LYS A 525 9.934 -31.792 -12.151 1.00 0.00 C ATOM 943 CD LYS A 525 9.007 -31.930 -10.944 1.00 0.00 C ATOM 944 CE LYS A 525 9.790 -31.983 -9.627 1.00 0.00 C ATOM 945 NZ LYS A 525 10.617 -33.235 -9.487 1.00 0.00 N ATOM 0 H LYS A 525 10.789 -29.572 -13.629 1.00 0.00 H new ATOM 0 HA LYS A 525 10.578 -32.123 -14.883 1.00 0.00 H new ATOM 0 HB2 LYS A 525 8.531 -30.586 -13.222 1.00 0.00 H new ATOM 0 HB3 LYS A 525 8.452 -32.294 -13.606 1.00 0.00 H new ATOM 0 HG2 LYS A 525 10.493 -32.717 -12.294 1.00 0.00 H new ATOM 0 HG3 LYS A 525 10.664 -31.004 -11.966 1.00 0.00 H new ATOM 0 HD2 LYS A 525 8.313 -31.090 -10.921 1.00 0.00 H new ATOM 0 HD3 LYS A 525 8.408 -32.835 -11.047 1.00 0.00 H new ATOM 0 HE2 LYS A 525 10.443 -31.113 -9.563 1.00 0.00 H new ATOM 0 HE3 LYS A 525 9.092 -31.919 -8.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 11.124 -33.216 -8.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 9.995 -34.068 -9.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 11.304 -33.286 -10.266 1.00 0.00 H new ATOM 959 N ILE A 526 8.526 -29.708 -15.857 1.00 0.00 N ATOM 960 CA ILE A 526 7.544 -29.343 -16.884 1.00 0.00 C ATOM 961 C ILE A 526 8.136 -29.055 -18.260 1.00 0.00 C ATOM 962 O ILE A 526 7.449 -29.156 -19.251 1.00 0.00 O ATOM 963 CB ILE A 526 6.680 -28.152 -16.447 1.00 0.00 C ATOM 964 CG1 ILE A 526 7.542 -27.077 -15.790 1.00 0.00 C ATOM 965 CG2 ILE A 526 5.615 -28.623 -15.481 1.00 0.00 C ATOM 966 CD1 ILE A 526 6.861 -25.759 -15.575 1.00 0.00 C ATOM 0 H ILE A 526 8.752 -28.963 -15.198 1.00 0.00 H new ATOM 0 HA ILE A 526 6.927 -30.236 -16.987 1.00 0.00 H new ATOM 0 HB ILE A 526 6.204 -27.722 -17.328 1.00 0.00 H new ATOM 0 HG12 ILE A 526 7.889 -27.450 -14.827 1.00 0.00 H new ATOM 0 HG13 ILE A 526 8.426 -26.915 -16.407 1.00 0.00 H new ATOM 0 HG21 ILE A 526 5.003 -27.775 -15.172 1.00 0.00 H new ATOM 0 HG22 ILE A 526 4.985 -29.367 -15.968 1.00 0.00 H new ATOM 0 HG23 ILE A 526 6.089 -29.066 -14.605 1.00 0.00 H new ATOM 0 HD11 ILE A 526 7.555 -25.063 -15.103 1.00 0.00 H new ATOM 0 HD12 ILE A 526 6.539 -25.355 -16.535 1.00 0.00 H new ATOM 0 HD13 ILE A 526 5.993 -25.899 -14.930 1.00 0.00 H new ATOM 978 N ARG A 527 9.415 -28.735 -18.331 1.00 0.00 N ATOM 979 CA ARG A 527 10.098 -28.529 -19.613 1.00 0.00 C ATOM 980 C ARG A 527 10.131 -29.798 -20.462 1.00 0.00 C ATOM 981 O ARG A 527 10.427 -29.742 -21.637 1.00 0.00 O ATOM 982 CB ARG A 527 11.539 -28.120 -19.318 1.00 0.00 C ATOM 983 CG ARG A 527 11.863 -26.704 -19.559 1.00 0.00 C ATOM 984 CD ARG A 527 13.145 -26.581 -20.361 1.00 0.00 C ATOM 985 NE ARG A 527 14.336 -27.110 -19.674 1.00 0.00 N ATOM 986 CZ ARG A 527 15.577 -27.034 -20.149 1.00 0.00 C ATOM 987 NH1 ARG A 527 15.854 -26.465 -21.298 1.00 0.00 N ATOM 988 NH2 ARG A 527 16.559 -27.540 -19.454 1.00 0.00 N ATOM 0 H ARG A 527 10.013 -28.609 -17.514 1.00 0.00 H new ATOM 0 HA ARG A 527 9.555 -27.765 -20.168 1.00 0.00 H new ATOM 0 HB2 ARG A 527 11.757 -28.351 -18.275 1.00 0.00 H new ATOM 0 HB3 ARG A 527 12.203 -28.734 -19.926 1.00 0.00 H new ATOM 0 HG2 ARG A 527 11.044 -26.224 -20.095 1.00 0.00 H new ATOM 0 HG3 ARG A 527 11.971 -26.183 -18.608 1.00 0.00 H new ATOM 0 HD2 ARG A 527 13.021 -27.107 -21.308 1.00 0.00 H new ATOM 0 HD3 ARG A 527 13.313 -25.531 -20.600 1.00 0.00 H new ATOM 0 HE ARG A 527 14.200 -27.566 -18.772 1.00 0.00 H new ATOM 0 HH11 ARG A 527 15.105 -26.061 -21.861 1.00 0.00 H new ATOM 0 HH12 ARG A 527 16.818 -26.426 -21.629 1.00 0.00 H new ATOM 0 HH21 ARG A 527 16.371 -27.988 -18.557 1.00 0.00 H new ATOM 0 HH22 ARG A 527 17.514 -27.488 -19.808 1.00 0.00 H new ATOM 1002 N ARG A 528 9.840 -30.941 -19.854 1.00 0.00 N ATOM 1003 CA ARG A 528 9.746 -32.217 -20.576 1.00 0.00 C ATOM 1004 C ARG A 528 8.338 -32.820 -20.459 1.00 0.00 C ATOM 1005 O ARG A 528 8.155 -34.019 -20.693 1.00 0.00 O ATOM 1006 CB ARG A 528 10.803 -33.190 -20.037 1.00 0.00 C ATOM 1007 CG ARG A 528 10.701 -33.431 -18.534 1.00 0.00 C ATOM 1008 CD ARG A 528 11.639 -34.517 -18.071 1.00 0.00 C ATOM 1009 NE ARG A 528 13.057 -34.146 -18.234 1.00 0.00 N ATOM 1010 CZ ARG A 528 14.091 -34.953 -18.008 1.00 0.00 C ATOM 1011 NH1 ARG A 528 13.939 -36.189 -17.597 1.00 0.00 N ATOM 1012 NH2 ARG A 528 15.301 -34.507 -18.202 1.00 0.00 N ATOM 0 H ARG A 528 9.662 -31.017 -18.852 1.00 0.00 H new ATOM 0 HA ARG A 528 9.935 -32.035 -21.634 1.00 0.00 H new ATOM 0 HB2 ARG A 528 10.706 -34.143 -20.557 1.00 0.00 H new ATOM 0 HB3 ARG A 528 11.795 -32.801 -20.268 1.00 0.00 H new ATOM 0 HG2 ARG A 528 10.926 -32.506 -18.003 1.00 0.00 H new ATOM 0 HG3 ARG A 528 9.677 -33.704 -18.279 1.00 0.00 H new ATOM 0 HD2 ARG A 528 11.443 -34.739 -17.022 1.00 0.00 H new ATOM 0 HD3 ARG A 528 11.439 -35.429 -18.633 1.00 0.00 H new ATOM 0 HE ARG A 528 13.261 -33.196 -18.544 1.00 0.00 H new ATOM 0 HH11 ARG A 528 13.003 -36.563 -17.440 1.00 0.00 H new ATOM 0 HH12 ARG A 528 14.757 -36.777 -17.435 1.00 0.00 H new ATOM 0 HH21 ARG A 528 15.446 -33.550 -18.523 1.00 0.00 H new ATOM 0 HH22 ARG A 528 16.102 -35.115 -18.032 1.00 0.00 H new ATOM 1026 N TYR A 529 7.362 -32.003 -20.085 1.00 0.00 N ATOM 1027 CA TYR A 529 5.983 -32.461 -19.873 1.00 0.00 C ATOM 1028 C TYR A 529 5.383 -32.997 -21.170 1.00 0.00 C ATOM 1029 O TYR A 529 5.403 -32.331 -22.194 1.00 0.00 O ATOM 1030 CB TYR A 529 5.152 -31.295 -19.334 1.00 0.00 C ATOM 1031 CG TYR A 529 3.867 -31.693 -18.647 1.00 0.00 C ATOM 1032 CD1 TYR A 529 2.631 -31.168 -19.073 1.00 0.00 C ATOM 1033 CD2 TYR A 529 3.874 -32.584 -17.551 1.00 0.00 C ATOM 1034 CE1 TYR A 529 1.428 -31.506 -18.406 1.00 0.00 C ATOM 1035 CE2 TYR A 529 2.663 -32.939 -16.891 1.00 0.00 C ATOM 1036 CZ TYR A 529 1.452 -32.388 -17.324 1.00 0.00 C ATOM 1037 OH TYR A 529 0.278 -32.707 -16.694 1.00 0.00 O ATOM 0 H TYR A 529 7.497 -31.006 -19.919 1.00 0.00 H new ATOM 0 HA TYR A 529 5.980 -33.276 -19.149 1.00 0.00 H new ATOM 0 HB2 TYR A 529 5.762 -30.728 -18.631 1.00 0.00 H new ATOM 0 HB3 TYR A 529 4.913 -30.626 -20.161 1.00 0.00 H new ATOM 0 HD1 TYR A 529 2.600 -30.499 -19.920 1.00 0.00 H new ATOM 0 HD2 TYR A 529 4.810 -33.001 -17.209 1.00 0.00 H new ATOM 0 HE1 TYR A 529 0.491 -31.081 -18.735 1.00 0.00 H new ATOM 0 HE2 TYR A 529 2.679 -33.630 -16.061 1.00 0.00 H new ATOM 0 HH TYR A 529 0.459 -33.333 -15.962 1.00 0.00 H new ATOM 1047 N LYS A 530 4.875 -34.223 -21.124 1.00 0.00 N ATOM 1048 CA LYS A 530 4.339 -34.880 -22.323 1.00 0.00 C ATOM 1049 C LYS A 530 2.849 -34.697 -22.559 1.00 0.00 C ATOM 1050 O LYS A 530 2.405 -34.801 -23.687 1.00 0.00 O ATOM 1051 CB LYS A 530 4.646 -36.382 -22.266 1.00 0.00 C ATOM 1052 CG LYS A 530 6.138 -36.711 -22.345 1.00 0.00 C ATOM 1053 CD LYS A 530 6.700 -36.455 -23.750 1.00 0.00 C ATOM 1054 CE LYS A 530 8.201 -36.691 -23.797 1.00 0.00 C ATOM 1055 NZ LYS A 530 8.934 -35.583 -23.091 1.00 0.00 N ATOM 0 H LYS A 530 4.820 -34.786 -20.275 1.00 0.00 H new ATOM 0 HA LYS A 530 4.836 -34.388 -23.159 1.00 0.00 H new ATOM 0 HB2 LYS A 530 4.242 -36.791 -21.340 1.00 0.00 H new ATOM 0 HB3 LYS A 530 4.130 -36.880 -23.087 1.00 0.00 H new ATOM 0 HG2 LYS A 530 6.683 -36.108 -21.619 1.00 0.00 H new ATOM 0 HG3 LYS A 530 6.296 -37.755 -22.074 1.00 0.00 H new ATOM 0 HD2 LYS A 530 6.204 -37.110 -24.467 1.00 0.00 H new ATOM 0 HD3 LYS A 530 6.481 -35.430 -24.050 1.00 0.00 H new ATOM 0 HE2 LYS A 530 8.439 -37.647 -23.330 1.00 0.00 H new ATOM 0 HE3 LYS A 530 8.533 -36.751 -24.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 530 9.714 -35.984 -22.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 530 9.318 -34.918 -23.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 530 8.278 -35.080 -22.460 1.00 0.00 H new ATOM 1069 N ALA A 531 2.084 -34.442 -21.506 1.00 0.00 N ATOM 1070 CA ALA A 531 0.633 -34.319 -21.644 1.00 0.00 C ATOM 1071 C ALA A 531 0.266 -33.111 -22.506 1.00 0.00 C ATOM 1072 O ALA A 531 -0.653 -33.164 -23.311 1.00 0.00 O ATOM 1073 CB ALA A 531 -0.019 -34.202 -20.263 1.00 0.00 C ATOM 0 H ALA A 531 2.435 -34.317 -20.557 1.00 0.00 H new ATOM 0 HA ALA A 531 0.259 -35.215 -22.139 1.00 0.00 H new ATOM 0 HB1 ALA A 531 -1.099 -34.111 -20.377 1.00 0.00 H new ATOM 0 HB2 ALA A 531 0.210 -35.091 -19.676 1.00 0.00 H new ATOM 0 HB3 ALA A 531 0.367 -33.320 -19.752 1.00 0.00 H new ATOM 1079 N ASN A 532 0.991 -32.017 -22.317 1.00 0.00 N ATOM 1080 CA ASN A 532 0.737 -30.793 -23.064 1.00 0.00 C ATOM 1081 C ASN A 532 2.044 -30.221 -23.587 1.00 0.00 C ATOM 1082 O ASN A 532 2.947 -29.902 -22.807 1.00 0.00 O ATOM 1083 CB ASN A 532 0.063 -29.763 -22.159 1.00 0.00 C ATOM 1084 CG ASN A 532 -1.219 -30.266 -21.555 1.00 0.00 C ATOM 1085 OD1 ASN A 532 -1.286 -30.506 -20.364 1.00 0.00 O ATOM 1086 ND2 ASN A 532 -2.234 -30.419 -22.358 1.00 0.00 N ATOM 0 H ASN A 532 1.761 -31.952 -21.651 1.00 0.00 H new ATOM 0 HA ASN A 532 0.082 -31.025 -23.904 1.00 0.00 H new ATOM 0 HB2 ASN A 532 0.750 -29.483 -21.360 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -0.142 -28.860 -22.734 1.00 0.00 H new ATOM 0 HD21 ASN A 532 -3.127 -30.751 -21.994 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -2.136 -30.206 -23.351 1.00 0.00 H new ATOM 1093 N LYS A 533 2.136 -30.079 -24.903 1.00 0.00 N ATOM 1094 CA LYS A 533 3.318 -29.498 -25.552 1.00 0.00 C ATOM 1095 C LYS A 533 3.506 -28.090 -25.047 1.00 0.00 C ATOM 1096 O LYS A 533 4.604 -27.688 -24.733 1.00 0.00 O ATOM 1097 CB LYS A 533 3.075 -29.461 -27.068 1.00 0.00 C ATOM 1098 CG LYS A 533 4.055 -28.647 -27.937 1.00 0.00 C ATOM 1099 CD LYS A 533 5.484 -29.170 -27.970 1.00 0.00 C ATOM 1100 CE LYS A 533 6.224 -28.504 -29.141 1.00 0.00 C ATOM 1101 NZ LYS A 533 7.725 -28.529 -29.012 1.00 0.00 N ATOM 0 H LYS A 533 1.401 -30.360 -25.553 1.00 0.00 H new ATOM 0 HA LYS A 533 4.204 -30.092 -25.330 1.00 0.00 H new ATOM 0 HB2 LYS A 533 3.079 -30.488 -27.432 1.00 0.00 H new ATOM 0 HB3 LYS A 533 2.073 -29.067 -27.236 1.00 0.00 H new ATOM 0 HG2 LYS A 533 3.672 -28.618 -28.957 1.00 0.00 H new ATOM 0 HG3 LYS A 533 4.070 -27.620 -27.573 1.00 0.00 H new ATOM 0 HD2 LYS A 533 5.989 -28.950 -27.029 1.00 0.00 H new ATOM 0 HD3 LYS A 533 5.487 -30.254 -28.088 1.00 0.00 H new ATOM 0 HE2 LYS A 533 5.941 -29.004 -30.067 1.00 0.00 H new ATOM 0 HE3 LYS A 533 5.894 -27.468 -29.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 533 8.146 -27.907 -29.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 533 7.998 -28.197 -28.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 533 8.069 -29.501 -29.150 1.00 0.00 H new ATOM 1115 N ASP A 534 2.414 -27.357 -24.971 1.00 0.00 N ATOM 1116 CA ASP A 534 2.431 -25.947 -24.597 1.00 0.00 C ATOM 1117 C ASP A 534 3.102 -25.695 -23.258 1.00 0.00 C ATOM 1118 O ASP A 534 3.900 -24.775 -23.116 1.00 0.00 O ATOM 1119 CB ASP A 534 0.996 -25.455 -24.536 1.00 0.00 C ATOM 1120 CG ASP A 534 0.118 -26.150 -25.543 1.00 0.00 C ATOM 1121 OD1 ASP A 534 0.183 -25.822 -26.739 1.00 0.00 O ATOM 1122 OD2 ASP A 534 -0.621 -27.071 -25.125 1.00 0.00 O ATOM 0 H ASP A 534 1.481 -27.720 -25.167 1.00 0.00 H new ATOM 0 HA ASP A 534 3.012 -25.410 -25.347 1.00 0.00 H new ATOM 0 HB2 ASP A 534 0.599 -25.619 -23.534 1.00 0.00 H new ATOM 0 HB3 ASP A 534 0.973 -24.380 -24.716 1.00 0.00 H new ATOM 1127 N VAL A 535 2.785 -26.528 -22.277 1.00 0.00 N ATOM 1128 CA VAL A 535 3.396 -26.414 -20.950 1.00 0.00 C ATOM 1129 C VAL A 535 4.906 -26.538 -21.085 1.00 0.00 C ATOM 1130 O VAL A 535 5.643 -25.765 -20.494 1.00 0.00 O ATOM 1131 CB VAL A 535 2.881 -27.518 -19.976 1.00 0.00 C ATOM 1132 CG1 VAL A 535 3.667 -27.516 -18.667 1.00 0.00 C ATOM 1133 CG2 VAL A 535 1.411 -27.313 -19.675 1.00 0.00 C ATOM 0 H VAL A 535 2.112 -27.289 -22.369 1.00 0.00 H new ATOM 0 HA VAL A 535 3.121 -25.444 -20.536 1.00 0.00 H new ATOM 0 HB VAL A 535 3.024 -28.480 -20.468 1.00 0.00 H new ATOM 0 HG11 VAL A 535 3.283 -28.297 -18.011 1.00 0.00 H new ATOM 0 HG12 VAL A 535 4.721 -27.702 -18.875 1.00 0.00 H new ATOM 0 HG13 VAL A 535 3.559 -26.547 -18.179 1.00 0.00 H new ATOM 0 HG21 VAL A 535 1.067 -28.092 -18.994 1.00 0.00 H new ATOM 0 HG22 VAL A 535 1.267 -26.337 -19.212 1.00 0.00 H new ATOM 0 HG23 VAL A 535 0.839 -27.363 -20.602 1.00 0.00 H new ATOM 1143 N MET A 536 5.361 -27.500 -21.870 1.00 0.00 N ATOM 1144 CA MET A 536 6.791 -27.728 -22.062 1.00 0.00 C ATOM 1145 C MET A 536 7.410 -26.536 -22.757 1.00 0.00 C ATOM 1146 O MET A 536 8.475 -26.084 -22.352 1.00 0.00 O ATOM 1147 CB MET A 536 6.996 -29.043 -22.833 1.00 0.00 C ATOM 1148 CG MET A 536 8.167 -29.087 -23.811 1.00 0.00 C ATOM 1149 SD MET A 536 8.580 -30.808 -24.272 1.00 0.00 S ATOM 1150 CE MET A 536 7.065 -31.366 -25.074 1.00 0.00 C ATOM 0 H MET A 536 4.761 -28.141 -22.389 1.00 0.00 H new ATOM 0 HA MET A 536 7.296 -27.831 -21.102 1.00 0.00 H new ATOM 0 HB2 MET A 536 7.128 -29.846 -22.108 1.00 0.00 H new ATOM 0 HB3 MET A 536 6.082 -29.260 -23.386 1.00 0.00 H new ATOM 0 HG2 MET A 536 7.918 -28.518 -24.707 1.00 0.00 H new ATOM 0 HG3 MET A 536 9.038 -28.609 -23.362 1.00 0.00 H new ATOM 0 HE1 MET A 536 7.186 -32.399 -25.401 1.00 0.00 H new ATOM 0 HE2 MET A 536 6.236 -31.303 -24.369 1.00 0.00 H new ATOM 0 HE3 MET A 536 6.856 -30.734 -25.937 1.00 0.00 H new ATOM 1160 N GLU A 537 6.749 -26.008 -23.774 1.00 0.00 N ATOM 1161 CA GLU A 537 7.272 -24.846 -24.490 1.00 0.00 C ATOM 1162 C GLU A 537 7.373 -23.612 -23.605 1.00 0.00 C ATOM 1163 O GLU A 537 8.409 -22.944 -23.584 1.00 0.00 O ATOM 1164 CB GLU A 537 6.389 -24.507 -25.688 1.00 0.00 C ATOM 1165 CG GLU A 537 6.236 -25.639 -26.668 1.00 0.00 C ATOM 1166 CD GLU A 537 7.450 -25.854 -27.545 1.00 0.00 C ATOM 1167 OE1 GLU A 537 7.422 -25.449 -28.720 1.00 0.00 O ATOM 1168 OE2 GLU A 537 8.424 -26.485 -27.075 1.00 0.00 O ATOM 0 H GLU A 537 5.857 -26.358 -24.123 1.00 0.00 H new ATOM 0 HA GLU A 537 8.274 -25.120 -24.820 1.00 0.00 H new ATOM 0 HB2 GLU A 537 5.403 -24.213 -25.329 1.00 0.00 H new ATOM 0 HB3 GLU A 537 6.810 -23.645 -26.205 1.00 0.00 H new ATOM 0 HG2 GLU A 537 6.029 -26.557 -26.119 1.00 0.00 H new ATOM 0 HG3 GLU A 537 5.371 -25.444 -27.302 1.00 0.00 H new ATOM 1175 N LYS A 538 6.319 -23.273 -22.871 1.00 0.00 N ATOM 1176 CA LYS A 538 6.394 -22.060 -22.064 1.00 0.00 C ATOM 1177 C LYS A 538 7.321 -22.246 -20.881 1.00 0.00 C ATOM 1178 O LYS A 538 8.058 -21.338 -20.529 1.00 0.00 O ATOM 1179 CB LYS A 538 5.010 -21.631 -21.609 1.00 0.00 C ATOM 1180 CG LYS A 538 4.913 -20.164 -21.191 1.00 0.00 C ATOM 1181 CD LYS A 538 4.983 -19.232 -22.396 1.00 0.00 C ATOM 1182 CE LYS A 538 4.991 -17.769 -21.977 1.00 0.00 C ATOM 1183 NZ LYS A 538 5.208 -16.886 -23.176 1.00 0.00 N ATOM 0 H LYS A 538 5.442 -23.791 -22.816 1.00 0.00 H new ATOM 0 HA LYS A 538 6.808 -21.267 -22.687 1.00 0.00 H new ATOM 0 HB2 LYS A 538 4.302 -21.814 -22.417 1.00 0.00 H new ATOM 0 HB3 LYS A 538 4.706 -22.257 -20.770 1.00 0.00 H new ATOM 0 HG2 LYS A 538 3.978 -19.998 -20.656 1.00 0.00 H new ATOM 0 HG3 LYS A 538 5.722 -19.928 -20.500 1.00 0.00 H new ATOM 0 HD2 LYS A 538 5.882 -19.450 -22.973 1.00 0.00 H new ATOM 0 HD3 LYS A 538 4.131 -19.418 -23.050 1.00 0.00 H new ATOM 0 HE2 LYS A 538 4.046 -17.516 -21.496 1.00 0.00 H new ATOM 0 HE3 LYS A 538 5.778 -17.598 -21.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 538 6.109 -16.376 -23.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 538 5.237 -17.470 -24.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 538 4.429 -16.201 -23.248 1.00 0.00 H new ATOM 1197 N ALA A 539 7.309 -23.426 -20.278 1.00 0.00 N ATOM 1198 CA ALA A 539 8.193 -23.714 -19.150 1.00 0.00 C ATOM 1199 C ALA A 539 9.620 -23.518 -19.585 1.00 0.00 C ATOM 1200 O ALA A 539 10.444 -22.999 -18.860 1.00 0.00 O ATOM 1201 CB ALA A 539 8.011 -25.134 -18.705 1.00 0.00 C ATOM 0 H ALA A 539 6.701 -24.199 -20.547 1.00 0.00 H new ATOM 0 HA ALA A 539 7.953 -23.044 -18.324 1.00 0.00 H new ATOM 0 HB1 ALA A 539 8.674 -25.340 -17.864 1.00 0.00 H new ATOM 0 HB2 ALA A 539 6.977 -25.289 -18.398 1.00 0.00 H new ATOM 0 HB3 ALA A 539 8.250 -25.807 -19.528 1.00 0.00 H new ATOM 1207 N ALA A 540 9.882 -23.967 -20.790 1.00 0.00 N ATOM 1208 CA ALA A 540 11.195 -23.849 -21.404 1.00 0.00 C ATOM 1209 C ALA A 540 11.642 -22.426 -21.617 1.00 0.00 C ATOM 1210 O ALA A 540 12.754 -22.073 -21.232 1.00 0.00 O ATOM 1211 CB ALA A 540 11.219 -24.592 -22.723 1.00 0.00 C ATOM 0 H ALA A 540 9.190 -24.428 -21.380 1.00 0.00 H new ATOM 0 HA ALA A 540 11.899 -24.293 -20.700 1.00 0.00 H new ATOM 0 HB1 ALA A 540 12.206 -24.498 -23.176 1.00 0.00 H new ATOM 0 HB2 ALA A 540 10.997 -25.645 -22.551 1.00 0.00 H new ATOM 0 HB3 ALA A 540 10.471 -24.168 -23.393 1.00 0.00 H new ATOM 1217 N GLU A 541 10.794 -21.620 -22.232 1.00 0.00 N ATOM 1218 CA GLU A 541 11.129 -20.233 -22.500 1.00 0.00 C ATOM 1219 C GLU A 541 11.433 -19.563 -21.156 1.00 0.00 C ATOM 1220 O GLU A 541 12.403 -18.821 -21.015 1.00 0.00 O ATOM 1221 CB GLU A 541 9.948 -19.559 -23.230 1.00 0.00 C ATOM 1222 CG GLU A 541 9.574 -18.192 -22.675 1.00 0.00 C ATOM 1223 CD GLU A 541 8.386 -17.536 -23.357 1.00 0.00 C ATOM 1224 OE1 GLU A 541 7.723 -18.164 -24.200 1.00 0.00 O ATOM 1225 OE2 GLU A 541 8.100 -16.365 -23.021 1.00 0.00 O ATOM 0 H GLU A 541 9.869 -21.902 -22.555 1.00 0.00 H new ATOM 0 HA GLU A 541 12.003 -20.144 -23.145 1.00 0.00 H new ATOM 0 HB2 GLU A 541 10.199 -19.455 -24.286 1.00 0.00 H new ATOM 0 HB3 GLU A 541 9.078 -20.213 -23.172 1.00 0.00 H new ATOM 0 HG2 GLU A 541 9.355 -18.293 -21.612 1.00 0.00 H new ATOM 0 HG3 GLU A 541 10.436 -17.531 -22.761 1.00 0.00 H new ATOM 1232 N VAL A 542 10.602 -19.847 -20.166 1.00 0.00 N ATOM 1233 CA VAL A 542 10.729 -19.239 -18.854 1.00 0.00 C ATOM 1234 C VAL A 542 11.986 -19.701 -18.166 1.00 0.00 C ATOM 1235 O VAL A 542 12.777 -18.889 -17.727 1.00 0.00 O ATOM 1236 CB VAL A 542 9.492 -19.577 -18.014 1.00 0.00 C ATOM 1237 CG1 VAL A 542 9.660 -19.169 -16.554 1.00 0.00 C ATOM 1238 CG2 VAL A 542 8.299 -18.873 -18.608 1.00 0.00 C ATOM 0 H VAL A 542 9.825 -20.502 -20.250 1.00 0.00 H new ATOM 0 HA VAL A 542 10.797 -18.157 -18.970 1.00 0.00 H new ATOM 0 HB VAL A 542 9.350 -20.658 -18.031 1.00 0.00 H new ATOM 0 HG11 VAL A 542 8.759 -19.428 -15.998 1.00 0.00 H new ATOM 0 HG12 VAL A 542 10.514 -19.693 -16.126 1.00 0.00 H new ATOM 0 HG13 VAL A 542 9.827 -18.094 -16.494 1.00 0.00 H new ATOM 0 HG21 VAL A 542 7.410 -19.104 -18.021 1.00 0.00 H new ATOM 0 HG22 VAL A 542 8.470 -17.797 -18.599 1.00 0.00 H new ATOM 0 HG23 VAL A 542 8.153 -19.209 -19.635 1.00 0.00 H new ATOM 1248 N TYR A 543 12.176 -21.007 -18.083 1.00 0.00 N ATOM 1249 CA TYR A 543 13.319 -21.591 -17.397 1.00 0.00 C ATOM 1250 C TYR A 543 14.623 -21.011 -17.939 1.00 0.00 C ATOM 1251 O TYR A 543 15.512 -20.655 -17.177 1.00 0.00 O ATOM 1252 CB TYR A 543 13.280 -23.109 -17.576 1.00 0.00 C ATOM 1253 CG TYR A 543 14.513 -23.809 -17.070 1.00 0.00 C ATOM 1254 CD1 TYR A 543 14.597 -24.248 -15.738 1.00 0.00 C ATOM 1255 CD2 TYR A 543 15.612 -24.027 -17.924 1.00 0.00 C ATOM 1256 CE1 TYR A 543 15.758 -24.895 -15.264 1.00 0.00 C ATOM 1257 CE2 TYR A 543 16.778 -24.664 -17.452 1.00 0.00 C ATOM 1258 CZ TYR A 543 16.841 -25.100 -16.123 1.00 0.00 C ATOM 1259 OH TYR A 543 17.966 -25.722 -15.644 1.00 0.00 O ATOM 0 H TYR A 543 11.542 -21.694 -18.490 1.00 0.00 H new ATOM 0 HA TYR A 543 13.270 -21.353 -16.334 1.00 0.00 H new ATOM 0 HB2 TYR A 543 12.408 -23.505 -17.055 1.00 0.00 H new ATOM 0 HB3 TYR A 543 13.151 -23.338 -18.634 1.00 0.00 H new ATOM 0 HD1 TYR A 543 13.764 -24.089 -15.070 1.00 0.00 H new ATOM 0 HD2 TYR A 543 15.561 -23.702 -18.953 1.00 0.00 H new ATOM 0 HE1 TYR A 543 15.810 -25.231 -14.239 1.00 0.00 H new ATOM 0 HE2 TYR A 543 17.619 -24.815 -18.113 1.00 0.00 H new ATOM 0 HH TYR A 543 18.631 -25.793 -16.360 1.00 0.00 H new ATOM 1269 N THR A 544 14.713 -20.902 -19.255 1.00 0.00 N ATOM 1270 CA THR A 544 15.874 -20.361 -19.946 1.00 0.00 C ATOM 1271 C THR A 544 16.097 -18.891 -19.607 1.00 0.00 C ATOM 1272 O THR A 544 17.222 -18.443 -19.429 1.00 0.00 O ATOM 1273 CB THR A 544 15.642 -20.493 -21.449 1.00 0.00 C ATOM 1274 OG1 THR A 544 15.359 -21.861 -21.754 1.00 0.00 O ATOM 1275 CG2 THR A 544 16.831 -20.082 -22.240 1.00 0.00 C ATOM 0 H THR A 544 13.966 -21.193 -19.886 1.00 0.00 H new ATOM 0 HA THR A 544 16.757 -20.917 -19.630 1.00 0.00 H new ATOM 0 HB THR A 544 14.811 -19.839 -21.712 1.00 0.00 H new ATOM 0 HG1 THR A 544 14.399 -21.968 -21.918 1.00 0.00 H new ATOM 0 HG21 THR A 544 16.617 -20.194 -23.303 1.00 0.00 H new ATOM 0 HG22 THR A 544 17.069 -19.040 -22.025 1.00 0.00 H new ATOM 0 HG23 THR A 544 17.681 -20.710 -21.973 1.00 0.00 H new ATOM 1283 N ARG A 545 15.024 -18.132 -19.485 1.00 0.00 N ATOM 1284 CA ARG A 545 15.143 -16.732 -19.093 1.00 0.00 C ATOM 1285 C ARG A 545 15.699 -16.612 -17.683 1.00 0.00 C ATOM 1286 O ARG A 545 16.334 -15.622 -17.359 1.00 0.00 O ATOM 1287 CB ARG A 545 13.814 -16.027 -19.198 1.00 0.00 C ATOM 1288 CG ARG A 545 13.445 -15.713 -20.625 1.00 0.00 C ATOM 1289 CD ARG A 545 12.155 -15.016 -20.594 1.00 0.00 C ATOM 1290 NE ARG A 545 11.576 -14.789 -21.927 1.00 0.00 N ATOM 1291 CZ ARG A 545 10.451 -14.120 -22.165 1.00 0.00 C ATOM 1292 NH1 ARG A 545 9.748 -13.568 -21.203 1.00 0.00 N ATOM 1293 NH2 ARG A 545 10.029 -14.004 -23.390 1.00 0.00 N ATOM 0 H ARG A 545 14.069 -18.452 -19.648 1.00 0.00 H new ATOM 0 HA ARG A 545 15.839 -16.250 -19.780 1.00 0.00 H new ATOM 0 HB2 ARG A 545 13.038 -16.650 -18.753 1.00 0.00 H new ATOM 0 HB3 ARG A 545 13.849 -15.102 -18.622 1.00 0.00 H new ATOM 0 HG2 ARG A 545 14.208 -15.090 -21.092 1.00 0.00 H new ATOM 0 HG3 ARG A 545 13.375 -16.627 -21.215 1.00 0.00 H new ATOM 0 HD2 ARG A 545 11.452 -15.596 -19.996 1.00 0.00 H new ATOM 0 HD3 ARG A 545 12.282 -14.056 -20.094 1.00 0.00 H new ATOM 0 HE ARG A 545 12.075 -15.174 -22.729 1.00 0.00 H new ATOM 0 HH11 ARG A 545 10.060 -13.645 -20.235 1.00 0.00 H new ATOM 0 HH12 ARG A 545 8.890 -13.063 -21.424 1.00 0.00 H new ATOM 0 HH21 ARG A 545 10.559 -14.423 -24.154 1.00 0.00 H new ATOM 0 HH22 ARG A 545 9.168 -13.494 -23.587 1.00 0.00 H new ATOM 1307 N LEU A 546 15.461 -17.602 -16.832 1.00 0.00 N ATOM 1308 CA LEU A 546 15.938 -17.513 -15.452 1.00 0.00 C ATOM 1309 C LEU A 546 17.426 -17.743 -15.469 1.00 0.00 C ATOM 1310 O LEU A 546 18.168 -17.134 -14.717 1.00 0.00 O ATOM 1311 CB LEU A 546 15.275 -18.536 -14.537 1.00 0.00 C ATOM 1312 CG LEU A 546 13.784 -18.826 -14.737 1.00 0.00 C ATOM 1313 CD1 LEU A 546 13.348 -19.696 -13.616 1.00 0.00 C ATOM 1314 CD2 LEU A 546 12.833 -17.618 -14.859 1.00 0.00 C ATOM 0 H LEU A 546 14.954 -18.457 -17.061 1.00 0.00 H new ATOM 0 HA LEU A 546 15.685 -16.529 -15.058 1.00 0.00 H new ATOM 0 HB2 LEU A 546 15.815 -19.477 -14.643 1.00 0.00 H new ATOM 0 HB3 LEU A 546 15.415 -18.203 -13.509 1.00 0.00 H new ATOM 0 HG LEU A 546 13.708 -19.296 -15.718 1.00 0.00 H new ATOM 0 HD11 LEU A 546 12.288 -19.925 -13.724 1.00 0.00 H new ATOM 0 HD12 LEU A 546 13.922 -20.622 -13.630 1.00 0.00 H new ATOM 0 HD13 LEU A 546 13.513 -19.181 -12.670 1.00 0.00 H new ATOM 0 HD21 LEU A 546 11.811 -17.972 -14.997 1.00 0.00 H new ATOM 0 HD22 LEU A 546 12.890 -17.017 -13.951 1.00 0.00 H new ATOM 0 HD23 LEU A 546 13.125 -17.010 -15.715 1.00 0.00 H new ATOM 1326 N LYS A 547 17.850 -18.626 -16.365 1.00 0.00 N ATOM 1327 CA LYS A 547 19.269 -18.922 -16.548 1.00 0.00 C ATOM 1328 C LYS A 547 20.008 -17.635 -16.893 1.00 0.00 C ATOM 1329 O LYS A 547 21.099 -17.396 -16.415 1.00 0.00 O ATOM 1330 CB LYS A 547 19.471 -19.976 -17.662 1.00 0.00 C ATOM 1331 CG LYS A 547 18.771 -21.327 -17.452 1.00 0.00 C ATOM 1332 CD LYS A 547 19.059 -21.941 -16.109 1.00 0.00 C ATOM 1333 CE LYS A 547 17.854 -21.938 -15.188 1.00 0.00 C ATOM 1334 NZ LYS A 547 18.285 -22.363 -13.824 1.00 0.00 N ATOM 0 H LYS A 547 17.229 -19.153 -16.980 1.00 0.00 H new ATOM 0 HA LYS A 547 19.670 -19.334 -15.622 1.00 0.00 H new ATOM 0 HB2 LYS A 547 19.121 -19.551 -18.603 1.00 0.00 H new ATOM 0 HB3 LYS A 547 20.540 -20.157 -17.772 1.00 0.00 H new ATOM 0 HG2 LYS A 547 17.695 -21.192 -17.559 1.00 0.00 H new ATOM 0 HG3 LYS A 547 19.085 -22.017 -18.235 1.00 0.00 H new ATOM 0 HD2 LYS A 547 19.400 -22.967 -16.250 1.00 0.00 H new ATOM 0 HD3 LYS A 547 19.875 -21.396 -15.634 1.00 0.00 H new ATOM 0 HE2 LYS A 547 17.411 -20.943 -15.150 1.00 0.00 H new ATOM 0 HE3 LYS A 547 17.088 -22.613 -15.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 547 17.464 -22.364 -13.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 547 18.689 -23.320 -13.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 547 19.003 -21.701 -13.465 1.00 0.00 H new ATOM 1348 N SER A 548 19.384 -16.800 -17.711 1.00 0.00 N ATOM 1349 CA SER A 548 19.970 -15.517 -18.107 1.00 0.00 C ATOM 1350 C SER A 548 19.958 -14.467 -16.987 1.00 0.00 C ATOM 1351 O SER A 548 20.670 -13.474 -17.068 1.00 0.00 O ATOM 1352 CB SER A 548 19.212 -14.959 -19.311 1.00 0.00 C ATOM 1353 OG SER A 548 19.847 -13.801 -19.820 1.00 0.00 O ATOM 0 H SER A 548 18.467 -16.985 -18.118 1.00 0.00 H new ATOM 0 HA SER A 548 21.013 -15.717 -18.352 1.00 0.00 H new ATOM 0 HB2 SER A 548 19.153 -15.718 -20.091 1.00 0.00 H new ATOM 0 HB3 SER A 548 18.189 -14.719 -19.021 1.00 0.00 H new ATOM 0 HG SER A 548 20.348 -13.360 -19.102 1.00 0.00 H new