USER MOD reduce.3.24.130724 H: found=0, std=0, add=700, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 702 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 Single : A 453 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 455 THR OG1 : rot 180:sc= 0 USER MOD Single : A 462 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 THR OG1 : rot 47:sc= -1.18 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 MET CE :methyl 180:sc= -3.23 (180deg=-3.23) USER MOD Single : A 469 THR OG1 : rot 180:sc= 0.00829 USER MOD Single : A 470 THR OG1 : rot 120:sc= -0.312 USER MOD Single : A 471 LYS NZ :NH3+ -165:sc= 0.0816 (180deg=0.0426) USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 GLN : amide:sc= -0.361 X(o=-0.36,f=-0.16) USER MOD Single : A 479 THR OG1 : rot 180:sc= 0 USER MOD Single : A 480 LYS NZ :NH3+ -125:sc= 0.0822 (180deg=0) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 485 SER OG : rot 180:sc= 0 USER MOD Single : A 486 SER OG : rot 170:sc= -0.0583 USER MOD Single : A 488 GLN : amide:sc= -0.0787 X(o=-0.079,f=-0.3) USER MOD Single : A 489 THR OG1 : rot 180:sc= 0 USER MOD Single : A 491 ASN : amide:sc=-0.00512 K(o=-0.0051,f=-1.4) USER MOD Single : A 495 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.19) USER MOD Single : A 498 LYS NZ :NH3+ -145:sc= -2.35! (180deg=-3.21!) USER MOD Single : A 501 ASN : amide:sc= -5.92! C(o=-5.9!,f=-9.3!) USER MOD Single : A 505 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 506 MET CE :methyl 173:sc= 0 (180deg=-0.048) USER MOD Single : A 508 ASN : amide:sc= -1.12 X(o=-1.1,f=-1.4) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 511 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 512 HIS :FLIP no HE2:sc= -3.25! C(o=-4.3!,f=-3.2!) USER MOD Single : A 514 SER OG : rot 180:sc= 0 USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 949 MET CE :methyl 160:sc= -0.846 (180deg=-1.96) USER MOD Single : B 951 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 958 ASN : amide:sc= -1.1 K(o=-1.1,f=-7.5!) USER MOD Single : B 961 MET CE :methyl -126:sc= -3.05! (180deg=-4.92!) USER MOD ----------------------------------------------------------------- ATOM 29 N GLN A 453 -13.250 6.827 0.627 1.00 0.00 N ATOM 30 CA GLN A 453 -12.907 5.993 1.773 1.00 0.00 C ATOM 31 C GLN A 453 -12.103 4.773 1.335 1.00 0.00 C ATOM 32 O GLN A 453 -12.574 3.959 0.540 1.00 0.00 O ATOM 33 CB GLN A 453 -14.175 5.547 2.504 1.00 0.00 C ATOM 34 CG GLN A 453 -13.898 4.777 3.785 1.00 0.00 C ATOM 35 CD GLN A 453 -15.164 4.253 4.434 1.00 0.00 C ATOM 36 OE1 GLN A 453 -15.884 3.439 3.853 1.00 0.00 O ATOM 37 NE2 GLN A 453 -15.444 4.718 5.646 1.00 0.00 N ATOM 0 HA GLN A 453 -12.294 6.586 2.452 1.00 0.00 H new ATOM 0 HB2 GLN A 453 -14.776 6.425 2.740 1.00 0.00 H new ATOM 0 HB3 GLN A 453 -14.769 4.924 1.836 1.00 0.00 H new ATOM 0 HG2 GLN A 453 -13.233 3.941 3.566 1.00 0.00 H new ATOM 0 HG3 GLN A 453 -13.375 5.425 4.488 1.00 0.00 H new ATOM 0 HE21 GLN A 453 -14.820 5.391 6.091 1.00 0.00 H new ATOM 0 HE22 GLN A 453 -16.283 4.402 6.132 1.00 0.00 H new ATOM 46 N VAL A 454 -10.887 4.652 1.858 1.00 0.00 N ATOM 47 CA VAL A 454 -10.018 3.535 1.525 1.00 0.00 C ATOM 48 C VAL A 454 -10.543 2.232 2.116 1.00 0.00 C ATOM 49 O VAL A 454 -10.945 2.184 3.279 1.00 0.00 O ATOM 50 CB VAL A 454 -8.587 3.779 2.035 1.00 0.00 C ATOM 51 CG1 VAL A 454 -7.875 4.803 1.165 1.00 0.00 C ATOM 52 CG2 VAL A 454 -8.604 4.223 3.490 1.00 0.00 C ATOM 0 H VAL A 454 -10.482 5.318 2.516 1.00 0.00 H new ATOM 0 HA VAL A 454 -10.004 3.453 0.438 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.037 2.840 1.974 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -6.865 4.961 1.542 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -7.826 4.438 0.139 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -8.423 5.745 1.189 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -7.582 4.390 3.831 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -9.173 5.148 3.581 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.069 3.449 4.101 1.00 0.00 H new ATOM 62 N THR A 455 -10.536 1.176 1.310 1.00 0.00 N ATOM 63 CA THR A 455 -11.012 -0.128 1.755 1.00 0.00 C ATOM 64 C THR A 455 -10.058 -1.235 1.316 1.00 0.00 C ATOM 65 O THR A 455 -9.372 -1.110 0.302 1.00 0.00 O ATOM 66 CB THR A 455 -12.415 -0.397 1.207 1.00 0.00 C ATOM 67 OG1 THR A 455 -12.944 -1.594 1.749 1.00 0.00 O ATOM 68 CG2 THR A 455 -12.458 -0.517 -0.301 1.00 0.00 C ATOM 0 H THR A 455 -10.206 1.198 0.345 1.00 0.00 H new ATOM 0 HA THR A 455 -11.052 -0.120 2.844 1.00 0.00 H new ATOM 0 HB THR A 455 -13.010 0.467 1.502 1.00 0.00 H new ATOM 0 HG1 THR A 455 -13.842 -1.748 1.388 1.00 0.00 H new ATOM 0 HG21 THR A 455 -13.482 -0.707 -0.622 1.00 0.00 H new ATOM 0 HG22 THR A 455 -12.104 0.411 -0.750 1.00 0.00 H new ATOM 0 HG23 THR A 455 -11.819 -1.341 -0.619 1.00 0.00 H new ATOM 76 N GLU A 456 -10.023 -2.319 2.083 1.00 0.00 N ATOM 77 CA GLU A 456 -9.155 -3.448 1.772 1.00 0.00 C ATOM 78 C GLU A 456 -9.543 -4.083 0.442 1.00 0.00 C ATOM 79 O GLU A 456 -8.685 -4.542 -0.312 1.00 0.00 O ATOM 80 CB GLU A 456 -9.223 -4.492 2.888 1.00 0.00 C ATOM 81 CG GLU A 456 -8.245 -5.643 2.706 1.00 0.00 C ATOM 82 CD GLU A 456 -8.396 -6.714 3.769 1.00 0.00 C ATOM 83 OE1 GLU A 456 -9.293 -6.579 4.628 1.00 0.00 O ATOM 84 OE2 GLU A 456 -7.616 -7.689 3.742 1.00 0.00 O ATOM 0 H GLU A 456 -10.586 -2.440 2.925 1.00 0.00 H new ATOM 0 HA GLU A 456 -8.133 -3.077 1.692 1.00 0.00 H new ATOM 0 HB2 GLU A 456 -9.024 -4.005 3.842 1.00 0.00 H new ATOM 0 HB3 GLU A 456 -10.236 -4.892 2.939 1.00 0.00 H new ATOM 0 HG2 GLU A 456 -8.395 -6.089 1.723 1.00 0.00 H new ATOM 0 HG3 GLU A 456 -7.226 -5.256 2.729 1.00 0.00 H new ATOM 91 N ASP A 457 -10.841 -4.107 0.159 1.00 0.00 N ATOM 92 CA ASP A 457 -11.344 -4.686 -1.081 1.00 0.00 C ATOM 93 C ASP A 457 -10.759 -3.971 -2.294 1.00 0.00 C ATOM 94 O ASP A 457 -10.422 -4.602 -3.295 1.00 0.00 O ATOM 95 CB ASP A 457 -12.872 -4.613 -1.119 1.00 0.00 C ATOM 96 CG ASP A 457 -13.520 -5.484 -0.061 1.00 0.00 C ATOM 97 OD1 ASP A 457 -12.828 -6.367 0.487 1.00 0.00 O ATOM 98 OD2 ASP A 457 -14.721 -5.284 0.219 1.00 0.00 O ATOM 0 H ASP A 457 -11.564 -3.732 0.772 1.00 0.00 H new ATOM 0 HA ASP A 457 -11.035 -5.731 -1.115 1.00 0.00 H new ATOM 0 HB2 ASP A 457 -13.187 -3.579 -0.977 1.00 0.00 H new ATOM 0 HB3 ASP A 457 -13.223 -4.921 -2.104 1.00 0.00 H new ATOM 103 N ALA A 458 -10.641 -2.651 -2.197 1.00 0.00 N ATOM 104 CA ALA A 458 -10.096 -1.851 -3.287 1.00 0.00 C ATOM 105 C ALA A 458 -8.645 -2.222 -3.569 1.00 0.00 C ATOM 106 O ALA A 458 -8.231 -2.315 -4.724 1.00 0.00 O ATOM 107 CB ALA A 458 -10.211 -0.369 -2.962 1.00 0.00 C ATOM 0 H ALA A 458 -10.915 -2.113 -1.375 1.00 0.00 H new ATOM 0 HA ALA A 458 -10.677 -2.061 -4.185 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -9.800 0.217 -3.784 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -11.260 -0.108 -2.819 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -9.656 -0.152 -2.049 1.00 0.00 H new ATOM 113 N VAL A 459 -7.875 -2.431 -2.506 1.00 0.00 N ATOM 114 CA VAL A 459 -6.469 -2.792 -2.639 1.00 0.00 C ATOM 115 C VAL A 459 -6.314 -4.160 -3.293 1.00 0.00 C ATOM 116 O VAL A 459 -5.446 -4.358 -4.143 1.00 0.00 O ATOM 117 CB VAL A 459 -5.761 -2.804 -1.271 1.00 0.00 C ATOM 118 CG1 VAL A 459 -4.268 -3.037 -1.442 1.00 0.00 C ATOM 119 CG2 VAL A 459 -6.024 -1.507 -0.522 1.00 0.00 C ATOM 0 H VAL A 459 -8.202 -2.356 -1.543 1.00 0.00 H new ATOM 0 HA VAL A 459 -6.005 -2.035 -3.272 1.00 0.00 H new ATOM 0 HB VAL A 459 -6.167 -3.626 -0.681 1.00 0.00 H new ATOM 0 HG11 VAL A 459 -3.786 -3.042 -0.464 1.00 0.00 H new ATOM 0 HG12 VAL A 459 -4.103 -3.996 -1.933 1.00 0.00 H new ATOM 0 HG13 VAL A 459 -3.843 -2.240 -2.052 1.00 0.00 H new ATOM 0 HG21 VAL A 459 -5.516 -1.534 0.442 1.00 0.00 H new ATOM 0 HG22 VAL A 459 -5.649 -0.667 -1.106 1.00 0.00 H new ATOM 0 HG23 VAL A 459 -7.096 -1.389 -0.364 1.00 0.00 H new ATOM 129 N ARG A 460 -7.161 -5.103 -2.890 1.00 0.00 N ATOM 130 CA ARG A 460 -7.117 -6.455 -3.437 1.00 0.00 C ATOM 131 C ARG A 460 -7.325 -6.440 -4.948 1.00 0.00 C ATOM 132 O ARG A 460 -6.666 -7.176 -5.682 1.00 0.00 O ATOM 133 CB ARG A 460 -8.182 -7.329 -2.772 1.00 0.00 C ATOM 134 CG ARG A 460 -8.126 -8.787 -3.200 1.00 0.00 C ATOM 135 CD ARG A 460 -9.172 -9.620 -2.477 1.00 0.00 C ATOM 136 NE ARG A 460 -10.529 -9.282 -2.899 1.00 0.00 N ATOM 137 CZ ARG A 460 -11.587 -10.062 -2.688 1.00 0.00 C ATOM 138 NH1 ARG A 460 -11.449 -11.224 -2.061 1.00 0.00 N ATOM 139 NH2 ARG A 460 -12.787 -9.680 -3.105 1.00 0.00 N ATOM 0 H ARG A 460 -7.885 -4.956 -2.187 1.00 0.00 H new ATOM 0 HA ARG A 460 -6.131 -6.872 -3.230 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -8.064 -7.272 -1.690 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -9.168 -6.928 -3.006 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -8.283 -8.858 -4.276 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -7.134 -9.189 -2.996 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -8.987 -10.677 -2.665 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -9.078 -9.466 -1.402 1.00 0.00 H new ATOM 0 HE ARG A 460 -10.674 -8.396 -3.384 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -10.529 -11.523 -1.738 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -12.263 -11.818 -1.902 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -12.899 -8.788 -3.588 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -13.597 -10.278 -2.943 1.00 0.00 H new ATOM 153 N ARG A 461 -8.247 -5.599 -5.405 1.00 0.00 N ATOM 154 CA ARG A 461 -8.543 -5.491 -6.829 1.00 0.00 C ATOM 155 C ARG A 461 -7.308 -5.052 -7.610 1.00 0.00 C ATOM 156 O ARG A 461 -7.041 -5.555 -8.702 1.00 0.00 O ATOM 157 CB ARG A 461 -9.685 -4.500 -7.060 1.00 0.00 C ATOM 158 CG ARG A 461 -11.018 -4.966 -6.497 1.00 0.00 C ATOM 159 CD ARG A 461 -12.128 -3.973 -6.801 1.00 0.00 C ATOM 160 NE ARG A 461 -12.464 -3.946 -8.222 1.00 0.00 N ATOM 161 CZ ARG A 461 -13.601 -3.450 -8.706 1.00 0.00 C ATOM 162 NH1 ARG A 461 -14.512 -2.938 -7.886 1.00 0.00 N ATOM 163 NH2 ARG A 461 -13.828 -3.463 -10.012 1.00 0.00 N ATOM 0 H ARG A 461 -8.802 -4.983 -4.811 1.00 0.00 H new ATOM 0 HA ARG A 461 -8.846 -6.475 -7.187 1.00 0.00 H new ATOM 0 HB2 ARG A 461 -9.423 -3.544 -6.607 1.00 0.00 H new ATOM 0 HB3 ARG A 461 -9.793 -4.326 -8.131 1.00 0.00 H new ATOM 0 HG2 ARG A 461 -11.272 -5.938 -6.919 1.00 0.00 H new ATOM 0 HG3 ARG A 461 -10.932 -5.099 -5.419 1.00 0.00 H new ATOM 0 HD2 ARG A 461 -13.015 -4.233 -6.224 1.00 0.00 H new ATOM 0 HD3 ARG A 461 -11.821 -2.977 -6.482 1.00 0.00 H new ATOM 0 HE ARG A 461 -11.788 -4.330 -8.882 1.00 0.00 H new ATOM 0 HH11 ARG A 461 -14.342 -2.923 -6.880 1.00 0.00 H new ATOM 0 HH12 ARG A 461 -15.381 -2.559 -8.262 1.00 0.00 H new ATOM 0 HH21 ARG A 461 -13.131 -3.853 -10.647 1.00 0.00 H new ATOM 0 HH22 ARG A 461 -14.699 -3.083 -10.382 1.00 0.00 H new ATOM 177 N TYR A 462 -6.559 -4.111 -7.046 1.00 0.00 N ATOM 178 CA TYR A 462 -5.353 -3.605 -7.690 1.00 0.00 C ATOM 179 C TYR A 462 -4.263 -4.671 -7.723 1.00 0.00 C ATOM 180 O TYR A 462 -3.615 -4.880 -8.748 1.00 0.00 O ATOM 181 CB TYR A 462 -4.844 -2.360 -6.962 1.00 0.00 C ATOM 182 CG TYR A 462 -5.833 -1.217 -6.951 1.00 0.00 C ATOM 183 CD1 TYR A 462 -6.459 -0.803 -8.121 1.00 0.00 C ATOM 184 CD2 TYR A 462 -6.140 -0.549 -5.772 1.00 0.00 C ATOM 185 CE1 TYR A 462 -7.363 0.241 -8.115 1.00 0.00 C ATOM 186 CE2 TYR A 462 -7.044 0.496 -5.758 1.00 0.00 C ATOM 187 CZ TYR A 462 -7.652 0.887 -6.932 1.00 0.00 C ATOM 188 OH TYR A 462 -8.552 1.928 -6.922 1.00 0.00 O ATOM 0 H TYR A 462 -6.766 -3.683 -6.144 1.00 0.00 H new ATOM 0 HA TYR A 462 -5.605 -3.339 -8.717 1.00 0.00 H new ATOM 0 HB2 TYR A 462 -4.598 -2.626 -5.934 1.00 0.00 H new ATOM 0 HB3 TYR A 462 -3.920 -2.025 -7.435 1.00 0.00 H new ATOM 0 HD1 TYR A 462 -6.235 -1.306 -9.050 1.00 0.00 H new ATOM 0 HD2 TYR A 462 -5.664 -0.852 -4.851 1.00 0.00 H new ATOM 0 HE1 TYR A 462 -7.841 0.550 -9.033 1.00 0.00 H new ATOM 0 HE2 TYR A 462 -7.273 1.004 -4.833 1.00 0.00 H new ATOM 0 HH TYR A 462 -8.643 2.273 -6.009 1.00 0.00 H new ATOM 198 N LEU A 463 -4.066 -5.344 -6.593 1.00 0.00 N ATOM 199 CA LEU A 463 -3.055 -6.389 -6.493 1.00 0.00 C ATOM 200 C LEU A 463 -3.411 -7.579 -7.377 1.00 0.00 C ATOM 201 O LEU A 463 -2.534 -8.221 -7.955 1.00 0.00 O ATOM 202 CB LEU A 463 -2.904 -6.844 -5.040 1.00 0.00 C ATOM 203 CG LEU A 463 -2.392 -5.773 -4.077 1.00 0.00 C ATOM 204 CD1 LEU A 463 -2.553 -6.229 -2.636 1.00 0.00 C ATOM 205 CD2 LEU A 463 -0.937 -5.443 -4.374 1.00 0.00 C ATOM 0 H LEU A 463 -4.593 -5.184 -5.735 1.00 0.00 H new ATOM 0 HA LEU A 463 -2.107 -5.976 -6.838 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -3.871 -7.199 -4.684 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -2.222 -7.694 -5.010 1.00 0.00 H new ATOM 0 HG LEU A 463 -2.986 -4.870 -4.218 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -2.183 -5.453 -1.965 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -3.607 -6.415 -2.429 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -1.985 -7.146 -2.479 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -0.588 -4.679 -3.679 1.00 0.00 H new ATOM 0 HD22 LEU A 463 -0.330 -6.341 -4.260 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -0.849 -5.072 -5.395 1.00 0.00 H new ATOM 217 N THR A 464 -4.705 -7.867 -7.479 1.00 0.00 N ATOM 218 CA THR A 464 -5.178 -8.978 -8.294 1.00 0.00 C ATOM 219 C THR A 464 -4.868 -8.742 -9.768 1.00 0.00 C ATOM 220 O THR A 464 -4.644 -9.686 -10.524 1.00 0.00 O ATOM 221 CB THR A 464 -6.682 -9.171 -8.100 1.00 0.00 C ATOM 222 OG1 THR A 464 -7.334 -7.920 -7.968 1.00 0.00 O ATOM 223 CG2 THR A 464 -7.027 -10.000 -6.881 1.00 0.00 C ATOM 0 H THR A 464 -5.444 -7.346 -7.007 1.00 0.00 H new ATOM 0 HA THR A 464 -4.658 -9.881 -7.974 1.00 0.00 H new ATOM 0 HB THR A 464 -7.023 -9.703 -8.988 1.00 0.00 H new ATOM 0 HG1 THR A 464 -7.023 -7.313 -8.672 1.00 0.00 H new ATOM 0 HG21 THR A 464 -8.110 -10.098 -6.802 1.00 0.00 H new ATOM 0 HG22 THR A 464 -6.579 -10.989 -6.975 1.00 0.00 H new ATOM 0 HG23 THR A 464 -6.641 -9.510 -5.987 1.00 0.00 H new ATOM 231 N ARG A 465 -4.859 -7.475 -10.169 1.00 0.00 N ATOM 232 CA ARG A 465 -4.575 -7.113 -11.553 1.00 0.00 C ATOM 233 C ARG A 465 -3.075 -7.089 -11.811 1.00 0.00 C ATOM 234 O ARG A 465 -2.566 -7.819 -12.661 1.00 0.00 O ATOM 235 CB ARG A 465 -5.184 -5.749 -11.881 1.00 0.00 C ATOM 236 CG ARG A 465 -5.026 -5.346 -13.338 1.00 0.00 C ATOM 237 CD ARG A 465 -5.666 -3.996 -13.617 1.00 0.00 C ATOM 238 NE ARG A 465 -7.113 -4.022 -13.415 1.00 0.00 N ATOM 239 CZ ARG A 465 -7.707 -3.795 -12.243 1.00 0.00 C ATOM 240 NH1 ARG A 465 -6.984 -3.523 -11.163 1.00 0.00 N ATOM 241 NH2 ARG A 465 -9.029 -3.840 -12.153 1.00 0.00 N ATOM 0 H ARG A 465 -5.045 -6.682 -9.555 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.024 -7.867 -12.199 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -6.245 -5.764 -11.630 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.718 -4.991 -11.251 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -3.967 -5.307 -13.593 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -5.480 -6.104 -13.977 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -5.223 -3.243 -12.965 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -5.449 -3.697 -14.642 1.00 0.00 H new ATOM 0 HE ARG A 465 -7.705 -4.226 -14.220 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -5.967 -3.487 -11.226 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -7.446 -3.351 -10.270 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -9.590 -4.048 -12.979 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -9.485 -3.667 -11.257 1.00 0.00 H new ATOM 255 N LYS A 466 -2.374 -6.243 -11.071 1.00 0.00 N ATOM 256 CA LYS A 466 -0.928 -6.115 -11.212 1.00 0.00 C ATOM 257 C LYS A 466 -0.275 -5.810 -9.865 1.00 0.00 C ATOM 258 O LYS A 466 -0.884 -5.182 -8.999 1.00 0.00 O ATOM 259 CB LYS A 466 -0.588 -5.014 -12.218 1.00 0.00 C ATOM 260 CG LYS A 466 -1.298 -3.699 -11.944 1.00 0.00 C ATOM 261 CD LYS A 466 -1.637 -2.970 -13.234 1.00 0.00 C ATOM 262 CE LYS A 466 -0.383 -2.572 -13.995 1.00 0.00 C ATOM 263 NZ LYS A 466 -0.612 -2.537 -15.466 1.00 0.00 N ATOM 0 H LYS A 466 -2.783 -5.632 -10.364 1.00 0.00 H new ATOM 0 HA LYS A 466 -0.538 -7.065 -11.578 1.00 0.00 H new ATOM 0 HB2 LYS A 466 0.489 -4.845 -12.209 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -0.848 -5.356 -13.220 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -2.212 -3.888 -11.381 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -0.666 -3.065 -11.322 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -2.258 -3.609 -13.862 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -2.224 -2.080 -13.007 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -0.049 -1.591 -13.656 1.00 0.00 H new ATOM 0 HE3 LYS A 466 0.417 -3.277 -13.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 0.267 -2.261 -15.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -0.906 -3.479 -15.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -1.358 -1.846 -15.685 1.00 0.00 H new ATOM 277 N PRO A 467 0.980 -6.252 -9.673 1.00 0.00 N ATOM 278 CA PRO A 467 1.714 -6.021 -8.424 1.00 0.00 C ATOM 279 C PRO A 467 2.048 -4.548 -8.214 1.00 0.00 C ATOM 280 O PRO A 467 2.436 -3.849 -9.150 1.00 0.00 O ATOM 281 CB PRO A 467 2.996 -6.840 -8.605 1.00 0.00 C ATOM 282 CG PRO A 467 3.169 -6.957 -10.079 1.00 0.00 C ATOM 283 CD PRO A 467 1.780 -7.006 -10.654 1.00 0.00 C ATOM 0 HA PRO A 467 1.130 -6.309 -7.550 1.00 0.00 H new ATOM 0 HB2 PRO A 467 3.850 -6.344 -8.145 1.00 0.00 H new ATOM 0 HB3 PRO A 467 2.908 -7.821 -8.138 1.00 0.00 H new ATOM 0 HG2 PRO A 467 3.726 -6.108 -10.476 1.00 0.00 H new ATOM 0 HG3 PRO A 467 3.730 -7.855 -10.336 1.00 0.00 H new ATOM 0 HD2 PRO A 467 1.738 -6.550 -11.643 1.00 0.00 H new ATOM 0 HD3 PRO A 467 1.425 -8.031 -10.760 1.00 0.00 H new ATOM 291 N MET A 468 1.894 -4.081 -6.978 1.00 0.00 N ATOM 292 CA MET A 468 2.178 -2.690 -6.646 1.00 0.00 C ATOM 293 C MET A 468 3.030 -2.594 -5.385 1.00 0.00 C ATOM 294 O MET A 468 2.958 -3.455 -4.508 1.00 0.00 O ATOM 295 CB MET A 468 0.874 -1.914 -6.455 1.00 0.00 C ATOM 296 CG MET A 468 -0.012 -1.901 -7.690 1.00 0.00 C ATOM 297 SD MET A 468 -1.500 -0.907 -7.467 1.00 0.00 S ATOM 298 CE MET A 468 -0.815 0.747 -7.521 1.00 0.00 C ATOM 0 H MET A 468 1.574 -4.646 -6.191 1.00 0.00 H new ATOM 0 HA MET A 468 2.736 -2.252 -7.473 1.00 0.00 H new ATOM 0 HB2 MET A 468 0.319 -2.351 -5.625 1.00 0.00 H new ATOM 0 HB3 MET A 468 1.109 -0.887 -6.176 1.00 0.00 H new ATOM 0 HG2 MET A 468 0.556 -1.513 -8.536 1.00 0.00 H new ATOM 0 HG3 MET A 468 -0.297 -2.923 -7.939 1.00 0.00 H new ATOM 0 HE1 MET A 468 -1.615 1.476 -7.397 1.00 0.00 H new ATOM 0 HE2 MET A 468 -0.088 0.866 -6.718 1.00 0.00 H new ATOM 0 HE3 MET A 468 -0.325 0.907 -8.481 1.00 0.00 H new ATOM 308 N THR A 469 3.834 -1.539 -5.299 1.00 0.00 N ATOM 309 CA THR A 469 4.698 -1.327 -4.143 1.00 0.00 C ATOM 310 C THR A 469 3.994 -0.481 -3.087 1.00 0.00 C ATOM 311 O THR A 469 2.970 0.145 -3.363 1.00 0.00 O ATOM 312 CB THR A 469 6.001 -0.650 -4.569 1.00 0.00 C ATOM 313 OG1 THR A 469 5.757 0.671 -5.018 1.00 0.00 O ATOM 314 CG2 THR A 469 6.725 -1.385 -5.677 1.00 0.00 C ATOM 0 H THR A 469 3.905 -0.817 -6.016 1.00 0.00 H new ATOM 0 HA THR A 469 4.928 -2.301 -3.710 1.00 0.00 H new ATOM 0 HB THR A 469 6.632 -0.655 -3.680 1.00 0.00 H new ATOM 0 HG1 THR A 469 6.603 1.088 -5.284 1.00 0.00 H new ATOM 0 HG21 THR A 469 7.641 -0.851 -5.930 1.00 0.00 H new ATOM 0 HG22 THR A 469 6.973 -2.393 -5.343 1.00 0.00 H new ATOM 0 HG23 THR A 469 6.083 -1.442 -6.556 1.00 0.00 H new ATOM 322 N THR A 470 4.547 -0.467 -1.879 1.00 0.00 N ATOM 323 CA THR A 470 3.970 0.304 -0.783 1.00 0.00 C ATOM 324 C THR A 470 3.861 1.781 -1.152 1.00 0.00 C ATOM 325 O THR A 470 2.837 2.418 -0.906 1.00 0.00 O ATOM 326 CB THR A 470 4.815 0.146 0.482 1.00 0.00 C ATOM 327 OG1 THR A 470 6.175 0.439 0.218 1.00 0.00 O ATOM 328 CG2 THR A 470 4.751 -1.245 1.075 1.00 0.00 C ATOM 0 H THR A 470 5.394 -0.980 -1.634 1.00 0.00 H new ATOM 0 HA THR A 470 2.968 -0.080 -0.593 1.00 0.00 H new ATOM 0 HB THR A 470 4.393 0.849 1.200 1.00 0.00 H new ATOM 0 HG1 THR A 470 6.463 1.188 0.780 1.00 0.00 H new ATOM 0 HG21 THR A 470 5.372 -1.288 1.969 1.00 0.00 H new ATOM 0 HG22 THR A 470 3.720 -1.481 1.338 1.00 0.00 H new ATOM 0 HG23 THR A 470 5.115 -1.969 0.345 1.00 0.00 H new ATOM 336 N LYS A 471 4.923 2.317 -1.743 1.00 0.00 N ATOM 337 CA LYS A 471 4.945 3.717 -2.146 1.00 0.00 C ATOM 338 C LYS A 471 3.837 4.012 -3.152 1.00 0.00 C ATOM 339 O LYS A 471 3.142 5.022 -3.046 1.00 0.00 O ATOM 340 CB LYS A 471 6.304 4.074 -2.752 1.00 0.00 C ATOM 341 CG LYS A 471 7.456 3.967 -1.766 1.00 0.00 C ATOM 342 CD LYS A 471 8.761 4.447 -2.380 1.00 0.00 C ATOM 343 CE LYS A 471 9.936 4.218 -1.443 1.00 0.00 C ATOM 344 NZ LYS A 471 10.958 5.295 -1.559 1.00 0.00 N ATOM 0 H LYS A 471 5.779 1.803 -1.953 1.00 0.00 H new ATOM 0 HA LYS A 471 4.778 4.326 -1.258 1.00 0.00 H new ATOM 0 HB2 LYS A 471 6.499 3.416 -3.599 1.00 0.00 H new ATOM 0 HB3 LYS A 471 6.263 5.091 -3.141 1.00 0.00 H new ATOM 0 HG2 LYS A 471 7.232 4.557 -0.878 1.00 0.00 H new ATOM 0 HG3 LYS A 471 7.564 2.932 -1.442 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.936 3.923 -3.320 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.684 5.508 -2.616 1.00 0.00 H new ATOM 0 HE2 LYS A 471 9.576 4.168 -0.415 1.00 0.00 H new ATOM 0 HE3 LYS A 471 10.396 3.255 -1.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 11.842 4.984 -1.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 11.134 5.499 -2.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 10.612 6.154 -1.086 1.00 0.00 H new ATOM 358 N ASP A 472 3.677 3.124 -4.127 1.00 0.00 N ATOM 359 CA ASP A 472 2.653 3.288 -5.153 1.00 0.00 C ATOM 360 C ASP A 472 1.263 3.358 -4.529 1.00 0.00 C ATOM 361 O ASP A 472 0.405 4.116 -4.983 1.00 0.00 O ATOM 362 CB ASP A 472 2.717 2.136 -6.157 1.00 0.00 C ATOM 363 CG ASP A 472 1.872 2.393 -7.390 1.00 0.00 C ATOM 364 OD1 ASP A 472 1.344 3.517 -7.526 1.00 0.00 O ATOM 365 OD2 ASP A 472 1.738 1.470 -8.221 1.00 0.00 O ATOM 0 H ASP A 472 4.244 2.282 -4.229 1.00 0.00 H new ATOM 0 HA ASP A 472 2.845 4.226 -5.675 1.00 0.00 H new ATOM 0 HB2 ASP A 472 3.753 1.977 -6.457 1.00 0.00 H new ATOM 0 HB3 ASP A 472 2.380 1.218 -5.674 1.00 0.00 H new ATOM 370 N LEU A 473 1.049 2.565 -3.487 1.00 0.00 N ATOM 371 CA LEU A 473 -0.237 2.535 -2.799 1.00 0.00 C ATOM 372 C LEU A 473 -0.509 3.860 -2.095 1.00 0.00 C ATOM 373 O LEU A 473 -1.625 4.378 -2.134 1.00 0.00 O ATOM 374 CB LEU A 473 -0.271 1.390 -1.785 1.00 0.00 C ATOM 375 CG LEU A 473 -0.159 -0.012 -2.388 1.00 0.00 C ATOM 376 CD1 LEU A 473 -0.271 -1.070 -1.302 1.00 0.00 C ATOM 377 CD2 LEU A 473 -1.229 -0.221 -3.450 1.00 0.00 C ATOM 0 H LEU A 473 1.749 1.933 -3.099 1.00 0.00 H new ATOM 0 HA LEU A 473 -1.015 2.374 -3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 473 0.544 1.530 -1.075 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -1.201 1.453 -1.220 1.00 0.00 H new ATOM 0 HG LEU A 473 0.819 -0.107 -2.860 1.00 0.00 H new ATOM 0 HD11 LEU A 473 -0.189 -2.061 -1.749 1.00 0.00 H new ATOM 0 HD12 LEU A 473 0.530 -0.932 -0.576 1.00 0.00 H new ATOM 0 HD13 LEU A 473 -1.235 -0.977 -0.801 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -1.135 -1.223 -3.869 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -2.215 -0.106 -3.000 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -1.104 0.517 -4.243 1.00 0.00 H new ATOM 389 N LEU A 474 0.518 4.406 -1.453 1.00 0.00 N ATOM 390 CA LEU A 474 0.389 5.672 -0.741 1.00 0.00 C ATOM 391 C LEU A 474 0.295 6.840 -1.718 1.00 0.00 C ATOM 392 O LEU A 474 -0.489 7.767 -1.517 1.00 0.00 O ATOM 393 CB LEU A 474 1.575 5.875 0.204 1.00 0.00 C ATOM 394 CG LEU A 474 1.253 6.634 1.492 1.00 0.00 C ATOM 395 CD1 LEU A 474 0.597 7.970 1.174 1.00 0.00 C ATOM 396 CD2 LEU A 474 0.356 5.799 2.392 1.00 0.00 C ATOM 0 H LEU A 474 1.449 3.992 -1.411 1.00 0.00 H new ATOM 0 HA LEU A 474 -0.530 5.638 -0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 474 1.981 4.899 0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 474 2.358 6.413 -0.331 1.00 0.00 H new ATOM 0 HG LEU A 474 2.186 6.827 2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 474 0.375 8.496 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 474 1.274 8.573 0.568 1.00 0.00 H new ATOM 0 HD13 LEU A 474 -0.328 7.799 0.623 1.00 0.00 H new ATOM 0 HD21 LEU A 474 0.137 6.355 3.304 1.00 0.00 H new ATOM 0 HD22 LEU A 474 -0.575 5.575 1.871 1.00 0.00 H new ATOM 0 HD23 LEU A 474 0.862 4.868 2.647 1.00 0.00 H new ATOM 408 N LYS A 475 1.097 6.787 -2.777 1.00 0.00 N ATOM 409 CA LYS A 475 1.100 7.841 -3.786 1.00 0.00 C ATOM 410 C LYS A 475 -0.280 7.989 -4.419 1.00 0.00 C ATOM 411 O LYS A 475 -0.701 9.094 -4.762 1.00 0.00 O ATOM 412 CB LYS A 475 2.141 7.542 -4.865 1.00 0.00 C ATOM 413 CG LYS A 475 3.573 7.757 -4.405 1.00 0.00 C ATOM 414 CD LYS A 475 4.564 7.500 -5.528 1.00 0.00 C ATOM 415 CE LYS A 475 6.000 7.611 -5.041 1.00 0.00 C ATOM 416 NZ LYS A 475 6.591 8.942 -5.352 1.00 0.00 N ATOM 0 H LYS A 475 1.752 6.027 -2.959 1.00 0.00 H new ATOM 0 HA LYS A 475 1.358 8.779 -3.295 1.00 0.00 H new ATOM 0 HB2 LYS A 475 2.025 6.509 -5.194 1.00 0.00 H new ATOM 0 HB3 LYS A 475 1.947 8.176 -5.731 1.00 0.00 H new ATOM 0 HG2 LYS A 475 3.690 8.778 -4.042 1.00 0.00 H new ATOM 0 HG3 LYS A 475 3.791 7.094 -3.568 1.00 0.00 H new ATOM 0 HD2 LYS A 475 4.395 6.506 -5.943 1.00 0.00 H new ATOM 0 HD3 LYS A 475 4.396 8.215 -6.334 1.00 0.00 H new ATOM 0 HE2 LYS A 475 6.032 7.442 -3.965 1.00 0.00 H new ATOM 0 HE3 LYS A 475 6.602 6.829 -5.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 475 7.570 8.977 -5.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 475 6.584 9.093 -6.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 475 6.032 9.687 -4.889 1.00 0.00 H new ATOM 430 N LYS A 476 -0.981 6.869 -4.567 1.00 0.00 N ATOM 431 CA LYS A 476 -2.315 6.875 -5.157 1.00 0.00 C ATOM 432 C LYS A 476 -3.258 7.755 -4.344 1.00 0.00 C ATOM 433 O LYS A 476 -4.141 8.413 -4.895 1.00 0.00 O ATOM 434 CB LYS A 476 -2.866 5.450 -5.233 1.00 0.00 C ATOM 435 CG LYS A 476 -4.119 5.326 -6.084 1.00 0.00 C ATOM 436 CD LYS A 476 -3.793 5.379 -7.567 1.00 0.00 C ATOM 437 CE LYS A 476 -5.005 5.032 -8.417 1.00 0.00 C ATOM 438 NZ LYS A 476 -4.896 5.587 -9.794 1.00 0.00 N ATOM 0 H LYS A 476 -0.648 5.947 -4.287 1.00 0.00 H new ATOM 0 HA LYS A 476 -2.242 7.282 -6.165 1.00 0.00 H new ATOM 0 HB2 LYS A 476 -2.096 4.793 -5.637 1.00 0.00 H new ATOM 0 HB3 LYS A 476 -3.086 5.100 -4.224 1.00 0.00 H new ATOM 0 HG2 LYS A 476 -4.624 4.388 -5.855 1.00 0.00 H new ATOM 0 HG3 LYS A 476 -4.811 6.130 -5.834 1.00 0.00 H new ATOM 0 HD2 LYS A 476 -3.438 6.376 -7.827 1.00 0.00 H new ATOM 0 HD3 LYS A 476 -2.982 4.685 -7.787 1.00 0.00 H new ATOM 0 HE2 LYS A 476 -5.113 3.949 -8.470 1.00 0.00 H new ATOM 0 HE3 LYS A 476 -5.905 5.419 -7.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 -5.742 5.328 -10.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 -4.819 6.623 -9.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 -4.051 5.198 -10.259 1.00 0.00 H new ATOM 452 N PHE A 477 -3.062 7.764 -3.029 1.00 0.00 N ATOM 453 CA PHE A 477 -3.890 8.564 -2.134 1.00 0.00 C ATOM 454 C PHE A 477 -3.021 9.392 -1.192 1.00 0.00 C ATOM 455 O PHE A 477 -3.338 9.546 -0.014 1.00 0.00 O ATOM 456 CB PHE A 477 -4.824 7.661 -1.327 1.00 0.00 C ATOM 457 CG PHE A 477 -5.809 6.906 -2.173 1.00 0.00 C ATOM 458 CD1 PHE A 477 -5.471 5.683 -2.729 1.00 0.00 C ATOM 459 CD2 PHE A 477 -7.074 7.420 -2.411 1.00 0.00 C ATOM 460 CE1 PHE A 477 -6.376 4.986 -3.508 1.00 0.00 C ATOM 461 CE2 PHE A 477 -7.983 6.728 -3.189 1.00 0.00 C ATOM 462 CZ PHE A 477 -7.633 5.510 -3.738 1.00 0.00 C ATOM 0 H PHE A 477 -2.335 7.225 -2.559 1.00 0.00 H new ATOM 0 HA PHE A 477 -4.490 9.243 -2.739 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -4.226 6.949 -0.758 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -5.369 8.269 -0.605 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -4.489 5.269 -2.552 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -7.353 8.372 -1.984 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -6.100 4.033 -3.936 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -8.966 7.139 -3.367 1.00 0.00 H new ATOM 0 HZ PHE A 477 -8.342 4.968 -4.347 1.00 0.00 H new ATOM 472 N GLN A 478 -1.922 9.920 -1.723 1.00 0.00 N ATOM 473 CA GLN A 478 -1.001 10.730 -0.932 1.00 0.00 C ATOM 474 C GLN A 478 -1.723 11.904 -0.277 1.00 0.00 C ATOM 475 O GLN A 478 -1.494 12.210 0.893 1.00 0.00 O ATOM 476 CB GLN A 478 0.138 11.247 -1.812 1.00 0.00 C ATOM 477 CG GLN A 478 1.173 12.060 -1.052 1.00 0.00 C ATOM 478 CD GLN A 478 2.188 12.715 -1.969 1.00 0.00 C ATOM 479 OE1 GLN A 478 1.827 13.359 -2.955 1.00 0.00 O ATOM 480 NE2 GLN A 478 3.466 12.553 -1.650 1.00 0.00 N ATOM 0 H GLN A 478 -1.647 9.801 -2.698 1.00 0.00 H new ATOM 0 HA GLN A 478 -0.590 10.098 -0.145 1.00 0.00 H new ATOM 0 HB2 GLN A 478 0.632 10.400 -2.288 1.00 0.00 H new ATOM 0 HB3 GLN A 478 -0.280 11.861 -2.609 1.00 0.00 H new ATOM 0 HG2 GLN A 478 0.668 12.829 -0.467 1.00 0.00 H new ATOM 0 HG3 GLN A 478 1.692 11.412 -0.346 1.00 0.00 H new ATOM 0 HE21 GLN A 478 3.721 12.012 -0.824 1.00 0.00 H new ATOM 0 HE22 GLN A 478 4.193 12.970 -2.231 1.00 0.00 H new ATOM 489 N THR A 479 -2.595 12.558 -1.038 1.00 0.00 N ATOM 490 CA THR A 479 -3.347 13.697 -0.527 1.00 0.00 C ATOM 491 C THR A 479 -4.613 13.928 -1.346 1.00 0.00 C ATOM 492 O THR A 479 -4.615 14.709 -2.298 1.00 0.00 O ATOM 493 CB THR A 479 -2.479 14.956 -0.543 1.00 0.00 C ATOM 494 OG1 THR A 479 -1.556 14.914 -1.618 1.00 0.00 O ATOM 495 CG2 THR A 479 -1.691 15.157 0.732 1.00 0.00 C ATOM 0 H THR A 479 -2.798 12.319 -2.009 1.00 0.00 H new ATOM 0 HA THR A 479 -3.637 13.476 0.500 1.00 0.00 H new ATOM 0 HB THR A 479 -3.176 15.786 -0.653 1.00 0.00 H new ATOM 0 HG1 THR A 479 -1.011 15.728 -1.613 1.00 0.00 H new ATOM 0 HG21 THR A 479 -1.097 16.068 0.653 1.00 0.00 H new ATOM 0 HG22 THR A 479 -2.378 15.243 1.574 1.00 0.00 H new ATOM 0 HG23 THR A 479 -1.029 14.305 0.889 1.00 0.00 H new ATOM 503 N LYS A 480 -5.689 13.245 -0.969 1.00 0.00 N ATOM 504 CA LYS A 480 -6.962 13.376 -1.668 1.00 0.00 C ATOM 505 C LYS A 480 -8.072 13.781 -0.703 1.00 0.00 C ATOM 506 O LYS A 480 -7.907 13.705 0.514 1.00 0.00 O ATOM 507 CB LYS A 480 -7.327 12.062 -2.362 1.00 0.00 C ATOM 508 CG LYS A 480 -6.359 11.669 -3.466 1.00 0.00 C ATOM 509 CD LYS A 480 -6.829 10.425 -4.202 1.00 0.00 C ATOM 510 CE LYS A 480 -8.018 10.726 -5.102 1.00 0.00 C ATOM 511 NZ LYS A 480 -9.006 9.613 -5.109 1.00 0.00 N ATOM 0 H LYS A 480 -5.705 12.595 -0.183 1.00 0.00 H new ATOM 0 HA LYS A 480 -6.856 14.157 -2.421 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -7.361 11.265 -1.619 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -8.329 12.149 -2.782 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -6.256 12.493 -4.172 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -5.372 11.490 -3.039 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -6.011 10.024 -4.800 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -7.103 9.656 -3.480 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -8.505 11.641 -4.766 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -7.667 10.906 -6.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -9.176 9.306 -6.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -8.634 8.815 -4.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -9.899 9.939 -4.689 1.00 0.00 H new ATOM 525 N LYS A 481 -9.203 14.211 -1.254 1.00 0.00 N ATOM 526 CA LYS A 481 -10.339 14.629 -0.441 1.00 0.00 C ATOM 527 C LYS A 481 -10.989 13.430 0.245 1.00 0.00 C ATOM 528 O LYS A 481 -12.136 13.085 -0.039 1.00 0.00 O ATOM 529 CB LYS A 481 -11.369 15.360 -1.305 1.00 0.00 C ATOM 530 CG LYS A 481 -11.975 14.490 -2.396 1.00 0.00 C ATOM 531 CD LYS A 481 -11.632 15.011 -3.782 1.00 0.00 C ATOM 532 CE LYS A 481 -12.468 16.228 -4.144 1.00 0.00 C ATOM 533 NZ LYS A 481 -11.691 17.221 -4.935 1.00 0.00 N ATOM 0 H LYS A 481 -9.357 14.279 -2.260 1.00 0.00 H new ATOM 0 HA LYS A 481 -9.973 15.309 0.329 1.00 0.00 H new ATOM 0 HB2 LYS A 481 -12.168 15.735 -0.665 1.00 0.00 H new ATOM 0 HB3 LYS A 481 -10.895 16.228 -1.765 1.00 0.00 H new ATOM 0 HG2 LYS A 481 -11.612 13.468 -2.291 1.00 0.00 H new ATOM 0 HG3 LYS A 481 -13.058 14.457 -2.277 1.00 0.00 H new ATOM 0 HD2 LYS A 481 -10.574 15.270 -3.823 1.00 0.00 H new ATOM 0 HD3 LYS A 481 -11.796 14.224 -4.518 1.00 0.00 H new ATOM 0 HE2 LYS A 481 -13.341 15.912 -4.715 1.00 0.00 H new ATOM 0 HE3 LYS A 481 -12.837 16.699 -3.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 -12.297 18.035 -5.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 -10.872 17.542 -4.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 -11.360 16.780 -5.817 1.00 0.00 H new ATOM 547 N THR A 482 -10.247 12.799 1.149 1.00 0.00 N ATOM 548 CA THR A 482 -10.750 11.640 1.877 1.00 0.00 C ATOM 549 C THR A 482 -11.350 12.053 3.218 1.00 0.00 C ATOM 550 O THR A 482 -12.205 11.358 3.767 1.00 0.00 O ATOM 551 CB THR A 482 -9.626 10.626 2.100 1.00 0.00 C ATOM 552 OG1 THR A 482 -8.640 11.153 2.969 1.00 0.00 O ATOM 553 CG2 THR A 482 -8.935 10.207 0.819 1.00 0.00 C ATOM 0 H THR A 482 -9.295 13.071 1.395 1.00 0.00 H new ATOM 0 HA THR A 482 -11.535 11.180 1.277 1.00 0.00 H new ATOM 0 HB THR A 482 -10.108 9.751 2.536 1.00 0.00 H new ATOM 0 HG1 THR A 482 -7.931 10.489 3.100 1.00 0.00 H new ATOM 0 HG21 THR A 482 -8.149 9.487 1.048 1.00 0.00 H new ATOM 0 HG22 THR A 482 -9.661 9.750 0.147 1.00 0.00 H new ATOM 0 HG23 THR A 482 -8.497 11.082 0.339 1.00 0.00 H new ATOM 561 N GLY A 483 -10.896 13.188 3.742 1.00 0.00 N ATOM 562 CA GLY A 483 -11.399 13.671 5.014 1.00 0.00 C ATOM 563 C GLY A 483 -10.394 13.504 6.137 1.00 0.00 C ATOM 564 O GLY A 483 -10.420 14.249 7.117 1.00 0.00 O ATOM 0 H GLY A 483 -10.189 13.781 3.308 1.00 0.00 H new ATOM 0 HA2 GLY A 483 -11.663 14.724 4.920 1.00 0.00 H new ATOM 0 HA3 GLY A 483 -12.314 13.135 5.267 1.00 0.00 H new ATOM 568 N LEU A 484 -9.508 12.525 5.995 1.00 0.00 N ATOM 569 CA LEU A 484 -8.489 12.263 7.005 1.00 0.00 C ATOM 570 C LEU A 484 -7.129 12.784 6.553 1.00 0.00 C ATOM 571 O LEU A 484 -6.819 12.788 5.361 1.00 0.00 O ATOM 572 CB LEU A 484 -8.403 10.764 7.296 1.00 0.00 C ATOM 573 CG LEU A 484 -9.729 10.098 7.667 1.00 0.00 C ATOM 574 CD1 LEU A 484 -9.554 8.591 7.787 1.00 0.00 C ATOM 575 CD2 LEU A 484 -10.273 10.677 8.965 1.00 0.00 C ATOM 0 H LEU A 484 -9.475 11.899 5.190 1.00 0.00 H new ATOM 0 HA LEU A 484 -8.774 12.787 7.917 1.00 0.00 H new ATOM 0 HB2 LEU A 484 -7.995 10.262 6.419 1.00 0.00 H new ATOM 0 HB3 LEU A 484 -7.695 10.608 8.110 1.00 0.00 H new ATOM 0 HG LEU A 484 -10.448 10.299 6.873 1.00 0.00 H new ATOM 0 HD11 LEU A 484 -10.508 8.134 8.052 1.00 0.00 H new ATOM 0 HD12 LEU A 484 -9.210 8.188 6.835 1.00 0.00 H new ATOM 0 HD13 LEU A 484 -8.819 8.371 8.561 1.00 0.00 H new ATOM 0 HD21 LEU A 484 -11.217 10.191 9.213 1.00 0.00 H new ATOM 0 HD22 LEU A 484 -9.556 10.507 9.768 1.00 0.00 H new ATOM 0 HD23 LEU A 484 -10.437 11.748 8.845 1.00 0.00 H new ATOM 587 N SER A 485 -6.319 13.224 7.511 1.00 0.00 N ATOM 588 CA SER A 485 -4.992 13.747 7.212 1.00 0.00 C ATOM 589 C SER A 485 -4.136 12.693 6.515 1.00 0.00 C ATOM 590 O SER A 485 -4.424 11.498 6.590 1.00 0.00 O ATOM 591 CB SER A 485 -4.303 14.214 8.494 1.00 0.00 C ATOM 592 OG SER A 485 -5.108 15.145 9.197 1.00 0.00 O ATOM 0 H SER A 485 -6.560 13.228 8.502 1.00 0.00 H new ATOM 0 HA SER A 485 -5.108 14.598 6.540 1.00 0.00 H new ATOM 0 HB2 SER A 485 -4.094 13.355 9.132 1.00 0.00 H new ATOM 0 HB3 SER A 485 -3.344 14.670 8.249 1.00 0.00 H new ATOM 0 HG SER A 485 -4.645 15.427 10.014 1.00 0.00 H new ATOM 598 N SER A 486 -3.084 13.144 5.839 1.00 0.00 N ATOM 599 CA SER A 486 -2.187 12.239 5.129 1.00 0.00 C ATOM 600 C SER A 486 -1.591 11.204 6.078 1.00 0.00 C ATOM 601 O SER A 486 -1.456 10.032 5.729 1.00 0.00 O ATOM 602 CB SER A 486 -1.066 13.029 4.450 1.00 0.00 C ATOM 603 OG SER A 486 -1.592 14.039 3.606 1.00 0.00 O ATOM 0 H SER A 486 -2.832 14.130 5.768 1.00 0.00 H new ATOM 0 HA SER A 486 -2.768 11.716 4.369 1.00 0.00 H new ATOM 0 HB2 SER A 486 -0.425 13.481 5.207 1.00 0.00 H new ATOM 0 HB3 SER A 486 -0.442 12.352 3.867 1.00 0.00 H new ATOM 0 HG SER A 486 -0.867 14.629 3.312 1.00 0.00 H new ATOM 609 N GLU A 487 -1.238 11.646 7.281 1.00 0.00 N ATOM 610 CA GLU A 487 -0.659 10.757 8.281 1.00 0.00 C ATOM 611 C GLU A 487 -1.679 9.719 8.741 1.00 0.00 C ATOM 612 O GLU A 487 -1.345 8.551 8.938 1.00 0.00 O ATOM 613 CB GLU A 487 -0.158 11.562 9.482 1.00 0.00 C ATOM 614 CG GLU A 487 0.590 10.725 10.507 1.00 0.00 C ATOM 615 CD GLU A 487 0.994 11.522 11.732 1.00 0.00 C ATOM 616 OE1 GLU A 487 0.647 12.720 11.804 1.00 0.00 O ATOM 617 OE2 GLU A 487 1.657 10.948 12.621 1.00 0.00 O ATOM 0 H GLU A 487 -1.343 12.614 7.586 1.00 0.00 H new ATOM 0 HA GLU A 487 0.183 10.237 7.824 1.00 0.00 H new ATOM 0 HB2 GLU A 487 0.497 12.358 9.127 1.00 0.00 H new ATOM 0 HB3 GLU A 487 -1.008 12.041 9.967 1.00 0.00 H new ATOM 0 HG2 GLU A 487 -0.037 9.888 10.814 1.00 0.00 H new ATOM 0 HG3 GLU A 487 1.481 10.302 10.044 1.00 0.00 H new ATOM 624 N GLN A 488 -2.923 10.155 8.908 1.00 0.00 N ATOM 625 CA GLN A 488 -3.993 9.264 9.344 1.00 0.00 C ATOM 626 C GLN A 488 -4.234 8.162 8.317 1.00 0.00 C ATOM 627 O GLN A 488 -4.537 7.023 8.673 1.00 0.00 O ATOM 628 CB GLN A 488 -5.282 10.055 9.571 1.00 0.00 C ATOM 629 CG GLN A 488 -5.172 11.094 10.675 1.00 0.00 C ATOM 630 CD GLN A 488 -4.900 10.475 12.032 1.00 0.00 C ATOM 631 OE1 GLN A 488 -5.499 9.464 12.399 1.00 0.00 O ATOM 632 NE2 GLN A 488 -3.991 11.082 12.787 1.00 0.00 N ATOM 0 H GLN A 488 -3.215 11.119 8.748 1.00 0.00 H new ATOM 0 HA GLN A 488 -3.688 8.802 10.283 1.00 0.00 H new ATOM 0 HB2 GLN A 488 -5.562 10.552 8.642 1.00 0.00 H new ATOM 0 HB3 GLN A 488 -6.086 9.361 9.816 1.00 0.00 H new ATOM 0 HG2 GLN A 488 -4.372 11.794 10.432 1.00 0.00 H new ATOM 0 HG3 GLN A 488 -6.097 11.670 10.721 1.00 0.00 H new ATOM 0 HE21 GLN A 488 -3.518 11.918 12.443 1.00 0.00 H new ATOM 0 HE22 GLN A 488 -3.766 10.712 13.710 1.00 0.00 H new ATOM 641 N THR A 489 -4.098 8.510 7.041 1.00 0.00 N ATOM 642 CA THR A 489 -4.302 7.551 5.961 1.00 0.00 C ATOM 643 C THR A 489 -3.345 6.371 6.093 1.00 0.00 C ATOM 644 O THR A 489 -3.729 5.220 5.881 1.00 0.00 O ATOM 645 CB THR A 489 -4.109 8.231 4.605 1.00 0.00 C ATOM 646 OG1 THR A 489 -4.850 9.435 4.538 1.00 0.00 O ATOM 647 CG2 THR A 489 -4.530 7.368 3.436 1.00 0.00 C ATOM 0 H THR A 489 -3.848 9.449 6.730 1.00 0.00 H new ATOM 0 HA THR A 489 -5.323 7.176 6.029 1.00 0.00 H new ATOM 0 HB THR A 489 -3.038 8.421 4.528 1.00 0.00 H new ATOM 0 HG1 THR A 489 -4.712 9.856 3.664 1.00 0.00 H new ATOM 0 HG21 THR A 489 -4.367 7.911 2.505 1.00 0.00 H new ATOM 0 HG22 THR A 489 -3.940 6.451 3.430 1.00 0.00 H new ATOM 0 HG23 THR A 489 -5.587 7.119 3.530 1.00 0.00 H new ATOM 655 N VAL A 490 -2.098 6.663 6.443 1.00 0.00 N ATOM 656 CA VAL A 490 -1.085 5.627 6.603 1.00 0.00 C ATOM 657 C VAL A 490 -1.455 4.666 7.728 1.00 0.00 C ATOM 658 O VAL A 490 -1.233 3.461 7.626 1.00 0.00 O ATOM 659 CB VAL A 490 0.299 6.235 6.897 1.00 0.00 C ATOM 660 CG1 VAL A 490 1.369 5.154 6.915 1.00 0.00 C ATOM 661 CG2 VAL A 490 0.636 7.312 5.877 1.00 0.00 C ATOM 0 H VAL A 490 -1.764 7.610 6.622 1.00 0.00 H new ATOM 0 HA VAL A 490 -1.040 5.080 5.661 1.00 0.00 H new ATOM 0 HB VAL A 490 0.268 6.697 7.884 1.00 0.00 H new ATOM 0 HG11 VAL A 490 2.339 5.605 7.124 1.00 0.00 H new ATOM 0 HG12 VAL A 490 1.134 4.423 7.689 1.00 0.00 H new ATOM 0 HG13 VAL A 490 1.402 4.658 5.945 1.00 0.00 H new ATOM 0 HG21 VAL A 490 1.617 7.730 6.100 1.00 0.00 H new ATOM 0 HG22 VAL A 490 0.646 6.876 4.878 1.00 0.00 H new ATOM 0 HG23 VAL A 490 -0.114 8.102 5.921 1.00 0.00 H new ATOM 671 N ASN A 491 -2.020 5.210 8.802 1.00 0.00 N ATOM 672 CA ASN A 491 -2.419 4.400 9.948 1.00 0.00 C ATOM 673 C ASN A 491 -3.429 3.331 9.538 1.00 0.00 C ATOM 674 O ASN A 491 -3.318 2.173 9.942 1.00 0.00 O ATOM 675 CB ASN A 491 -3.016 5.288 11.042 1.00 0.00 C ATOM 676 CG ASN A 491 -3.176 4.552 12.358 1.00 0.00 C ATOM 677 OD1 ASN A 491 -2.670 3.444 12.529 1.00 0.00 O ATOM 678 ND2 ASN A 491 -3.884 5.169 13.297 1.00 0.00 N ATOM 0 H ASN A 491 -2.212 6.207 8.902 1.00 0.00 H new ATOM 0 HA ASN A 491 -1.530 3.903 10.335 1.00 0.00 H new ATOM 0 HB2 ASN A 491 -2.376 6.158 11.190 1.00 0.00 H new ATOM 0 HB3 ASN A 491 -3.987 5.659 10.716 1.00 0.00 H new ATOM 0 HD21 ASN A 491 -4.026 4.724 14.204 1.00 0.00 H new ATOM 0 HD22 ASN A 491 -4.286 6.088 13.112 1.00 0.00 H new ATOM 685 N VAL A 492 -4.412 3.727 8.736 1.00 0.00 N ATOM 686 CA VAL A 492 -5.440 2.802 8.275 1.00 0.00 C ATOM 687 C VAL A 492 -4.878 1.822 7.250 1.00 0.00 C ATOM 688 O VAL A 492 -5.080 0.613 7.358 1.00 0.00 O ATOM 689 CB VAL A 492 -6.633 3.552 7.652 1.00 0.00 C ATOM 690 CG1 VAL A 492 -7.753 2.583 7.301 1.00 0.00 C ATOM 691 CG2 VAL A 492 -7.134 4.637 8.594 1.00 0.00 C ATOM 0 H VAL A 492 -4.518 4.681 8.392 1.00 0.00 H new ATOM 0 HA VAL A 492 -5.785 2.251 9.150 1.00 0.00 H new ATOM 0 HB VAL A 492 -6.295 4.028 6.732 1.00 0.00 H new ATOM 0 HG11 VAL A 492 -8.586 3.133 6.862 1.00 0.00 H new ATOM 0 HG12 VAL A 492 -7.387 1.847 6.585 1.00 0.00 H new ATOM 0 HG13 VAL A 492 -8.090 2.074 8.204 1.00 0.00 H new ATOM 0 HG21 VAL A 492 -7.977 5.155 8.136 1.00 0.00 H new ATOM 0 HG22 VAL A 492 -7.453 4.185 9.533 1.00 0.00 H new ATOM 0 HG23 VAL A 492 -6.332 5.349 8.788 1.00 0.00 H new ATOM 701 N LEU A 493 -4.174 2.352 6.255 1.00 0.00 N ATOM 702 CA LEU A 493 -3.585 1.523 5.210 1.00 0.00 C ATOM 703 C LEU A 493 -2.516 0.598 5.782 1.00 0.00 C ATOM 704 O LEU A 493 -2.344 -0.529 5.318 1.00 0.00 O ATOM 705 CB LEU A 493 -2.978 2.401 4.113 1.00 0.00 C ATOM 706 CG LEU A 493 -3.971 2.906 3.064 1.00 0.00 C ATOM 707 CD1 LEU A 493 -4.865 3.988 3.651 1.00 0.00 C ATOM 708 CD2 LEU A 493 -3.231 3.431 1.842 1.00 0.00 C ATOM 0 H LEU A 493 -3.998 3.351 6.151 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.378 0.911 4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -2.498 3.261 4.581 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -2.195 1.835 3.608 1.00 0.00 H new ATOM 0 HG LEU A 493 -4.600 2.071 2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -5.564 4.335 2.890 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -5.420 3.582 4.496 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -4.252 4.824 3.988 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -3.951 3.786 1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -2.578 4.253 2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -2.633 2.630 1.407 1.00 0.00 H new ATOM 720 N ALA A 494 -1.800 1.080 6.791 1.00 0.00 N ATOM 721 CA ALA A 494 -0.749 0.292 7.422 1.00 0.00 C ATOM 722 C ALA A 494 -1.331 -0.896 8.179 1.00 0.00 C ATOM 723 O ALA A 494 -0.838 -2.017 8.071 1.00 0.00 O ATOM 724 CB ALA A 494 0.076 1.163 8.358 1.00 0.00 C ATOM 0 H ALA A 494 -1.928 2.011 7.189 1.00 0.00 H new ATOM 0 HA ALA A 494 -0.100 -0.094 6.636 1.00 0.00 H new ATOM 0 HB1 ALA A 494 0.857 0.560 8.822 1.00 0.00 H new ATOM 0 HB2 ALA A 494 0.532 1.975 7.792 1.00 0.00 H new ATOM 0 HB3 ALA A 494 -0.569 1.578 9.132 1.00 0.00 H new ATOM 730 N GLN A 495 -2.384 -0.638 8.942 1.00 0.00 N ATOM 731 CA GLN A 495 -3.040 -1.682 9.722 1.00 0.00 C ATOM 732 C GLN A 495 -3.800 -2.647 8.817 1.00 0.00 C ATOM 733 O GLN A 495 -3.836 -3.851 9.071 1.00 0.00 O ATOM 734 CB GLN A 495 -3.996 -1.061 10.742 1.00 0.00 C ATOM 735 CG GLN A 495 -3.294 -0.247 11.816 1.00 0.00 C ATOM 736 CD GLN A 495 -2.367 -1.088 12.671 1.00 0.00 C ATOM 737 OE1 GLN A 495 -2.746 -2.155 13.155 1.00 0.00 O ATOM 738 NE2 GLN A 495 -1.144 -0.609 12.864 1.00 0.00 N ATOM 0 H GLN A 495 -2.804 0.286 9.039 1.00 0.00 H new ATOM 0 HA GLN A 495 -2.268 -2.242 10.250 1.00 0.00 H new ATOM 0 HB2 GLN A 495 -4.706 -0.421 10.219 1.00 0.00 H new ATOM 0 HB3 GLN A 495 -4.572 -1.855 11.218 1.00 0.00 H new ATOM 0 HG2 GLN A 495 -2.722 0.553 11.345 1.00 0.00 H new ATOM 0 HG3 GLN A 495 -4.040 0.227 12.454 1.00 0.00 H new ATOM 0 HE21 GLN A 495 -0.872 0.280 12.444 1.00 0.00 H new ATOM 0 HE22 GLN A 495 -0.476 -1.130 13.433 1.00 0.00 H new ATOM 747 N ILE A 496 -4.411 -2.113 7.764 1.00 0.00 N ATOM 748 CA ILE A 496 -5.173 -2.929 6.828 1.00 0.00 C ATOM 749 C ILE A 496 -4.251 -3.786 5.966 1.00 0.00 C ATOM 750 O ILE A 496 -4.499 -4.974 5.758 1.00 0.00 O ATOM 751 CB ILE A 496 -6.077 -2.050 5.929 1.00 0.00 C ATOM 752 CG1 ILE A 496 -7.351 -2.809 5.553 1.00 0.00 C ATOM 753 CG2 ILE A 496 -5.345 -1.583 4.675 1.00 0.00 C ATOM 754 CD1 ILE A 496 -8.469 -1.911 5.070 1.00 0.00 C ATOM 0 H ILE A 496 -4.393 -1.118 7.538 1.00 0.00 H new ATOM 0 HA ILE A 496 -5.809 -3.591 7.416 1.00 0.00 H new ATOM 0 HB ILE A 496 -6.348 -1.162 6.500 1.00 0.00 H new ATOM 0 HG12 ILE A 496 -7.116 -3.534 4.774 1.00 0.00 H new ATOM 0 HG13 ILE A 496 -7.697 -3.373 6.419 1.00 0.00 H new ATOM 0 HG21 ILE A 496 -6.013 -0.969 4.071 1.00 0.00 H new ATOM 0 HG22 ILE A 496 -4.472 -0.996 4.961 1.00 0.00 H new ATOM 0 HG23 ILE A 496 -5.026 -2.450 4.096 1.00 0.00 H new ATOM 0 HD11 ILE A 496 -9.340 -2.517 4.821 1.00 0.00 H new ATOM 0 HD12 ILE A 496 -8.732 -1.203 5.856 1.00 0.00 H new ATOM 0 HD13 ILE A 496 -8.141 -1.366 4.185 1.00 0.00 H new ATOM 766 N LEU A 497 -3.187 -3.169 5.466 1.00 0.00 N ATOM 767 CA LEU A 497 -2.222 -3.864 4.622 1.00 0.00 C ATOM 768 C LEU A 497 -1.384 -4.846 5.430 1.00 0.00 C ATOM 769 O LEU A 497 -1.156 -5.972 4.997 1.00 0.00 O ATOM 770 CB LEU A 497 -1.307 -2.860 3.918 1.00 0.00 C ATOM 771 CG LEU A 497 -1.943 -2.118 2.742 1.00 0.00 C ATOM 772 CD1 LEU A 497 -1.231 -0.798 2.495 1.00 0.00 C ATOM 773 CD2 LEU A 497 -1.916 -2.983 1.490 1.00 0.00 C ATOM 0 H LEU A 497 -2.970 -2.186 5.631 1.00 0.00 H new ATOM 0 HA LEU A 497 -2.782 -4.426 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -0.967 -2.127 4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -0.423 -3.387 3.560 1.00 0.00 H new ATOM 0 HG LEU A 497 -2.983 -1.905 2.991 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -1.698 -0.285 1.654 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -1.302 -0.174 3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -0.182 -0.987 2.267 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -2.373 -2.440 0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -0.884 -3.227 1.238 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -2.472 -3.903 1.671 1.00 0.00 H new ATOM 785 N LYS A 498 -0.924 -4.417 6.604 1.00 0.00 N ATOM 786 CA LYS A 498 -0.098 -5.267 7.461 1.00 0.00 C ATOM 787 C LYS A 498 -0.696 -6.663 7.605 1.00 0.00 C ATOM 788 O LYS A 498 0.014 -7.660 7.521 1.00 0.00 O ATOM 789 CB LYS A 498 0.069 -4.630 8.841 1.00 0.00 C ATOM 790 CG LYS A 498 0.954 -5.434 9.780 1.00 0.00 C ATOM 791 CD LYS A 498 0.163 -6.511 10.508 1.00 0.00 C ATOM 792 CE LYS A 498 0.818 -7.876 10.366 1.00 0.00 C ATOM 793 NZ LYS A 498 -0.173 -8.982 10.473 1.00 0.00 N ATOM 0 H LYS A 498 -1.108 -3.488 6.983 1.00 0.00 H new ATOM 0 HA LYS A 498 0.879 -5.362 6.987 1.00 0.00 H new ATOM 0 HB2 LYS A 498 0.492 -3.632 8.723 1.00 0.00 H new ATOM 0 HB3 LYS A 498 -0.914 -4.508 9.297 1.00 0.00 H new ATOM 0 HG2 LYS A 498 1.762 -5.896 9.213 1.00 0.00 H new ATOM 0 HG3 LYS A 498 1.416 -4.766 10.507 1.00 0.00 H new ATOM 0 HD2 LYS A 498 0.082 -6.253 11.564 1.00 0.00 H new ATOM 0 HD3 LYS A 498 -0.851 -6.550 10.111 1.00 0.00 H new ATOM 0 HE2 LYS A 498 1.326 -7.936 9.404 1.00 0.00 H new ATOM 0 HE3 LYS A 498 1.579 -7.995 11.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 0.265 -9.796 10.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 -0.995 -8.660 11.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 -0.482 -9.264 9.521 1.00 0.00 H new ATOM 807 N ARG A 499 -2.000 -6.734 7.821 1.00 0.00 N ATOM 808 CA ARG A 499 -2.670 -8.020 7.964 1.00 0.00 C ATOM 809 C ARG A 499 -2.931 -8.662 6.601 1.00 0.00 C ATOM 810 O ARG A 499 -3.240 -9.850 6.512 1.00 0.00 O ATOM 811 CB ARG A 499 -3.987 -7.853 8.726 1.00 0.00 C ATOM 812 CG ARG A 499 -3.808 -7.351 10.148 1.00 0.00 C ATOM 813 CD ARG A 499 -5.136 -7.276 10.884 1.00 0.00 C ATOM 814 NE ARG A 499 -5.689 -8.602 11.153 1.00 0.00 N ATOM 815 CZ ARG A 499 -5.280 -9.390 12.143 1.00 0.00 C ATOM 816 NH1 ARG A 499 -4.313 -8.990 12.962 1.00 0.00 N ATOM 817 NH2 ARG A 499 -5.836 -10.580 12.318 1.00 0.00 N ATOM 0 H ARG A 499 -2.613 -5.923 7.901 1.00 0.00 H new ATOM 0 HA ARG A 499 -2.012 -8.679 8.531 1.00 0.00 H new ATOM 0 HB2 ARG A 499 -4.626 -7.157 8.182 1.00 0.00 H new ATOM 0 HB3 ARG A 499 -4.507 -8.811 8.751 1.00 0.00 H new ATOM 0 HG2 ARG A 499 -3.130 -8.013 10.686 1.00 0.00 H new ATOM 0 HG3 ARG A 499 -3.344 -6.365 10.131 1.00 0.00 H new ATOM 0 HD2 ARG A 499 -4.999 -6.743 11.825 1.00 0.00 H new ATOM 0 HD3 ARG A 499 -5.847 -6.700 10.291 1.00 0.00 H new ATOM 0 HE ARG A 499 -6.433 -8.943 10.545 1.00 0.00 H new ATOM 0 HH11 ARG A 499 -3.881 -8.075 12.833 1.00 0.00 H new ATOM 0 HH12 ARG A 499 -4.003 -9.598 13.720 1.00 0.00 H new ATOM 0 HH21 ARG A 499 -6.579 -10.893 11.693 1.00 0.00 H new ATOM 0 HH22 ARG A 499 -5.521 -11.183 13.078 1.00 0.00 H new ATOM 831 N LEU A 500 -2.826 -7.860 5.544 1.00 0.00 N ATOM 832 CA LEU A 500 -3.071 -8.331 4.187 1.00 0.00 C ATOM 833 C LEU A 500 -2.225 -9.546 3.824 1.00 0.00 C ATOM 834 O LEU A 500 -2.706 -10.473 3.174 1.00 0.00 O ATOM 835 CB LEU A 500 -2.822 -7.205 3.182 1.00 0.00 C ATOM 836 CG LEU A 500 -3.330 -7.476 1.765 1.00 0.00 C ATOM 837 CD1 LEU A 500 -4.802 -7.858 1.790 1.00 0.00 C ATOM 838 CD2 LEU A 500 -3.110 -6.259 0.880 1.00 0.00 C ATOM 0 H LEU A 500 -2.571 -6.874 5.605 1.00 0.00 H new ATOM 0 HA LEU A 500 -4.115 -8.640 4.144 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -3.296 -6.296 3.553 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -1.751 -7.010 3.136 1.00 0.00 H new ATOM 0 HG LEU A 500 -2.765 -8.311 1.350 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -5.146 -8.047 0.773 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -4.934 -8.758 2.391 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -5.382 -7.043 2.224 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -3.477 -6.469 -0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -3.649 -5.407 1.293 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -2.046 -6.028 0.837 1.00 0.00 H new ATOM 850 N ASN A 501 -0.965 -9.533 4.228 1.00 0.00 N ATOM 851 CA ASN A 501 -0.061 -10.634 3.922 1.00 0.00 C ATOM 852 C ASN A 501 0.089 -10.816 2.408 1.00 0.00 C ATOM 853 O ASN A 501 -0.041 -11.930 1.899 1.00 0.00 O ATOM 854 CB ASN A 501 -0.575 -11.933 4.548 1.00 0.00 C ATOM 855 CG ASN A 501 -0.324 -12.001 6.040 1.00 0.00 C ATOM 856 OD1 ASN A 501 0.723 -12.472 6.484 1.00 0.00 O ATOM 857 ND2 ASN A 501 -1.288 -11.531 6.825 1.00 0.00 N ATOM 0 H ASN A 501 -0.544 -8.776 4.767 1.00 0.00 H new ATOM 0 HA ASN A 501 0.916 -10.393 4.342 1.00 0.00 H new ATOM 0 HB2 ASN A 501 -1.645 -12.024 4.359 1.00 0.00 H new ATOM 0 HB3 ASN A 501 -0.092 -12.781 4.063 1.00 0.00 H new ATOM 0 HD21 ASN A 501 -1.176 -11.552 7.839 1.00 0.00 H new ATOM 0 HD22 ASN A 501 -2.140 -11.149 6.414 1.00 0.00 H new ATOM 864 N PRO A 502 0.368 -9.728 1.661 1.00 0.00 N ATOM 865 CA PRO A 502 0.533 -9.801 0.207 1.00 0.00 C ATOM 866 C PRO A 502 1.827 -10.503 -0.189 1.00 0.00 C ATOM 867 O PRO A 502 2.854 -10.349 0.471 1.00 0.00 O ATOM 868 CB PRO A 502 0.573 -8.330 -0.242 1.00 0.00 C ATOM 869 CG PRO A 502 0.203 -7.523 0.959 1.00 0.00 C ATOM 870 CD PRO A 502 0.550 -8.357 2.156 1.00 0.00 C ATOM 0 HA PRO A 502 -0.269 -10.375 -0.257 1.00 0.00 H new ATOM 0 HB2 PRO A 502 1.565 -8.059 -0.604 1.00 0.00 H new ATOM 0 HB3 PRO A 502 -0.124 -8.153 -1.061 1.00 0.00 H new ATOM 0 HG2 PRO A 502 0.746 -6.578 0.974 1.00 0.00 H new ATOM 0 HG3 PRO A 502 -0.859 -7.280 0.951 1.00 0.00 H new ATOM 0 HD2 PRO A 502 1.572 -8.180 2.490 1.00 0.00 H new ATOM 0 HD3 PRO A 502 -0.103 -8.142 3.002 1.00 0.00 H new ATOM 878 N GLU A 503 1.775 -11.269 -1.274 1.00 0.00 N ATOM 879 CA GLU A 503 2.951 -11.983 -1.755 1.00 0.00 C ATOM 880 C GLU A 503 4.055 -11.000 -2.128 1.00 0.00 C ATOM 881 O GLU A 503 3.810 -10.012 -2.820 1.00 0.00 O ATOM 882 CB GLU A 503 2.594 -12.854 -2.959 1.00 0.00 C ATOM 883 CG GLU A 503 1.866 -14.136 -2.590 1.00 0.00 C ATOM 884 CD GLU A 503 0.408 -13.901 -2.242 1.00 0.00 C ATOM 885 OE1 GLU A 503 -0.166 -12.909 -2.735 1.00 0.00 O ATOM 886 OE2 GLU A 503 -0.158 -14.711 -1.478 1.00 0.00 O ATOM 0 H GLU A 503 0.935 -11.411 -1.834 1.00 0.00 H new ATOM 0 HA GLU A 503 3.312 -12.627 -0.953 1.00 0.00 H new ATOM 0 HB2 GLU A 503 1.971 -12.277 -3.642 1.00 0.00 H new ATOM 0 HB3 GLU A 503 3.508 -13.107 -3.497 1.00 0.00 H new ATOM 0 HG2 GLU A 503 1.928 -14.837 -3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 503 2.367 -14.603 -1.742 1.00 0.00 H new ATOM 893 N ARG A 504 5.268 -11.271 -1.662 1.00 0.00 N ATOM 894 CA ARG A 504 6.404 -10.403 -1.945 1.00 0.00 C ATOM 895 C ARG A 504 7.208 -10.921 -3.132 1.00 0.00 C ATOM 896 O ARG A 504 7.718 -12.041 -3.110 1.00 0.00 O ATOM 897 CB ARG A 504 7.303 -10.291 -0.711 1.00 0.00 C ATOM 898 CG ARG A 504 8.090 -8.992 -0.646 1.00 0.00 C ATOM 899 CD ARG A 504 7.176 -7.794 -0.445 1.00 0.00 C ATOM 900 NE ARG A 504 7.920 -6.538 -0.405 1.00 0.00 N ATOM 901 CZ ARG A 504 8.540 -6.076 0.679 1.00 0.00 C ATOM 902 NH1 ARG A 504 8.513 -6.764 1.813 1.00 0.00 N ATOM 903 NH2 ARG A 504 9.192 -4.922 0.627 1.00 0.00 N ATOM 0 H ARG A 504 5.490 -12.084 -1.087 1.00 0.00 H new ATOM 0 HA ARG A 504 6.020 -9.415 -2.199 1.00 0.00 H new ATOM 0 HB2 ARG A 504 6.688 -10.379 0.185 1.00 0.00 H new ATOM 0 HB3 ARG A 504 8.000 -11.129 -0.703 1.00 0.00 H new ATOM 0 HG2 ARG A 504 8.810 -9.042 0.171 1.00 0.00 H new ATOM 0 HG3 ARG A 504 8.660 -8.865 -1.566 1.00 0.00 H new ATOM 0 HD2 ARG A 504 6.445 -7.757 -1.253 1.00 0.00 H new ATOM 0 HD3 ARG A 504 6.619 -7.915 0.484 1.00 0.00 H new ATOM 0 HE ARG A 504 7.968 -5.981 -1.258 1.00 0.00 H new ATOM 0 HH11 ARG A 504 8.015 -7.653 1.858 1.00 0.00 H new ATOM 0 HH12 ARG A 504 8.990 -6.404 2.639 1.00 0.00 H new ATOM 0 HH21 ARG A 504 9.218 -4.390 -0.243 1.00 0.00 H new ATOM 0 HH22 ARG A 504 9.667 -4.567 1.457 1.00 0.00 H new ATOM 917 N LYS A 505 7.318 -10.095 -4.168 1.00 0.00 N ATOM 918 CA LYS A 505 8.061 -10.464 -5.367 1.00 0.00 C ATOM 919 C LYS A 505 8.974 -9.325 -5.809 1.00 0.00 C ATOM 920 O LYS A 505 8.669 -8.152 -5.593 1.00 0.00 O ATOM 921 CB LYS A 505 7.097 -10.830 -6.497 1.00 0.00 C ATOM 922 CG LYS A 505 6.224 -12.035 -6.187 1.00 0.00 C ATOM 923 CD LYS A 505 5.268 -12.339 -7.328 1.00 0.00 C ATOM 924 CE LYS A 505 6.006 -12.867 -8.548 1.00 0.00 C ATOM 925 NZ LYS A 505 5.099 -13.610 -9.466 1.00 0.00 N ATOM 0 H LYS A 505 6.901 -9.165 -4.201 1.00 0.00 H new ATOM 0 HA LYS A 505 8.678 -11.331 -5.132 1.00 0.00 H new ATOM 0 HB2 LYS A 505 6.457 -9.973 -6.709 1.00 0.00 H new ATOM 0 HB3 LYS A 505 7.671 -11.031 -7.402 1.00 0.00 H new ATOM 0 HG2 LYS A 505 6.855 -12.904 -5.998 1.00 0.00 H new ATOM 0 HG3 LYS A 505 5.656 -11.849 -5.275 1.00 0.00 H new ATOM 0 HD2 LYS A 505 4.532 -13.073 -7.001 1.00 0.00 H new ATOM 0 HD3 LYS A 505 4.720 -11.435 -7.596 1.00 0.00 H new ATOM 0 HE2 LYS A 505 6.463 -12.035 -9.084 1.00 0.00 H new ATOM 0 HE3 LYS A 505 6.815 -13.523 -8.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 505 5.640 -13.954 -10.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 505 4.682 -14.419 -8.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 505 4.341 -12.977 -9.793 1.00 0.00 H new ATOM 939 N MET A 506 10.096 -9.678 -6.429 1.00 0.00 N ATOM 940 CA MET A 506 11.053 -8.683 -6.900 1.00 0.00 C ATOM 941 C MET A 506 10.915 -8.463 -8.403 1.00 0.00 C ATOM 942 O MET A 506 11.278 -9.325 -9.203 1.00 0.00 O ATOM 943 CB MET A 506 12.482 -9.117 -6.565 1.00 0.00 C ATOM 944 CG MET A 506 12.758 -10.582 -6.860 1.00 0.00 C ATOM 945 SD MET A 506 14.491 -11.023 -6.621 1.00 0.00 S ATOM 946 CE MET A 506 14.597 -11.023 -4.833 1.00 0.00 C ATOM 0 H MET A 506 10.364 -10.644 -6.617 1.00 0.00 H new ATOM 0 HA MET A 506 10.839 -7.743 -6.392 1.00 0.00 H new ATOM 0 HB2 MET A 506 13.182 -8.503 -7.132 1.00 0.00 H new ATOM 0 HB3 MET A 506 12.673 -8.925 -5.509 1.00 0.00 H new ATOM 0 HG2 MET A 506 12.137 -11.202 -6.214 1.00 0.00 H new ATOM 0 HG3 MET A 506 12.469 -10.803 -7.888 1.00 0.00 H new ATOM 0 HE1 MET A 506 15.573 -11.398 -4.526 1.00 0.00 H new ATOM 0 HE2 MET A 506 14.465 -10.007 -4.461 1.00 0.00 H new ATOM 0 HE3 MET A 506 13.817 -11.664 -4.422 1.00 0.00 H new ATOM 956 N ILE A 507 10.387 -7.302 -8.780 1.00 0.00 N ATOM 957 CA ILE A 507 10.201 -6.968 -10.186 1.00 0.00 C ATOM 958 C ILE A 507 11.001 -5.725 -10.564 1.00 0.00 C ATOM 959 O ILE A 507 10.896 -4.685 -9.912 1.00 0.00 O ATOM 960 CB ILE A 507 8.715 -6.727 -10.514 1.00 0.00 C ATOM 961 CG1 ILE A 507 7.865 -7.896 -10.014 1.00 0.00 C ATOM 962 CG2 ILE A 507 8.526 -6.532 -12.012 1.00 0.00 C ATOM 963 CD1 ILE A 507 6.376 -7.671 -10.170 1.00 0.00 C ATOM 0 H ILE A 507 10.081 -6.578 -8.130 1.00 0.00 H new ATOM 0 HA ILE A 507 10.560 -7.819 -10.765 1.00 0.00 H new ATOM 0 HB ILE A 507 8.389 -5.820 -10.006 1.00 0.00 H new ATOM 0 HG12 ILE A 507 8.147 -8.798 -10.557 1.00 0.00 H new ATOM 0 HG13 ILE A 507 8.089 -8.074 -8.962 1.00 0.00 H new ATOM 0 HG21 ILE A 507 7.471 -6.363 -12.227 1.00 0.00 H new ATOM 0 HG22 ILE A 507 9.106 -5.671 -12.343 1.00 0.00 H new ATOM 0 HG23 ILE A 507 8.866 -7.423 -12.541 1.00 0.00 H new ATOM 0 HD11 ILE A 507 5.835 -8.540 -9.795 1.00 0.00 H new ATOM 0 HD12 ILE A 507 6.080 -6.788 -9.604 1.00 0.00 H new ATOM 0 HD13 ILE A 507 6.139 -7.523 -11.224 1.00 0.00 H new ATOM 975 N ASN A 508 11.802 -5.840 -11.618 1.00 0.00 N ATOM 976 CA ASN A 508 12.620 -4.725 -12.083 1.00 0.00 C ATOM 977 C ASN A 508 13.565 -4.249 -10.984 1.00 0.00 C ATOM 978 O ASN A 508 13.743 -3.048 -10.778 1.00 0.00 O ATOM 979 CB ASN A 508 11.730 -3.569 -12.544 1.00 0.00 C ATOM 980 CG ASN A 508 10.718 -3.999 -13.589 1.00 0.00 C ATOM 981 OD1 ASN A 508 9.534 -3.677 -13.493 1.00 0.00 O ATOM 982 ND2 ASN A 508 11.183 -4.731 -14.594 1.00 0.00 N ATOM 0 H ASN A 508 11.902 -6.694 -12.167 1.00 0.00 H new ATOM 0 HA ASN A 508 13.218 -5.072 -12.926 1.00 0.00 H new ATOM 0 HB2 ASN A 508 11.205 -3.153 -11.684 1.00 0.00 H new ATOM 0 HB3 ASN A 508 12.354 -2.774 -12.952 1.00 0.00 H new ATOM 0 HD21 ASN A 508 10.550 -5.050 -15.328 1.00 0.00 H new ATOM 0 HD22 ASN A 508 12.173 -4.974 -14.633 1.00 0.00 H new ATOM 989 N ASP A 509 14.169 -5.200 -10.278 1.00 0.00 N ATOM 990 CA ASP A 509 15.096 -4.881 -9.199 1.00 0.00 C ATOM 991 C ASP A 509 14.411 -4.044 -8.123 1.00 0.00 C ATOM 992 O ASP A 509 15.026 -3.165 -7.520 1.00 0.00 O ATOM 993 CB ASP A 509 16.311 -4.130 -9.747 1.00 0.00 C ATOM 994 CG ASP A 509 17.139 -4.981 -10.692 1.00 0.00 C ATOM 995 OD1 ASP A 509 16.977 -6.219 -10.673 1.00 0.00 O ATOM 996 OD2 ASP A 509 17.950 -4.408 -11.450 1.00 0.00 O ATOM 0 H ASP A 509 14.032 -6.199 -10.434 1.00 0.00 H new ATOM 0 HA ASP A 509 15.428 -5.817 -8.751 1.00 0.00 H new ATOM 0 HB2 ASP A 509 15.976 -3.234 -10.269 1.00 0.00 H new ATOM 0 HB3 ASP A 509 16.936 -3.801 -8.917 1.00 0.00 H new ATOM 1001 N LYS A 510 13.134 -4.326 -7.888 1.00 0.00 N ATOM 1002 CA LYS A 510 12.362 -3.601 -6.885 1.00 0.00 C ATOM 1003 C LYS A 510 11.382 -4.530 -6.177 1.00 0.00 C ATOM 1004 O LYS A 510 10.950 -5.537 -6.738 1.00 0.00 O ATOM 1005 CB LYS A 510 11.605 -2.440 -7.532 1.00 0.00 C ATOM 1006 CG LYS A 510 12.513 -1.356 -8.089 1.00 0.00 C ATOM 1007 CD LYS A 510 11.711 -0.178 -8.620 1.00 0.00 C ATOM 1008 CE LYS A 510 12.612 0.858 -9.275 1.00 0.00 C ATOM 1009 NZ LYS A 510 12.134 2.245 -9.026 1.00 0.00 N ATOM 0 H LYS A 510 12.611 -5.052 -8.379 1.00 0.00 H new ATOM 0 HA LYS A 510 13.058 -3.204 -6.146 1.00 0.00 H new ATOM 0 HB2 LYS A 510 10.981 -2.828 -8.337 1.00 0.00 H new ATOM 0 HB3 LYS A 510 10.936 -1.998 -6.794 1.00 0.00 H new ATOM 0 HG2 LYS A 510 13.193 -1.013 -7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 510 13.128 -1.770 -8.889 1.00 0.00 H new ATOM 0 HD2 LYS A 510 10.977 -0.533 -9.343 1.00 0.00 H new ATOM 0 HD3 LYS A 510 11.157 0.284 -7.803 1.00 0.00 H new ATOM 0 HE2 LYS A 510 13.627 0.750 -8.893 1.00 0.00 H new ATOM 0 HE3 LYS A 510 12.654 0.676 -10.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 12.775 2.921 -9.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 11.175 2.356 -9.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 12.118 2.428 -8.002 1.00 0.00 H new ATOM 1023 N MET A 511 11.033 -4.186 -4.942 1.00 0.00 N ATOM 1024 CA MET A 511 10.102 -4.989 -4.159 1.00 0.00 C ATOM 1025 C MET A 511 8.660 -4.598 -4.464 1.00 0.00 C ATOM 1026 O MET A 511 8.284 -3.432 -4.343 1.00 0.00 O ATOM 1027 CB MET A 511 10.384 -4.822 -2.664 1.00 0.00 C ATOM 1028 CG MET A 511 11.745 -5.352 -2.239 1.00 0.00 C ATOM 1029 SD MET A 511 12.003 -5.250 -0.458 1.00 0.00 S ATOM 1030 CE MET A 511 13.696 -5.820 -0.329 1.00 0.00 C ATOM 0 H MET A 511 11.381 -3.356 -4.462 1.00 0.00 H new ATOM 0 HA MET A 511 10.242 -6.035 -4.432 1.00 0.00 H new ATOM 0 HB2 MET A 511 10.318 -3.765 -2.406 1.00 0.00 H new ATOM 0 HB3 MET A 511 9.609 -5.337 -2.097 1.00 0.00 H new ATOM 0 HG2 MET A 511 11.842 -6.390 -2.558 1.00 0.00 H new ATOM 0 HG3 MET A 511 12.526 -4.788 -2.748 1.00 0.00 H new ATOM 0 HE1 MET A 511 14.003 -5.814 0.717 1.00 0.00 H new ATOM 0 HE2 MET A 511 13.770 -6.834 -0.723 1.00 0.00 H new ATOM 0 HE3 MET A 511 14.347 -5.160 -0.902 1.00 0.00 H new ATOM 1040 N HIS A 512 7.857 -5.580 -4.859 1.00 0.00 N ATOM 1041 CA HIS A 512 6.456 -5.340 -5.182 1.00 0.00 C ATOM 1042 C HIS A 512 5.548 -6.298 -4.416 1.00 0.00 C ATOM 1043 O HIS A 512 5.987 -7.354 -3.961 1.00 0.00 O ATOM 1044 CB HIS A 512 6.224 -5.494 -6.686 1.00 0.00 C ATOM 1045 CG HIS A 512 6.747 -4.346 -7.493 1.00 0.00 C ATOM 1046 ND1 HIS A 512 6.129 -3.234 -7.957 1.00 0.00 N flip ATOM 1047 CD2 HIS A 512 8.057 -4.259 -7.917 1.00 0.00 C flip ATOM 1048 CE1 HIS A 512 7.067 -2.504 -8.645 1.00 0.00 C flip ATOM 1049 NE2 HIS A 512 8.221 -3.143 -8.605 1.00 0.00 N flip ATOM 0 H HIS A 512 8.153 -6.551 -4.963 1.00 0.00 H new ATOM 0 HA HIS A 512 6.211 -4.320 -4.885 1.00 0.00 H new ATOM 0 HB2 HIS A 512 6.700 -6.414 -7.026 1.00 0.00 H new ATOM 0 HB3 HIS A 512 5.155 -5.601 -6.871 1.00 0.00 H new ATOM 0 HD1 HIS A 512 5.149 -2.985 -7.821 1.00 0.00 H new ATOM 0 HD2 HIS A 512 8.828 -4.989 -7.718 1.00 0.00 H new ATOM 0 HE1 HIS A 512 6.889 -1.560 -9.139 1.00 0.00 H new ATOM 1058 N PHE A 513 4.281 -5.922 -4.282 1.00 0.00 N ATOM 1059 CA PHE A 513 3.310 -6.748 -3.573 1.00 0.00 C ATOM 1060 C PHE A 513 2.295 -7.344 -4.544 1.00 0.00 C ATOM 1061 O PHE A 513 1.802 -6.658 -5.439 1.00 0.00 O ATOM 1062 CB PHE A 513 2.589 -5.923 -2.505 1.00 0.00 C ATOM 1063 CG PHE A 513 3.504 -5.388 -1.441 1.00 0.00 C ATOM 1064 CD1 PHE A 513 4.170 -4.185 -1.623 1.00 0.00 C ATOM 1065 CD2 PHE A 513 3.699 -6.085 -0.261 1.00 0.00 C ATOM 1066 CE1 PHE A 513 5.014 -3.691 -0.647 1.00 0.00 C ATOM 1067 CE2 PHE A 513 4.542 -5.596 0.719 1.00 0.00 C ATOM 1068 CZ PHE A 513 5.200 -4.397 0.525 1.00 0.00 C ATOM 0 H PHE A 513 3.902 -5.051 -4.655 1.00 0.00 H new ATOM 0 HA PHE A 513 3.847 -7.564 -3.089 1.00 0.00 H new ATOM 0 HB2 PHE A 513 2.077 -5.089 -2.986 1.00 0.00 H new ATOM 0 HB3 PHE A 513 1.822 -6.540 -2.037 1.00 0.00 H new ATOM 0 HD1 PHE A 513 4.027 -3.628 -2.537 1.00 0.00 H new ATOM 0 HD2 PHE A 513 3.186 -7.022 -0.104 1.00 0.00 H new ATOM 0 HE1 PHE A 513 5.528 -2.754 -0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 513 4.686 -6.150 1.635 1.00 0.00 H new ATOM 0 HZ PHE A 513 5.859 -4.012 1.289 1.00 0.00 H new ATOM 1078 N SER A 514 1.986 -8.623 -4.360 1.00 0.00 N ATOM 1079 CA SER A 514 1.031 -9.310 -5.220 1.00 0.00 C ATOM 1080 C SER A 514 0.011 -10.082 -4.392 1.00 0.00 C ATOM 1081 O SER A 514 0.311 -10.537 -3.288 1.00 0.00 O ATOM 1082 CB SER A 514 1.759 -10.261 -6.171 1.00 0.00 C ATOM 1083 OG SER A 514 0.857 -10.859 -7.086 1.00 0.00 O ATOM 0 H SER A 514 2.384 -9.205 -3.622 1.00 0.00 H new ATOM 0 HA SER A 514 0.502 -8.558 -5.806 1.00 0.00 H new ATOM 0 HB2 SER A 514 2.528 -9.715 -6.718 1.00 0.00 H new ATOM 0 HB3 SER A 514 2.266 -11.036 -5.597 1.00 0.00 H new ATOM 0 HG SER A 514 1.348 -11.461 -7.683 1.00 0.00 H new ATOM 1089 N LEU A 515 -1.196 -10.227 -4.930 1.00 0.00 N ATOM 1090 CA LEU A 515 -2.259 -10.945 -4.239 1.00 0.00 C ATOM 1091 C LEU A 515 -3.036 -11.832 -5.208 1.00 0.00 C ATOM 1092 O LEU A 515 -3.723 -11.338 -6.102 1.00 0.00 O ATOM 1093 CB LEU A 515 -3.207 -9.957 -3.555 1.00 0.00 C ATOM 1094 CG LEU A 515 -3.557 -10.297 -2.103 1.00 0.00 C ATOM 1095 CD1 LEU A 515 -3.284 -9.109 -1.193 1.00 0.00 C ATOM 1096 CD2 LEU A 515 -5.010 -10.734 -1.989 1.00 0.00 C ATOM 0 H LEU A 515 -1.461 -9.856 -5.842 1.00 0.00 H new ATOM 0 HA LEU A 515 -1.803 -11.582 -3.481 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -2.755 -8.965 -3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -4.130 -9.903 -4.132 1.00 0.00 H new ATOM 0 HG LEU A 515 -2.924 -11.125 -1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -3.539 -9.371 -0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -2.228 -8.843 -1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -3.889 -8.260 -1.512 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -5.238 -10.971 -0.950 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -5.660 -9.928 -2.329 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -5.174 -11.617 -2.607 1.00 0.00 H new ATOM 1108 N LYS A 516 -2.921 -13.143 -5.024 1.00 0.00 N ATOM 1109 CA LYS A 516 -3.612 -14.098 -5.882 1.00 0.00 C ATOM 1110 C LYS A 516 -4.998 -14.420 -5.332 1.00 0.00 C ATOM 1111 O LYS A 516 -5.155 -14.703 -4.143 1.00 0.00 O ATOM 1112 CB LYS A 516 -2.792 -15.383 -6.013 1.00 0.00 C ATOM 1113 CG LYS A 516 -3.323 -16.337 -7.071 1.00 0.00 C ATOM 1114 CD LYS A 516 -2.505 -17.617 -7.126 1.00 0.00 C ATOM 1115 CE LYS A 516 -2.925 -18.497 -8.292 1.00 0.00 C ATOM 1116 NZ LYS A 516 -1.760 -19.169 -8.931 1.00 0.00 N ATOM 0 H LYS A 516 -2.356 -13.568 -4.289 1.00 0.00 H new ATOM 0 HA LYS A 516 -3.728 -13.646 -6.867 1.00 0.00 H new ATOM 0 HB2 LYS A 516 -1.761 -15.124 -6.254 1.00 0.00 H new ATOM 0 HB3 LYS A 516 -2.776 -15.894 -5.050 1.00 0.00 H new ATOM 0 HG2 LYS A 516 -4.364 -16.578 -6.856 1.00 0.00 H new ATOM 0 HG3 LYS A 516 -3.304 -15.849 -8.045 1.00 0.00 H new ATOM 0 HD2 LYS A 516 -1.447 -17.370 -7.218 1.00 0.00 H new ATOM 0 HD3 LYS A 516 -2.624 -18.167 -6.192 1.00 0.00 H new ATOM 0 HE2 LYS A 516 -3.631 -19.250 -7.942 1.00 0.00 H new ATOM 0 HE3 LYS A 516 -3.446 -17.892 -9.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 -2.090 -19.759 -9.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 -1.098 -18.451 -9.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 -1.277 -19.767 -8.231 1.00 0.00 H new ATOM 1130 N GLU A 517 -6.000 -14.374 -6.204 1.00 0.00 N ATOM 1131 CA GLU A 517 -7.373 -14.660 -5.805 1.00 0.00 C ATOM 1132 C GLU A 517 -8.121 -15.389 -6.917 1.00 0.00 C ATOM 1133 O GLU A 517 -7.663 -15.326 -8.077 1.00 0.00 O ATOM 1134 CB GLU A 517 -8.104 -13.365 -5.448 1.00 0.00 C ATOM 1135 CG GLU A 517 -7.500 -12.634 -4.260 1.00 0.00 C ATOM 1136 CD GLU A 517 -7.539 -13.456 -2.987 1.00 0.00 C ATOM 1137 OE1 GLU A 517 -8.319 -14.431 -2.933 1.00 0.00 O ATOM 1138 OE2 GLU A 517 -6.790 -13.127 -2.044 1.00 0.00 O ATOM 1139 OXT GLU A 517 -9.158 -16.019 -6.618 1.00 0.00 O ATOM 0 H GLU A 517 -5.887 -14.142 -7.191 1.00 0.00 H new ATOM 0 HA GLU A 517 -7.343 -15.305 -4.927 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -8.097 -12.703 -6.314 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -9.147 -13.594 -5.231 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -6.467 -12.372 -4.487 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -8.039 -11.700 -4.101 1.00 0.00 H new ATOM 1187 N GLU B 945 8.422 13.194 2.920 1.00 0.00 N ATOM 1188 CA GLU B 945 7.106 13.033 3.528 1.00 0.00 C ATOM 1189 C GLU B 945 6.445 11.743 3.054 1.00 0.00 C ATOM 1190 O GLU B 945 5.790 11.047 3.831 1.00 0.00 O ATOM 1191 CB GLU B 945 6.216 14.230 3.193 1.00 0.00 C ATOM 1192 CG GLU B 945 6.735 15.548 3.744 1.00 0.00 C ATOM 1193 CD GLU B 945 6.864 15.538 5.256 1.00 0.00 C ATOM 1194 OE1 GLU B 945 6.245 14.664 5.898 1.00 0.00 O ATOM 1195 OE2 GLU B 945 7.583 16.404 5.795 1.00 0.00 O ATOM 0 HA GLU B 945 7.235 12.979 4.609 1.00 0.00 H new ATOM 0 HB2 GLU B 945 6.122 14.310 2.110 1.00 0.00 H new ATOM 0 HB3 GLU B 945 5.216 14.050 3.587 1.00 0.00 H new ATOM 0 HG2 GLU B 945 7.707 15.765 3.302 1.00 0.00 H new ATOM 0 HG3 GLU B 945 6.062 16.352 3.446 1.00 0.00 H new ATOM 1202 N ALA B 946 6.621 11.430 1.775 1.00 0.00 N ATOM 1203 CA ALA B 946 6.042 10.223 1.197 1.00 0.00 C ATOM 1204 C ALA B 946 6.784 8.978 1.672 1.00 0.00 C ATOM 1205 O ALA B 946 6.173 7.944 1.941 1.00 0.00 O ATOM 1206 CB ALA B 946 6.062 10.305 -0.323 1.00 0.00 C ATOM 0 H ALA B 946 7.160 11.995 1.119 1.00 0.00 H new ATOM 0 HA ALA B 946 5.008 10.148 1.532 1.00 0.00 H new ATOM 0 HB1 ALA B 946 5.627 9.398 -0.742 1.00 0.00 H new ATOM 0 HB2 ALA B 946 5.483 11.169 -0.648 1.00 0.00 H new ATOM 0 HB3 ALA B 946 7.091 10.407 -0.668 1.00 0.00 H new ATOM 1212 N ASP B 947 8.104 9.086 1.773 1.00 0.00 N ATOM 1213 CA ASP B 947 8.932 7.969 2.215 1.00 0.00 C ATOM 1214 C ASP B 947 8.531 7.515 3.615 1.00 0.00 C ATOM 1215 O ASP B 947 8.525 6.321 3.913 1.00 0.00 O ATOM 1216 CB ASP B 947 10.410 8.363 2.199 1.00 0.00 C ATOM 1217 CG ASP B 947 10.934 8.587 0.793 1.00 0.00 C ATOM 1218 OD1 ASP B 947 10.254 8.168 -0.168 1.00 0.00 O ATOM 1219 OD2 ASP B 947 12.023 9.181 0.654 1.00 0.00 O ATOM 0 H ASP B 947 8.624 9.936 1.555 1.00 0.00 H new ATOM 0 HA ASP B 947 8.777 7.140 1.524 1.00 0.00 H new ATOM 0 HB2 ASP B 947 10.547 9.272 2.784 1.00 0.00 H new ATOM 0 HB3 ASP B 947 10.997 7.582 2.682 1.00 0.00 H new ATOM 1224 N GLU B 948 8.195 8.475 4.471 1.00 0.00 N ATOM 1225 CA GLU B 948 7.793 8.171 5.840 1.00 0.00 C ATOM 1226 C GLU B 948 6.484 7.390 5.862 1.00 0.00 C ATOM 1227 O GLU B 948 6.330 6.438 6.627 1.00 0.00 O ATOM 1228 CB GLU B 948 7.643 9.462 6.648 1.00 0.00 C ATOM 1229 CG GLU B 948 8.962 10.171 6.910 1.00 0.00 C ATOM 1230 CD GLU B 948 9.985 9.273 7.577 1.00 0.00 C ATOM 1231 OE1 GLU B 948 9.642 8.642 8.600 1.00 0.00 O ATOM 1232 OE2 GLU B 948 11.127 9.200 7.078 1.00 0.00 O ATOM 0 H GLU B 948 8.193 9.469 4.241 1.00 0.00 H new ATOM 0 HA GLU B 948 8.570 7.555 6.292 1.00 0.00 H new ATOM 0 HB2 GLU B 948 6.975 10.139 6.115 1.00 0.00 H new ATOM 0 HB3 GLU B 948 7.168 9.231 7.602 1.00 0.00 H new ATOM 0 HG2 GLU B 948 9.366 10.538 5.967 1.00 0.00 H new ATOM 0 HG3 GLU B 948 8.783 11.042 7.540 1.00 0.00 H new ATOM 1239 N MET B 949 5.542 7.798 5.017 1.00 0.00 N ATOM 1240 CA MET B 949 4.245 7.135 4.940 1.00 0.00 C ATOM 1241 C MET B 949 4.385 5.736 4.348 1.00 0.00 C ATOM 1242 O MET B 949 3.717 4.797 4.782 1.00 0.00 O ATOM 1243 CB MET B 949 3.271 7.963 4.099 1.00 0.00 C ATOM 1244 CG MET B 949 2.947 9.320 4.704 1.00 0.00 C ATOM 1245 SD MET B 949 1.323 9.930 4.210 1.00 0.00 S ATOM 1246 CE MET B 949 1.699 10.652 2.615 1.00 0.00 C ATOM 0 H MET B 949 5.653 8.584 4.376 1.00 0.00 H new ATOM 0 HA MET B 949 3.851 7.045 5.952 1.00 0.00 H new ATOM 0 HB2 MET B 949 3.695 8.109 3.106 1.00 0.00 H new ATOM 0 HB3 MET B 949 2.346 7.401 3.971 1.00 0.00 H new ATOM 0 HG2 MET B 949 2.989 9.248 5.791 1.00 0.00 H new ATOM 0 HG3 MET B 949 3.708 10.039 4.402 1.00 0.00 H new ATOM 0 HE1 MET B 949 0.782 10.748 2.034 1.00 0.00 H new ATOM 0 HE2 MET B 949 2.143 11.637 2.757 1.00 0.00 H new ATOM 0 HE3 MET B 949 2.401 10.011 2.082 1.00 0.00 H new ATOM 1256 N ALA B 950 5.255 5.605 3.352 1.00 0.00 N ATOM 1257 CA ALA B 950 5.482 4.322 2.698 1.00 0.00 C ATOM 1258 C ALA B 950 6.376 3.421 3.545 1.00 0.00 C ATOM 1259 O ALA B 950 6.166 2.209 3.612 1.00 0.00 O ATOM 1260 CB ALA B 950 6.095 4.532 1.322 1.00 0.00 C ATOM 0 H ALA B 950 5.815 6.372 2.980 1.00 0.00 H new ATOM 0 HA ALA B 950 4.518 3.827 2.583 1.00 0.00 H new ATOM 0 HB1 ALA B 950 6.259 3.566 0.845 1.00 0.00 H new ATOM 0 HB2 ALA B 950 5.419 5.129 0.710 1.00 0.00 H new ATOM 0 HB3 ALA B 950 7.047 5.053 1.423 1.00 0.00 H new ATOM 1266 N LYS B 951 7.374 4.019 4.187 1.00 0.00 N ATOM 1267 CA LYS B 951 8.301 3.268 5.027 1.00 0.00 C ATOM 1268 C LYS B 951 7.559 2.536 6.141 1.00 0.00 C ATOM 1269 O LYS B 951 7.800 1.354 6.386 1.00 0.00 O ATOM 1270 CB LYS B 951 9.350 4.205 5.629 1.00 0.00 C ATOM 1271 CG LYS B 951 10.419 3.486 6.433 1.00 0.00 C ATOM 1272 CD LYS B 951 11.393 4.464 7.068 1.00 0.00 C ATOM 1273 CE LYS B 951 12.544 3.743 7.749 1.00 0.00 C ATOM 1274 NZ LYS B 951 13.720 3.599 6.848 1.00 0.00 N ATOM 0 H LYS B 951 7.562 5.021 4.142 1.00 0.00 H new ATOM 0 HA LYS B 951 8.799 2.528 4.401 1.00 0.00 H new ATOM 0 HB2 LYS B 951 9.828 4.766 4.826 1.00 0.00 H new ATOM 0 HB3 LYS B 951 8.851 4.931 6.271 1.00 0.00 H new ATOM 0 HG2 LYS B 951 9.948 2.885 7.210 1.00 0.00 H new ATOM 0 HG3 LYS B 951 10.963 2.799 5.784 1.00 0.00 H new ATOM 0 HD2 LYS B 951 11.785 5.136 6.304 1.00 0.00 H new ATOM 0 HD3 LYS B 951 10.867 5.081 7.797 1.00 0.00 H new ATOM 0 HE2 LYS B 951 12.837 4.292 8.644 1.00 0.00 H new ATOM 0 HE3 LYS B 951 12.213 2.757 8.074 1.00 0.00 H new ATOM 0 HZ1 LYS B 951 14.483 3.102 7.350 1.00 0.00 H new ATOM 0 HZ2 LYS B 951 13.447 3.053 6.006 1.00 0.00 H new ATOM 0 HZ3 LYS B 951 14.052 4.541 6.558 1.00 0.00 H new ATOM 1288 N ALA B 952 6.657 3.245 6.810 1.00 0.00 N ATOM 1289 CA ALA B 952 5.881 2.661 7.896 1.00 0.00 C ATOM 1290 C ALA B 952 4.924 1.595 7.373 1.00 0.00 C ATOM 1291 O ALA B 952 4.671 0.590 8.038 1.00 0.00 O ATOM 1292 CB ALA B 952 5.114 3.744 8.639 1.00 0.00 C ATOM 0 H ALA B 952 6.446 4.224 6.619 1.00 0.00 H new ATOM 0 HA ALA B 952 6.573 2.183 8.589 1.00 0.00 H new ATOM 0 HB1 ALA B 952 4.539 3.293 9.448 1.00 0.00 H new ATOM 0 HB2 ALA B 952 5.816 4.468 9.053 1.00 0.00 H new ATOM 0 HB3 ALA B 952 4.437 4.248 7.950 1.00 0.00 H new ATOM 1298 N LEU B 953 4.392 1.824 6.177 1.00 0.00 N ATOM 1299 CA LEU B 953 3.461 0.885 5.561 1.00 0.00 C ATOM 1300 C LEU B 953 4.167 -0.412 5.174 1.00 0.00 C ATOM 1301 O LEU B 953 3.655 -1.505 5.418 1.00 0.00 O ATOM 1302 CB LEU B 953 2.816 1.513 4.325 1.00 0.00 C ATOM 1303 CG LEU B 953 1.694 0.688 3.691 1.00 0.00 C ATOM 1304 CD1 LEU B 953 0.379 0.928 4.416 1.00 0.00 C ATOM 1305 CD2 LEU B 953 1.561 1.021 2.213 1.00 0.00 C ATOM 0 H LEU B 953 4.590 2.652 5.615 1.00 0.00 H new ATOM 0 HA LEU B 953 2.686 0.651 6.291 1.00 0.00 H new ATOM 0 HB2 LEU B 953 2.418 2.490 4.598 1.00 0.00 H new ATOM 0 HB3 LEU B 953 3.590 1.682 3.576 1.00 0.00 H new ATOM 0 HG LEU B 953 1.946 -0.368 3.784 1.00 0.00 H new ATOM 0 HD11 LEU B 953 -0.407 0.333 3.951 1.00 0.00 H new ATOM 0 HD12 LEU B 953 0.482 0.639 5.462 1.00 0.00 H new ATOM 0 HD13 LEU B 953 0.118 1.985 4.356 1.00 0.00 H new ATOM 0 HD21 LEU B 953 0.759 0.426 1.777 1.00 0.00 H new ATOM 0 HD22 LEU B 953 1.331 2.080 2.098 1.00 0.00 H new ATOM 0 HD23 LEU B 953 2.498 0.796 1.704 1.00 0.00 H new ATOM 1317 N GLU B 954 5.343 -0.282 4.570 1.00 0.00 N ATOM 1318 CA GLU B 954 6.118 -1.443 4.149 1.00 0.00 C ATOM 1319 C GLU B 954 6.733 -2.157 5.348 1.00 0.00 C ATOM 1320 O GLU B 954 6.838 -3.383 5.366 1.00 0.00 O ATOM 1321 CB GLU B 954 7.217 -1.021 3.171 1.00 0.00 C ATOM 1322 CG GLU B 954 8.274 -0.123 3.793 1.00 0.00 C ATOM 1323 CD GLU B 954 9.296 0.364 2.783 1.00 0.00 C ATOM 1324 OE1 GLU B 954 9.277 -0.127 1.634 1.00 0.00 O ATOM 1325 OE2 GLU B 954 10.115 1.236 3.141 1.00 0.00 O ATOM 0 H GLU B 954 5.780 0.615 4.361 1.00 0.00 H new ATOM 0 HA GLU B 954 5.441 -2.136 3.649 1.00 0.00 H new ATOM 0 HB2 GLU B 954 7.699 -1.914 2.773 1.00 0.00 H new ATOM 0 HB3 GLU B 954 6.762 -0.502 2.328 1.00 0.00 H new ATOM 0 HG2 GLU B 954 7.788 0.736 4.256 1.00 0.00 H new ATOM 0 HG3 GLU B 954 8.785 -0.667 4.588 1.00 0.00 H new ATOM 1332 N ALA B 955 7.139 -1.381 6.348 1.00 0.00 N ATOM 1333 CA ALA B 955 7.745 -1.940 7.550 1.00 0.00 C ATOM 1334 C ALA B 955 6.799 -2.915 8.242 1.00 0.00 C ATOM 1335 O ALA B 955 7.237 -3.873 8.880 1.00 0.00 O ATOM 1336 CB ALA B 955 8.147 -0.825 8.504 1.00 0.00 C ATOM 0 H ALA B 955 7.059 -0.364 6.349 1.00 0.00 H new ATOM 0 HA ALA B 955 8.637 -2.491 7.254 1.00 0.00 H new ATOM 0 HB1 ALA B 955 8.598 -1.256 9.398 1.00 0.00 H new ATOM 0 HB2 ALA B 955 8.867 -0.169 8.014 1.00 0.00 H new ATOM 0 HB3 ALA B 955 7.264 -0.250 8.784 1.00 0.00 H new ATOM 1342 N GLU B 956 5.500 -2.665 8.113 1.00 0.00 N ATOM 1343 CA GLU B 956 4.493 -3.522 8.729 1.00 0.00 C ATOM 1344 C GLU B 956 4.354 -4.835 7.966 1.00 0.00 C ATOM 1345 O GLU B 956 4.410 -5.915 8.555 1.00 0.00 O ATOM 1346 CB GLU B 956 3.144 -2.798 8.781 1.00 0.00 C ATOM 1347 CG GLU B 956 2.612 -2.607 10.192 1.00 0.00 C ATOM 1348 CD GLU B 956 3.162 -1.361 10.860 1.00 0.00 C ATOM 1349 OE1 GLU B 956 4.135 -0.784 10.332 1.00 0.00 O ATOM 1350 OE2 GLU B 956 2.618 -0.963 11.911 1.00 0.00 O ATOM 0 H GLU B 956 5.120 -1.877 7.588 1.00 0.00 H new ATOM 0 HA GLU B 956 4.815 -3.750 9.745 1.00 0.00 H new ATOM 0 HB2 GLU B 956 3.245 -1.823 8.304 1.00 0.00 H new ATOM 0 HB3 GLU B 956 2.415 -3.363 8.200 1.00 0.00 H new ATOM 0 HG2 GLU B 956 1.524 -2.548 10.161 1.00 0.00 H new ATOM 0 HG3 GLU B 956 2.867 -3.480 10.793 1.00 0.00 H new ATOM 1357 N LEU B 957 4.169 -4.737 6.653 1.00 0.00 N ATOM 1358 CA LEU B 957 4.019 -5.919 5.811 1.00 0.00 C ATOM 1359 C LEU B 957 5.291 -6.762 5.815 1.00 0.00 C ATOM 1360 O LEU B 957 5.239 -7.981 5.657 1.00 0.00 O ATOM 1361 CB LEU B 957 3.666 -5.510 4.380 1.00 0.00 C ATOM 1362 CG LEU B 957 2.193 -5.160 4.152 1.00 0.00 C ATOM 1363 CD1 LEU B 957 1.995 -4.544 2.777 1.00 0.00 C ATOM 1364 CD2 LEU B 957 1.322 -6.397 4.313 1.00 0.00 C ATOM 0 H LEU B 957 4.119 -3.851 6.149 1.00 0.00 H new ATOM 0 HA LEU B 957 3.208 -6.522 6.220 1.00 0.00 H new ATOM 0 HB2 LEU B 957 4.275 -4.650 4.103 1.00 0.00 H new ATOM 0 HB3 LEU B 957 3.939 -6.323 3.708 1.00 0.00 H new ATOM 0 HG LEU B 957 1.894 -4.427 4.901 1.00 0.00 H new ATOM 0 HD11 LEU B 957 0.942 -4.303 2.635 1.00 0.00 H new ATOM 0 HD12 LEU B 957 2.590 -3.634 2.697 1.00 0.00 H new ATOM 0 HD13 LEU B 957 2.311 -5.253 2.012 1.00 0.00 H new ATOM 0 HD21 LEU B 957 0.278 -6.131 4.148 1.00 0.00 H new ATOM 0 HD22 LEU B 957 1.624 -7.151 3.586 1.00 0.00 H new ATOM 0 HD23 LEU B 957 1.440 -6.796 5.320 1.00 0.00 H new ATOM 1376 N ASN B 958 6.433 -6.106 5.997 1.00 0.00 N ATOM 1377 CA ASN B 958 7.717 -6.797 6.021 1.00 0.00 C ATOM 1378 C ASN B 958 7.740 -7.880 7.097 1.00 0.00 C ATOM 1379 O ASN B 958 8.476 -8.861 6.988 1.00 0.00 O ATOM 1380 CB ASN B 958 8.852 -5.800 6.262 1.00 0.00 C ATOM 1381 CG ASN B 958 9.096 -4.899 5.067 1.00 0.00 C ATOM 1382 OD1 ASN B 958 8.720 -5.227 3.942 1.00 0.00 O ATOM 1383 ND2 ASN B 958 9.726 -3.755 5.307 1.00 0.00 N ATOM 0 H ASN B 958 6.495 -5.097 6.130 1.00 0.00 H new ATOM 0 HA ASN B 958 7.859 -7.274 5.051 1.00 0.00 H new ATOM 0 HB2 ASN B 958 8.615 -5.188 7.132 1.00 0.00 H new ATOM 0 HB3 ASN B 958 9.767 -6.345 6.495 1.00 0.00 H new ATOM 0 HD21 ASN B 958 9.916 -3.107 4.542 1.00 0.00 H new ATOM 0 HD22 ASN B 958 10.020 -3.524 6.256 1.00 0.00 H new ATOM 1390 N ASP B 959 6.933 -7.694 8.138 1.00 0.00 N ATOM 1391 CA ASP B 959 6.866 -8.655 9.234 1.00 0.00 C ATOM 1392 C ASP B 959 6.248 -9.972 8.772 1.00 0.00 C ATOM 1393 O ASP B 959 6.646 -11.046 9.223 1.00 0.00 O ATOM 1394 CB ASP B 959 6.055 -8.078 10.395 1.00 0.00 C ATOM 1395 CG ASP B 959 6.153 -8.928 11.648 1.00 0.00 C ATOM 1396 OD1 ASP B 959 7.058 -9.786 11.715 1.00 0.00 O ATOM 1397 OD2 ASP B 959 5.324 -8.734 12.562 1.00 0.00 O ATOM 0 H ASP B 959 6.317 -6.888 8.245 1.00 0.00 H new ATOM 0 HA ASP B 959 7.883 -8.853 9.571 1.00 0.00 H new ATOM 0 HB2 ASP B 959 6.407 -7.070 10.615 1.00 0.00 H new ATOM 0 HB3 ASP B 959 5.010 -7.993 10.098 1.00 0.00 H new ATOM 1402 N LEU B 960 5.275 -9.882 7.871 1.00 0.00 N ATOM 1403 CA LEU B 960 4.604 -11.069 7.351 1.00 0.00 C ATOM 1404 C LEU B 960 5.574 -11.941 6.558 1.00 0.00 C ATOM 1405 O LEU B 960 5.392 -13.154 6.460 1.00 0.00 O ATOM 1406 CB LEU B 960 3.421 -10.668 6.467 1.00 0.00 C ATOM 1407 CG LEU B 960 2.465 -9.647 7.085 1.00 0.00 C ATOM 1408 CD1 LEU B 960 1.730 -8.876 5.999 1.00 0.00 C ATOM 1409 CD2 LEU B 960 1.474 -10.331 8.018 1.00 0.00 C ATOM 0 H LEU B 960 4.934 -9.001 7.486 1.00 0.00 H new ATOM 0 HA LEU B 960 4.235 -11.646 8.199 1.00 0.00 H new ATOM 0 HB2 LEU B 960 3.807 -10.261 5.533 1.00 0.00 H new ATOM 0 HB3 LEU B 960 2.856 -11.565 6.215 1.00 0.00 H new ATOM 0 HG LEU B 960 3.054 -8.941 7.670 1.00 0.00 H new ATOM 0 HD11 LEU B 960 1.055 -8.154 6.459 1.00 0.00 H new ATOM 0 HD12 LEU B 960 2.452 -8.350 5.374 1.00 0.00 H new ATOM 0 HD13 LEU B 960 1.156 -9.570 5.385 1.00 0.00 H new ATOM 0 HD21 LEU B 960 0.804 -9.586 8.446 1.00 0.00 H new ATOM 0 HD22 LEU B 960 0.892 -11.063 7.458 1.00 0.00 H new ATOM 0 HD23 LEU B 960 2.016 -10.834 8.819 1.00 0.00 H new ATOM 1421 N MET B 961 6.605 -11.316 5.995 1.00 0.00 N ATOM 1422 CA MET B 961 7.604 -12.035 5.209 1.00 0.00 C ATOM 1423 C MET B 961 8.135 -13.247 5.972 1.00 0.00 C ATOM 1424 O MET B 961 8.215 -14.336 5.367 1.00 0.00 O ATOM 1425 CB MET B 961 8.762 -11.106 4.843 1.00 0.00 C ATOM 1426 CG MET B 961 8.370 -9.992 3.885 1.00 0.00 C ATOM 1427 SD MET B 961 9.798 -9.123 3.209 1.00 0.00 S ATOM 1428 CE MET B 961 10.489 -8.397 4.692 1.00 0.00 C ATOM 1429 OXT MET B 961 8.466 -13.094 7.165 1.00 0.00 O ATOM 0 H MET B 961 6.771 -10.312 6.069 1.00 0.00 H new ATOM 0 HA MET B 961 7.123 -12.385 4.296 1.00 0.00 H new ATOM 0 HB2 MET B 961 9.165 -10.665 5.755 1.00 0.00 H new ATOM 0 HB3 MET B 961 9.561 -11.695 4.394 1.00 0.00 H new ATOM 0 HG2 MET B 961 7.784 -10.411 3.067 1.00 0.00 H new ATOM 0 HG3 MET B 961 7.729 -9.280 4.405 1.00 0.00 H new ATOM 0 HE1 MET B 961 10.604 -7.322 4.551 1.00 0.00 H new ATOM 0 HE2 MET B 961 9.821 -8.583 5.533 1.00 0.00 H new ATOM 0 HE3 MET B 961 11.463 -8.843 4.896 1.00 0.00 H new