USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 733 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 510 LYS NZ :NH3+ -132:sc= 0.32 (180deg=-0.723) USER MOD Set 1.2: A 512 HIS :FLIP no HE2:sc= -6.25! F(o=-8.9,f=-5.9!) USER MOD Set 2.1: A 511 MET CE :methyl 158:sc= -0.898 (180deg=-2.22!) USER MOD Set 2.2: B 958 ASN : amide:sc= 0 K(o=-2.6,f=-7!) USER MOD Set 2.3: B 961 MET CE :methyl -148:sc= -1.75 (180deg=-4.85!) USER MOD Single : A 453 GLN : amide:sc= 0 K(o=0,f=-0.9) 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 43:sc= -0.155 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 MET CE :methyl -136:sc= -0.257 (180deg=-1.35) USER MOD Single : A 469 THR OG1 : rot 180:sc= -0.512 USER MOD Single : A 470 THR OG1 : rot -144:sc= 0.365 USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 X(o=0,f=-0.0035) USER MOD Single : A 479 THR OG1 : rot 180:sc=-0.00262 USER MOD Single : A 480 LYS NZ :NH3+ -170:sc= -0.0124 (180deg=-0.145) 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 180:sc= 0 USER MOD Single : A 488 GLN : amide:sc= -0.946 K(o=-0.95,f=-3.8!) USER MOD Single : A 489 THR OG1 : rot 71:sc= 0.934 USER MOD Single : A 491 ASN : amide:sc= -0.715 K(o=-0.72,f=-2!) USER MOD Single : A 495 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 498 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 ASN : amide:sc= 0 X(o=0,f=0.13) USER MOD Single : A 505 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 506 MET CE :methyl 164:sc= -0.013 (180deg=-0.273) USER MOD Single : A 508 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.84) USER MOD Single : A 514 SER OG : rot 180:sc= -1.07 USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 942 SER OG : rot 180:sc= 0 USER MOD Single : B 943 SER OG : rot -42:sc= 1.06 USER MOD Single : B 944 SER OG : rot 180:sc= 0 USER MOD Single : B 949 MET CE :methyl -100:sc= -8.02! (180deg=-11.3!) USER MOD Single : B 951 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 451 -17.951 11.845 1.375 1.00 0.00 N ATOM 2 CA ASP A 451 -16.495 11.668 1.614 1.00 0.00 C ATOM 3 C ASP A 451 -15.982 10.385 0.970 1.00 0.00 C ATOM 4 O ASP A 451 -16.765 9.559 0.499 1.00 0.00 O ATOM 5 CB ASP A 451 -16.249 11.636 3.125 1.00 0.00 C ATOM 6 CG ASP A 451 -17.006 10.517 3.812 1.00 0.00 C ATOM 7 OD1 ASP A 451 -17.513 9.620 3.107 1.00 0.00 O ATOM 8 OD2 ASP A 451 -17.093 10.537 5.058 1.00 0.00 O ATOM 0 HA ASP A 451 -15.955 12.500 1.162 1.00 0.00 H new ATOM 0 HB2 ASP A 451 -15.182 11.518 3.314 1.00 0.00 H new ATOM 0 HB3 ASP A 451 -16.546 12.591 3.559 1.00 0.00 H new ATOM 13 N VAL A 452 -14.663 10.222 0.951 1.00 0.00 N ATOM 14 CA VAL A 452 -14.046 9.040 0.364 1.00 0.00 C ATOM 15 C VAL A 452 -13.392 8.172 1.434 1.00 0.00 C ATOM 16 O VAL A 452 -12.682 8.674 2.305 1.00 0.00 O ATOM 17 CB VAL A 452 -12.988 9.422 -0.688 1.00 0.00 C ATOM 18 CG1 VAL A 452 -12.496 8.187 -1.426 1.00 0.00 C ATOM 19 CG2 VAL A 452 -13.549 10.446 -1.663 1.00 0.00 C ATOM 0 H VAL A 452 -14.001 10.895 1.336 1.00 0.00 H new ATOM 0 HA VAL A 452 -14.843 8.476 -0.121 1.00 0.00 H new ATOM 0 HB VAL A 452 -12.138 9.871 -0.174 1.00 0.00 H new ATOM 0 HG11 VAL A 452 -11.749 8.478 -2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 452 -12.051 7.491 -0.715 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -13.335 7.705 -1.928 1.00 0.00 H new ATOM 0 HG21 VAL A 452 -12.787 10.704 -2.399 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -14.417 10.027 -2.171 1.00 0.00 H new ATOM 0 HG23 VAL A 452 -13.845 11.343 -1.119 1.00 0.00 H new ATOM 29 N GLN A 453 -13.638 6.868 1.362 1.00 0.00 N ATOM 30 CA GLN A 453 -13.073 5.930 2.325 1.00 0.00 C ATOM 31 C GLN A 453 -12.216 4.880 1.625 1.00 0.00 C ATOM 32 O GLN A 453 -12.392 4.611 0.437 1.00 0.00 O ATOM 33 CB GLN A 453 -14.189 5.247 3.119 1.00 0.00 C ATOM 34 CG GLN A 453 -15.010 6.208 3.962 1.00 0.00 C ATOM 35 CD GLN A 453 -16.141 5.517 4.699 1.00 0.00 C ATOM 36 OE1 GLN A 453 -16.554 4.416 4.334 1.00 0.00 O ATOM 37 NE2 GLN A 453 -16.649 6.162 5.743 1.00 0.00 N ATOM 0 H GLN A 453 -14.224 6.437 0.647 1.00 0.00 H new ATOM 0 HA GLN A 453 -12.439 6.491 3.011 1.00 0.00 H new ATOM 0 HB2 GLN A 453 -14.851 4.728 2.426 1.00 0.00 H new ATOM 0 HB3 GLN A 453 -13.750 4.490 3.769 1.00 0.00 H new ATOM 0 HG2 GLN A 453 -14.358 6.700 4.684 1.00 0.00 H new ATOM 0 HG3 GLN A 453 -15.422 6.987 3.321 1.00 0.00 H new ATOM 0 HE21 GLN A 453 -16.276 7.073 6.010 1.00 0.00 H new ATOM 0 HE22 GLN A 453 -17.412 5.746 6.277 1.00 0.00 H new ATOM 46 N VAL A 454 -11.287 4.289 2.371 1.00 0.00 N ATOM 47 CA VAL A 454 -10.401 3.269 1.823 1.00 0.00 C ATOM 48 C VAL A 454 -10.714 1.897 2.412 1.00 0.00 C ATOM 49 O VAL A 454 -10.872 1.754 3.625 1.00 0.00 O ATOM 50 CB VAL A 454 -8.922 3.605 2.090 1.00 0.00 C ATOM 51 CG1 VAL A 454 -8.010 2.633 1.360 1.00 0.00 C ATOM 52 CG2 VAL A 454 -8.619 5.040 1.685 1.00 0.00 C ATOM 0 H VAL A 454 -11.129 4.499 3.356 1.00 0.00 H new ATOM 0 HA VAL A 454 -10.571 3.248 0.747 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.735 3.506 3.159 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -6.970 2.888 1.562 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -8.208 1.618 1.706 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -8.197 2.694 0.288 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -7.569 5.259 1.881 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.825 5.169 0.622 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.246 5.721 2.261 1.00 0.00 H new ATOM 62 N THR A 455 -10.801 0.893 1.547 1.00 0.00 N ATOM 63 CA THR A 455 -11.093 -0.468 1.983 1.00 0.00 C ATOM 64 C THR A 455 -10.039 -1.443 1.470 1.00 0.00 C ATOM 65 O THR A 455 -9.386 -1.190 0.456 1.00 0.00 O ATOM 66 CB THR A 455 -12.480 -0.893 1.496 1.00 0.00 C ATOM 67 OG1 THR A 455 -12.593 -0.726 0.094 1.00 0.00 O ATOM 68 CG2 THR A 455 -13.606 -0.115 2.142 1.00 0.00 C ATOM 0 H THR A 455 -10.674 0.995 0.540 1.00 0.00 H new ATOM 0 HA THR A 455 -11.076 -0.486 3.073 1.00 0.00 H new ATOM 0 HB THR A 455 -12.575 -1.942 1.778 1.00 0.00 H new ATOM 0 HG1 THR A 455 -13.486 -1.005 -0.198 1.00 0.00 H new ATOM 0 HG21 THR A 455 -14.561 -0.466 1.752 1.00 0.00 H new ATOM 0 HG22 THR A 455 -13.578 -0.263 3.222 1.00 0.00 H new ATOM 0 HG23 THR A 455 -13.491 0.946 1.918 1.00 0.00 H new ATOM 76 N GLU A 456 -9.878 -2.558 2.175 1.00 0.00 N ATOM 77 CA GLU A 456 -8.902 -3.572 1.793 1.00 0.00 C ATOM 78 C GLU A 456 -9.278 -4.216 0.462 1.00 0.00 C ATOM 79 O GLU A 456 -8.408 -4.570 -0.334 1.00 0.00 O ATOM 80 CB GLU A 456 -8.797 -4.643 2.880 1.00 0.00 C ATOM 81 CG GLU A 456 -7.686 -5.652 2.635 1.00 0.00 C ATOM 82 CD GLU A 456 -7.655 -6.753 3.678 1.00 0.00 C ATOM 83 OE1 GLU A 456 -8.553 -6.776 4.547 1.00 0.00 O ATOM 84 OE2 GLU A 456 -6.731 -7.592 3.627 1.00 0.00 O ATOM 0 H GLU A 456 -10.412 -2.782 3.015 1.00 0.00 H new ATOM 0 HA GLU A 456 -7.934 -3.084 1.679 1.00 0.00 H new ATOM 0 HB2 GLU A 456 -8.630 -4.158 3.842 1.00 0.00 H new ATOM 0 HB3 GLU A 456 -9.748 -5.172 2.950 1.00 0.00 H new ATOM 0 HG2 GLU A 456 -7.815 -6.096 1.648 1.00 0.00 H new ATOM 0 HG3 GLU A 456 -6.726 -5.135 2.629 1.00 0.00 H new ATOM 91 N ASP A 457 -10.577 -4.369 0.230 1.00 0.00 N ATOM 92 CA ASP A 457 -11.068 -4.973 -1.003 1.00 0.00 C ATOM 93 C ASP A 457 -10.581 -4.199 -2.224 1.00 0.00 C ATOM 94 O ASP A 457 -10.297 -4.784 -3.269 1.00 0.00 O ATOM 95 CB ASP A 457 -12.598 -5.026 -0.996 1.00 0.00 C ATOM 96 CG ASP A 457 -13.156 -5.831 -2.153 1.00 0.00 C ATOM 97 OD1 ASP A 457 -12.378 -6.564 -2.798 1.00 0.00 O ATOM 98 OD2 ASP A 457 -14.372 -5.726 -2.415 1.00 0.00 O ATOM 0 H ASP A 457 -11.309 -4.083 0.880 1.00 0.00 H new ATOM 0 HA ASP A 457 -10.675 -5.988 -1.060 1.00 0.00 H new ATOM 0 HB2 ASP A 457 -12.939 -5.461 -0.057 1.00 0.00 H new ATOM 0 HB3 ASP A 457 -12.994 -4.011 -1.039 1.00 0.00 H new ATOM 103 N ALA A 458 -10.488 -2.881 -2.085 1.00 0.00 N ATOM 104 CA ALA A 458 -10.036 -2.028 -3.178 1.00 0.00 C ATOM 105 C ALA A 458 -8.582 -2.316 -3.535 1.00 0.00 C ATOM 106 O ALA A 458 -8.267 -2.637 -4.681 1.00 0.00 O ATOM 107 CB ALA A 458 -10.210 -0.563 -2.808 1.00 0.00 C ATOM 0 H ALA A 458 -10.719 -2.380 -1.227 1.00 0.00 H new ATOM 0 HA ALA A 458 -10.647 -2.247 -4.054 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -9.869 0.063 -3.632 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -11.262 -0.360 -2.610 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -9.623 -0.341 -1.917 1.00 0.00 H new ATOM 113 N VAL A 459 -7.700 -2.200 -2.548 1.00 0.00 N ATOM 114 CA VAL A 459 -6.280 -2.449 -2.759 1.00 0.00 C ATOM 115 C VAL A 459 -6.036 -3.885 -3.208 1.00 0.00 C ATOM 116 O VAL A 459 -5.224 -4.140 -4.099 1.00 0.00 O ATOM 117 CB VAL A 459 -5.466 -2.177 -1.479 1.00 0.00 C ATOM 118 CG1 VAL A 459 -3.974 -2.292 -1.758 1.00 0.00 C ATOM 119 CG2 VAL A 459 -5.805 -0.808 -0.911 1.00 0.00 C ATOM 0 H VAL A 459 -7.944 -1.935 -1.594 1.00 0.00 H new ATOM 0 HA VAL A 459 -5.951 -1.765 -3.542 1.00 0.00 H new ATOM 0 HB VAL A 459 -5.732 -2.929 -0.736 1.00 0.00 H new ATOM 0 HG11 VAL A 459 -3.416 -2.096 -0.842 1.00 0.00 H new ATOM 0 HG12 VAL A 459 -3.747 -3.297 -2.114 1.00 0.00 H new ATOM 0 HG13 VAL A 459 -3.689 -1.565 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 459 -5.220 -0.634 -0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 459 -5.571 -0.040 -1.648 1.00 0.00 H new ATOM 0 HG23 VAL A 459 -6.867 -0.767 -0.669 1.00 0.00 H new ATOM 129 N ARG A 460 -6.745 -4.822 -2.586 1.00 0.00 N ATOM 130 CA ARG A 460 -6.607 -6.235 -2.920 1.00 0.00 C ATOM 131 C ARG A 460 -6.932 -6.484 -4.389 1.00 0.00 C ATOM 132 O ARG A 460 -6.272 -7.282 -5.054 1.00 0.00 O ATOM 133 CB ARG A 460 -7.526 -7.079 -2.034 1.00 0.00 C ATOM 134 CG ARG A 460 -7.340 -8.576 -2.215 1.00 0.00 C ATOM 135 CD ARG A 460 -8.436 -9.362 -1.514 1.00 0.00 C ATOM 136 NE ARG A 460 -8.440 -9.129 -0.071 1.00 0.00 N ATOM 137 CZ ARG A 460 -7.601 -9.717 0.778 1.00 0.00 C ATOM 138 NH1 ARG A 460 -6.690 -10.574 0.335 1.00 0.00 N ATOM 139 NH2 ARG A 460 -7.675 -9.449 2.075 1.00 0.00 N ATOM 0 H ARG A 460 -7.421 -4.628 -1.848 1.00 0.00 H new ATOM 0 HA ARG A 460 -5.571 -6.525 -2.743 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -7.346 -6.823 -0.990 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -8.563 -6.821 -2.251 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -7.340 -8.818 -3.278 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -6.368 -8.873 -1.821 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -9.404 -9.083 -1.929 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -8.301 -10.426 -1.709 1.00 0.00 H new ATOM 0 HE ARG A 460 -9.127 -8.477 0.308 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -6.630 -10.785 -0.661 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -6.050 -11.022 0.991 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -8.375 -8.793 2.421 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -7.032 -9.899 2.726 1.00 0.00 H new ATOM 153 N ARG A 461 -7.955 -5.799 -4.888 1.00 0.00 N ATOM 154 CA ARG A 461 -8.371 -5.947 -6.278 1.00 0.00 C ATOM 155 C ARG A 461 -7.257 -5.528 -7.234 1.00 0.00 C ATOM 156 O ARG A 461 -7.089 -6.116 -8.302 1.00 0.00 O ATOM 157 CB ARG A 461 -9.628 -5.118 -6.547 1.00 0.00 C ATOM 158 CG ARG A 461 -10.330 -5.482 -7.845 1.00 0.00 C ATOM 159 CD ARG A 461 -11.524 -4.579 -8.106 1.00 0.00 C ATOM 160 NE ARG A 461 -12.293 -5.013 -9.270 1.00 0.00 N ATOM 161 CZ ARG A 461 -13.549 -4.641 -9.508 1.00 0.00 C ATOM 162 NH1 ARG A 461 -14.180 -3.830 -8.669 1.00 0.00 N ATOM 163 NH2 ARG A 461 -14.175 -5.082 -10.591 1.00 0.00 N ATOM 0 H ARG A 461 -8.512 -5.135 -4.350 1.00 0.00 H new ATOM 0 HA ARG A 461 -8.593 -7.000 -6.451 1.00 0.00 H new ATOM 0 HB2 ARG A 461 -10.324 -5.249 -5.718 1.00 0.00 H new ATOM 0 HB3 ARG A 461 -9.358 -4.062 -6.573 1.00 0.00 H new ATOM 0 HG2 ARG A 461 -9.627 -5.405 -8.674 1.00 0.00 H new ATOM 0 HG3 ARG A 461 -10.660 -6.520 -7.802 1.00 0.00 H new ATOM 0 HD2 ARG A 461 -12.170 -4.569 -7.228 1.00 0.00 H new ATOM 0 HD3 ARG A 461 -11.179 -3.557 -8.260 1.00 0.00 H new ATOM 0 HE ARG A 461 -11.842 -5.637 -9.939 1.00 0.00 H new ATOM 0 HH11 ARG A 461 -13.703 -3.487 -7.835 1.00 0.00 H new ATOM 0 HH12 ARG A 461 -15.142 -3.549 -8.858 1.00 0.00 H new ATOM 0 HH21 ARG A 461 -13.694 -5.705 -11.240 1.00 0.00 H new ATOM 0 HH22 ARG A 461 -15.137 -4.798 -10.775 1.00 0.00 H new ATOM 177 N TYR A 462 -6.500 -4.506 -6.846 1.00 0.00 N ATOM 178 CA TYR A 462 -5.405 -4.009 -7.672 1.00 0.00 C ATOM 179 C TYR A 462 -4.289 -5.043 -7.783 1.00 0.00 C ATOM 180 O TYR A 462 -3.760 -5.285 -8.868 1.00 0.00 O ATOM 181 CB TYR A 462 -4.851 -2.706 -7.093 1.00 0.00 C ATOM 182 CG TYR A 462 -5.723 -1.502 -7.368 1.00 0.00 C ATOM 183 CD1 TYR A 462 -5.736 -0.900 -8.619 1.00 0.00 C ATOM 184 CD2 TYR A 462 -6.531 -0.965 -6.374 1.00 0.00 C ATOM 185 CE1 TYR A 462 -6.530 0.202 -8.874 1.00 0.00 C ATOM 186 CE2 TYR A 462 -7.329 0.137 -6.620 1.00 0.00 C ATOM 187 CZ TYR A 462 -7.325 0.717 -7.871 1.00 0.00 C ATOM 188 OH TYR A 462 -8.118 1.813 -8.120 1.00 0.00 O ATOM 0 H TYR A 462 -6.625 -4.006 -5.966 1.00 0.00 H new ATOM 0 HA TYR A 462 -5.798 -3.818 -8.671 1.00 0.00 H new ATOM 0 HB2 TYR A 462 -4.731 -2.819 -6.015 1.00 0.00 H new ATOM 0 HB3 TYR A 462 -3.859 -2.527 -7.507 1.00 0.00 H new ATOM 0 HD1 TYR A 462 -5.115 -1.300 -9.407 1.00 0.00 H new ATOM 0 HD2 TYR A 462 -6.536 -1.416 -5.393 1.00 0.00 H new ATOM 0 HE1 TYR A 462 -6.528 0.658 -9.853 1.00 0.00 H new ATOM 0 HE2 TYR A 462 -7.952 0.541 -5.836 1.00 0.00 H new ATOM 0 HH TYR A 462 -8.615 2.048 -7.309 1.00 0.00 H new ATOM 198 N LEU A 463 -3.933 -5.649 -6.655 1.00 0.00 N ATOM 199 CA LEU A 463 -2.876 -6.654 -6.627 1.00 0.00 C ATOM 200 C LEU A 463 -3.282 -7.902 -7.405 1.00 0.00 C ATOM 201 O LEU A 463 -2.456 -8.525 -8.071 1.00 0.00 O ATOM 202 CB LEU A 463 -2.538 -7.026 -5.182 1.00 0.00 C ATOM 203 CG LEU A 463 -1.981 -5.882 -4.334 1.00 0.00 C ATOM 204 CD1 LEU A 463 -1.876 -6.300 -2.876 1.00 0.00 C ATOM 205 CD2 LEU A 463 -0.625 -5.440 -4.863 1.00 0.00 C ATOM 0 H LEU A 463 -4.361 -5.462 -5.748 1.00 0.00 H new ATOM 0 HA LEU A 463 -1.993 -6.227 -7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -3.438 -7.410 -4.701 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -1.811 -7.838 -5.192 1.00 0.00 H new ATOM 0 HG LEU A 463 -2.668 -5.038 -4.399 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -1.478 -5.473 -2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -2.864 -6.568 -2.502 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -1.211 -7.159 -2.791 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -0.243 -4.625 -4.248 1.00 0.00 H new ATOM 0 HD22 LEU A 463 0.070 -6.279 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -0.730 -5.099 -5.893 1.00 0.00 H new ATOM 217 N THR A 464 -4.558 -8.261 -7.315 1.00 0.00 N ATOM 218 CA THR A 464 -5.069 -9.437 -8.011 1.00 0.00 C ATOM 219 C THR A 464 -4.893 -9.294 -9.520 1.00 0.00 C ATOM 220 O THR A 464 -4.713 -10.284 -10.229 1.00 0.00 O ATOM 221 CB THR A 464 -6.545 -9.656 -7.675 1.00 0.00 C ATOM 222 OG1 THR A 464 -7.188 -8.422 -7.413 1.00 0.00 O ATOM 223 CG2 THR A 464 -6.759 -10.550 -6.473 1.00 0.00 C ATOM 0 H THR A 464 -5.256 -7.756 -6.769 1.00 0.00 H new ATOM 0 HA THR A 464 -4.497 -10.303 -7.677 1.00 0.00 H new ATOM 0 HB THR A 464 -6.971 -10.145 -8.551 1.00 0.00 H new ATOM 0 HG1 THR A 464 -6.907 -7.759 -8.078 1.00 0.00 H new ATOM 0 HG21 THR A 464 -7.827 -10.664 -6.290 1.00 0.00 H new ATOM 0 HG22 THR A 464 -6.317 -11.528 -6.664 1.00 0.00 H new ATOM 0 HG23 THR A 464 -6.286 -10.103 -5.598 1.00 0.00 H new ATOM 231 N ARG A 465 -4.948 -8.058 -10.004 1.00 0.00 N ATOM 232 CA ARG A 465 -4.795 -7.791 -11.430 1.00 0.00 C ATOM 233 C ARG A 465 -3.323 -7.740 -11.820 1.00 0.00 C ATOM 234 O ARG A 465 -2.874 -8.478 -12.697 1.00 0.00 O ATOM 235 CB ARG A 465 -5.480 -6.476 -11.806 1.00 0.00 C ATOM 236 CG ARG A 465 -6.998 -6.543 -11.747 1.00 0.00 C ATOM 237 CD ARG A 465 -7.636 -5.410 -12.536 1.00 0.00 C ATOM 238 NE ARG A 465 -7.200 -4.098 -12.064 1.00 0.00 N ATOM 239 CZ ARG A 465 -7.739 -3.465 -11.025 1.00 0.00 C ATOM 240 NH1 ARG A 465 -8.728 -4.023 -10.338 1.00 0.00 N ATOM 241 NH2 ARG A 465 -7.286 -2.270 -10.669 1.00 0.00 N ATOM 0 H ARG A 465 -5.097 -7.227 -9.432 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.270 -8.606 -11.976 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -5.133 -5.690 -11.135 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -5.176 -6.192 -12.814 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -7.337 -7.500 -12.144 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -7.326 -6.494 -10.709 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -7.384 -5.517 -13.591 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -8.721 -5.481 -12.458 1.00 0.00 H new ATOM 0 HE ARG A 465 -6.436 -3.639 -12.561 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -9.079 -4.942 -10.605 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -9.137 -3.532 -9.543 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -6.525 -1.837 -11.192 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -7.699 -1.785 -9.873 1.00 0.00 H new ATOM 255 N LYS A 466 -2.578 -6.864 -11.161 1.00 0.00 N ATOM 256 CA LYS A 466 -1.154 -6.712 -11.433 1.00 0.00 C ATOM 257 C LYS A 466 -0.387 -6.365 -10.158 1.00 0.00 C ATOM 258 O LYS A 466 -0.908 -5.678 -9.279 1.00 0.00 O ATOM 259 CB LYS A 466 -0.928 -5.627 -12.488 1.00 0.00 C ATOM 260 CG LYS A 466 -1.354 -4.240 -12.036 1.00 0.00 C ATOM 261 CD LYS A 466 -1.933 -3.432 -13.185 1.00 0.00 C ATOM 262 CE LYS A 466 -2.867 -2.342 -12.686 1.00 0.00 C ATOM 263 NZ LYS A 466 -3.523 -1.615 -13.807 1.00 0.00 N ATOM 0 H LYS A 466 -2.936 -6.246 -10.433 1.00 0.00 H new ATOM 0 HA LYS A 466 -0.780 -7.663 -11.812 1.00 0.00 H new ATOM 0 HB2 LYS A 466 0.129 -5.605 -12.753 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -1.478 -5.890 -13.391 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -2.095 -4.327 -11.242 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -0.497 -3.714 -11.616 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -1.123 -2.983 -13.760 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -2.474 -4.095 -13.861 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -3.630 -2.783 -12.044 1.00 0.00 H new ATOM 0 HE3 LYS A 466 -2.306 -1.635 -12.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 -4.151 -0.880 -13.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -2.797 -1.172 -14.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -4.080 -2.284 -14.376 1.00 0.00 H new ATOM 277 N PRO A 467 0.868 -6.836 -10.040 1.00 0.00 N ATOM 278 CA PRO A 467 1.704 -6.570 -8.864 1.00 0.00 C ATOM 279 C PRO A 467 1.857 -5.078 -8.590 1.00 0.00 C ATOM 280 O PRO A 467 1.946 -4.272 -9.517 1.00 0.00 O ATOM 281 CB PRO A 467 3.058 -7.183 -9.236 1.00 0.00 C ATOM 282 CG PRO A 467 2.746 -8.201 -10.278 1.00 0.00 C ATOM 283 CD PRO A 467 1.568 -7.662 -11.041 1.00 0.00 C ATOM 0 HA PRO A 467 1.269 -6.987 -7.956 1.00 0.00 H new ATOM 0 HB2 PRO A 467 3.743 -6.426 -9.617 1.00 0.00 H new ATOM 0 HB3 PRO A 467 3.537 -7.639 -8.369 1.00 0.00 H new ATOM 0 HG2 PRO A 467 3.599 -8.359 -10.938 1.00 0.00 H new ATOM 0 HG3 PRO A 467 2.510 -9.164 -9.825 1.00 0.00 H new ATOM 0 HD2 PRO A 467 1.882 -7.072 -11.902 1.00 0.00 H new ATOM 0 HD3 PRO A 467 0.932 -8.463 -11.418 1.00 0.00 H new ATOM 291 N MET A 468 1.886 -4.715 -7.311 1.00 0.00 N ATOM 292 CA MET A 468 2.029 -3.318 -6.916 1.00 0.00 C ATOM 293 C MET A 468 3.008 -3.179 -5.754 1.00 0.00 C ATOM 294 O MET A 468 3.362 -4.163 -5.105 1.00 0.00 O ATOM 295 CB MET A 468 0.670 -2.735 -6.526 1.00 0.00 C ATOM 296 CG MET A 468 -0.373 -2.834 -7.626 1.00 0.00 C ATOM 297 SD MET A 468 0.137 -2.004 -9.144 1.00 0.00 S ATOM 298 CE MET A 468 0.261 -0.309 -8.578 1.00 0.00 C ATOM 0 H MET A 468 1.812 -5.368 -6.531 1.00 0.00 H new ATOM 0 HA MET A 468 2.423 -2.764 -7.768 1.00 0.00 H new ATOM 0 HB2 MET A 468 0.302 -3.254 -5.641 1.00 0.00 H new ATOM 0 HB3 MET A 468 0.798 -1.688 -6.252 1.00 0.00 H new ATOM 0 HG2 MET A 468 -0.571 -3.884 -7.840 1.00 0.00 H new ATOM 0 HG3 MET A 468 -1.308 -2.398 -7.275 1.00 0.00 H new ATOM 0 HE1 MET A 468 -0.195 0.354 -9.313 1.00 0.00 H new ATOM 0 HE2 MET A 468 -0.257 -0.205 -7.624 1.00 0.00 H new ATOM 0 HE3 MET A 468 1.311 -0.043 -8.452 1.00 0.00 H new ATOM 308 N THR A 469 3.439 -1.948 -5.495 1.00 0.00 N ATOM 309 CA THR A 469 4.375 -1.677 -4.410 1.00 0.00 C ATOM 310 C THR A 469 3.723 -0.818 -3.332 1.00 0.00 C ATOM 311 O THR A 469 2.654 -0.243 -3.546 1.00 0.00 O ATOM 312 CB THR A 469 5.625 -0.979 -4.948 1.00 0.00 C ATOM 313 OG1 THR A 469 5.343 0.370 -5.274 1.00 0.00 O ATOM 314 CG2 THR A 469 6.196 -1.641 -6.183 1.00 0.00 C ATOM 0 H THR A 469 3.155 -1.122 -6.022 1.00 0.00 H new ATOM 0 HA THR A 469 4.663 -2.630 -3.966 1.00 0.00 H new ATOM 0 HB THR A 469 6.362 -1.047 -4.147 1.00 0.00 H new ATOM 0 HG1 THR A 469 6.155 0.801 -5.615 1.00 0.00 H new ATOM 0 HG21 THR A 469 7.081 -1.096 -6.512 1.00 0.00 H new ATOM 0 HG22 THR A 469 6.470 -2.670 -5.951 1.00 0.00 H new ATOM 0 HG23 THR A 469 5.450 -1.635 -6.977 1.00 0.00 H new ATOM 322 N THR A 470 4.370 -0.733 -2.174 1.00 0.00 N ATOM 323 CA THR A 470 3.850 0.057 -1.064 1.00 0.00 C ATOM 324 C THR A 470 3.688 1.521 -1.464 1.00 0.00 C ATOM 325 O THR A 470 2.657 2.137 -1.196 1.00 0.00 O ATOM 326 CB THR A 470 4.778 -0.050 0.148 1.00 0.00 C ATOM 327 OG1 THR A 470 6.127 0.169 -0.229 1.00 0.00 O ATOM 328 CG2 THR A 470 4.702 -1.393 0.843 1.00 0.00 C ATOM 0 H THR A 470 5.255 -1.201 -1.980 1.00 0.00 H new ATOM 0 HA THR A 470 2.870 -0.340 -0.800 1.00 0.00 H new ATOM 0 HB THR A 470 4.436 0.718 0.842 1.00 0.00 H new ATOM 0 HG1 THR A 470 6.713 -0.408 0.304 1.00 0.00 H new ATOM 0 HG21 THR A 470 5.384 -1.402 1.693 1.00 0.00 H new ATOM 0 HG22 THR A 470 3.684 -1.565 1.193 1.00 0.00 H new ATOM 0 HG23 THR A 470 4.983 -2.181 0.144 1.00 0.00 H new ATOM 336 N LYS A 471 4.713 2.071 -2.108 1.00 0.00 N ATOM 337 CA LYS A 471 4.683 3.461 -2.545 1.00 0.00 C ATOM 338 C LYS A 471 3.540 3.699 -3.525 1.00 0.00 C ATOM 339 O LYS A 471 2.905 4.753 -3.512 1.00 0.00 O ATOM 340 CB LYS A 471 6.014 3.843 -3.193 1.00 0.00 C ATOM 341 CG LYS A 471 7.193 3.805 -2.233 1.00 0.00 C ATOM 342 CD LYS A 471 8.466 4.306 -2.894 1.00 0.00 C ATOM 343 CE LYS A 471 9.666 4.166 -1.970 1.00 0.00 C ATOM 344 NZ LYS A 471 10.611 5.307 -2.110 1.00 0.00 N ATOM 0 H LYS A 471 5.574 1.575 -2.338 1.00 0.00 H new ATOM 0 HA LYS A 471 4.521 4.088 -1.668 1.00 0.00 H new ATOM 0 HB2 LYS A 471 6.211 3.166 -4.024 1.00 0.00 H new ATOM 0 HB3 LYS A 471 5.930 4.846 -3.612 1.00 0.00 H new ATOM 0 HG2 LYS A 471 6.971 4.416 -1.358 1.00 0.00 H new ATOM 0 HG3 LYS A 471 7.343 2.785 -1.879 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.645 3.746 -3.812 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.343 5.351 -3.177 1.00 0.00 H new ATOM 0 HE2 LYS A 471 9.323 4.103 -0.937 1.00 0.00 H new ATOM 0 HE3 LYS A 471 10.187 3.234 -2.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 11.415 5.173 -1.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 10.958 5.352 -3.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 10.121 6.194 -1.875 1.00 0.00 H new ATOM 358 N ASP A 472 3.282 2.710 -4.375 1.00 0.00 N ATOM 359 CA ASP A 472 2.216 2.811 -5.365 1.00 0.00 C ATOM 360 C ASP A 472 0.856 2.957 -4.689 1.00 0.00 C ATOM 361 O ASP A 472 -0.025 3.656 -5.191 1.00 0.00 O ATOM 362 CB ASP A 472 2.217 1.580 -6.274 1.00 0.00 C ATOM 363 CG ASP A 472 3.461 1.498 -7.135 1.00 0.00 C ATOM 364 OD1 ASP A 472 4.163 2.523 -7.265 1.00 0.00 O ATOM 365 OD2 ASP A 472 3.734 0.408 -7.682 1.00 0.00 O ATOM 0 H ASP A 472 3.797 1.830 -4.398 1.00 0.00 H new ATOM 0 HA ASP A 472 2.399 3.700 -5.968 1.00 0.00 H new ATOM 0 HB2 ASP A 472 2.142 0.681 -5.663 1.00 0.00 H new ATOM 0 HB3 ASP A 472 1.336 1.605 -6.915 1.00 0.00 H new ATOM 370 N LEU A 473 0.693 2.293 -3.551 1.00 0.00 N ATOM 371 CA LEU A 473 -0.561 2.348 -2.806 1.00 0.00 C ATOM 372 C LEU A 473 -0.908 3.784 -2.424 1.00 0.00 C ATOM 373 O LEU A 473 -2.050 4.217 -2.576 1.00 0.00 O ATOM 374 CB LEU A 473 -0.469 1.482 -1.547 1.00 0.00 C ATOM 375 CG LEU A 473 -0.146 0.008 -1.798 1.00 0.00 C ATOM 376 CD1 LEU A 473 -0.155 -0.769 -0.491 1.00 0.00 C ATOM 377 CD2 LEU A 473 -1.135 -0.593 -2.785 1.00 0.00 C ATOM 0 H LEU A 473 1.413 1.710 -3.123 1.00 0.00 H new ATOM 0 HA LEU A 473 -1.352 1.962 -3.449 1.00 0.00 H new ATOM 0 HB2 LEU A 473 0.296 1.900 -0.892 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -1.416 1.545 -1.011 1.00 0.00 H new ATOM 0 HG LEU A 473 0.853 -0.058 -2.230 1.00 0.00 H new ATOM 0 HD11 LEU A 473 0.077 -1.816 -0.688 1.00 0.00 H new ATOM 0 HD12 LEU A 473 0.592 -0.353 0.185 1.00 0.00 H new ATOM 0 HD13 LEU A 473 -1.141 -0.696 -0.031 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -0.890 -1.642 -2.952 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -2.145 -0.516 -2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -1.080 -0.053 -3.730 1.00 0.00 H new ATOM 389 N LEU A 474 0.084 4.517 -1.932 1.00 0.00 N ATOM 390 CA LEU A 474 -0.117 5.904 -1.529 1.00 0.00 C ATOM 391 C LEU A 474 -0.405 6.785 -2.741 1.00 0.00 C ATOM 392 O LEU A 474 -1.181 7.737 -2.658 1.00 0.00 O ATOM 393 CB LEU A 474 1.114 6.426 -0.785 1.00 0.00 C ATOM 394 CG LEU A 474 1.382 5.764 0.566 1.00 0.00 C ATOM 395 CD1 LEU A 474 2.752 6.163 1.093 1.00 0.00 C ATOM 396 CD2 LEU A 474 0.297 6.134 1.566 1.00 0.00 C ATOM 0 H LEU A 474 1.036 4.174 -1.802 1.00 0.00 H new ATOM 0 HA LEU A 474 -0.978 5.941 -0.861 1.00 0.00 H new ATOM 0 HB2 LEU A 474 1.989 6.288 -1.420 1.00 0.00 H new ATOM 0 HB3 LEU A 474 0.998 7.499 -0.630 1.00 0.00 H new ATOM 0 HG LEU A 474 1.368 4.683 0.428 1.00 0.00 H new ATOM 0 HD11 LEU A 474 2.926 5.682 2.056 1.00 0.00 H new ATOM 0 HD12 LEU A 474 3.520 5.848 0.386 1.00 0.00 H new ATOM 0 HD13 LEU A 474 2.794 7.245 1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 474 0.504 5.654 2.522 1.00 0.00 H new ATOM 0 HD22 LEU A 474 0.279 7.216 1.700 1.00 0.00 H new ATOM 0 HD23 LEU A 474 -0.671 5.798 1.194 1.00 0.00 H new ATOM 408 N LYS A 475 0.226 6.462 -3.865 1.00 0.00 N ATOM 409 CA LYS A 475 0.038 7.225 -5.093 1.00 0.00 C ATOM 410 C LYS A 475 -1.423 7.201 -5.534 1.00 0.00 C ATOM 411 O LYS A 475 -1.950 8.199 -6.026 1.00 0.00 O ATOM 412 CB LYS A 475 0.926 6.666 -6.206 1.00 0.00 C ATOM 413 CG LYS A 475 0.897 7.493 -7.481 1.00 0.00 C ATOM 414 CD LYS A 475 1.681 8.784 -7.326 1.00 0.00 C ATOM 415 CE LYS A 475 1.730 9.566 -8.628 1.00 0.00 C ATOM 416 NZ LYS A 475 3.003 9.340 -9.367 1.00 0.00 N ATOM 0 H LYS A 475 0.872 5.677 -3.951 1.00 0.00 H new ATOM 0 HA LYS A 475 0.321 8.259 -4.894 1.00 0.00 H new ATOM 0 HB2 LYS A 475 1.953 6.606 -5.845 1.00 0.00 H new ATOM 0 HB3 LYS A 475 0.609 5.649 -6.436 1.00 0.00 H new ATOM 0 HG2 LYS A 475 1.313 6.910 -8.303 1.00 0.00 H new ATOM 0 HG3 LYS A 475 -0.136 7.723 -7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 475 1.224 9.397 -6.549 1.00 0.00 H new ATOM 0 HD3 LYS A 475 2.696 8.558 -6.998 1.00 0.00 H new ATOM 0 HE2 LYS A 475 0.889 9.275 -9.257 1.00 0.00 H new ATOM 0 HE3 LYS A 475 1.617 10.629 -8.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 475 2.995 9.892 -10.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 475 3.805 9.641 -8.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 475 3.099 8.329 -9.592 1.00 0.00 H new ATOM 430 N LYS A 476 -2.071 6.055 -5.354 1.00 0.00 N ATOM 431 CA LYS A 476 -3.472 5.901 -5.734 1.00 0.00 C ATOM 432 C LYS A 476 -4.354 6.898 -4.989 1.00 0.00 C ATOM 433 O LYS A 476 -5.324 7.416 -5.542 1.00 0.00 O ATOM 434 CB LYS A 476 -3.944 4.473 -5.451 1.00 0.00 C ATOM 435 CG LYS A 476 -3.169 3.414 -6.217 1.00 0.00 C ATOM 436 CD LYS A 476 -3.346 3.572 -7.719 1.00 0.00 C ATOM 437 CE LYS A 476 -2.723 2.411 -8.478 1.00 0.00 C ATOM 438 NZ LYS A 476 -2.592 2.705 -9.932 1.00 0.00 N ATOM 0 H LYS A 476 -1.650 5.220 -4.948 1.00 0.00 H new ATOM 0 HA LYS A 476 -3.556 6.100 -6.802 1.00 0.00 H new ATOM 0 HB2 LYS A 476 -3.855 4.275 -4.383 1.00 0.00 H new ATOM 0 HB3 LYS A 476 -5.001 4.392 -5.704 1.00 0.00 H new ATOM 0 HG2 LYS A 476 -2.111 3.483 -5.965 1.00 0.00 H new ATOM 0 HG3 LYS A 476 -3.506 2.423 -5.912 1.00 0.00 H new ATOM 0 HD2 LYS A 476 -4.408 3.636 -7.957 1.00 0.00 H new ATOM 0 HD3 LYS A 476 -2.890 4.507 -8.044 1.00 0.00 H new ATOM 0 HE2 LYS A 476 -1.740 2.191 -8.062 1.00 0.00 H new ATOM 0 HE3 LYS A 476 -3.334 1.519 -8.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 -2.163 1.889 -10.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 -3.533 2.890 -10.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 -1.988 3.542 -10.064 1.00 0.00 H new ATOM 452 N PHE A 477 -4.011 7.163 -3.733 1.00 0.00 N ATOM 453 CA PHE A 477 -4.775 8.099 -2.914 1.00 0.00 C ATOM 454 C PHE A 477 -3.874 8.791 -1.895 1.00 0.00 C ATOM 455 O PHE A 477 -4.014 8.590 -0.688 1.00 0.00 O ATOM 456 CB PHE A 477 -5.912 7.370 -2.198 1.00 0.00 C ATOM 457 CG PHE A 477 -6.915 6.755 -3.132 1.00 0.00 C ATOM 458 CD1 PHE A 477 -7.930 7.522 -3.683 1.00 0.00 C ATOM 459 CD2 PHE A 477 -6.843 5.411 -3.461 1.00 0.00 C ATOM 460 CE1 PHE A 477 -8.853 6.960 -4.544 1.00 0.00 C ATOM 461 CE2 PHE A 477 -7.763 4.843 -4.322 1.00 0.00 C ATOM 462 CZ PHE A 477 -8.769 5.618 -4.863 1.00 0.00 C ATOM 0 H PHE A 477 -3.210 6.744 -3.260 1.00 0.00 H new ATOM 0 HA PHE A 477 -5.198 8.859 -3.571 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -5.490 6.589 -1.566 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -6.424 8.071 -1.539 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -8.000 8.571 -3.436 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -6.059 4.800 -3.040 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -9.639 7.568 -4.967 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -7.695 3.794 -4.571 1.00 0.00 H new ATOM 0 HZ PHE A 477 -9.490 5.176 -5.535 1.00 0.00 H new ATOM 472 N GLN A 478 -2.948 9.608 -2.389 1.00 0.00 N ATOM 473 CA GLN A 478 -2.026 10.330 -1.521 1.00 0.00 C ATOM 474 C GLN A 478 -2.767 11.361 -0.676 1.00 0.00 C ATOM 475 O GLN A 478 -2.605 11.411 0.543 1.00 0.00 O ATOM 476 CB GLN A 478 -0.943 11.018 -2.354 1.00 0.00 C ATOM 477 CG GLN A 478 0.182 11.609 -1.520 1.00 0.00 C ATOM 478 CD GLN A 478 1.151 12.431 -2.346 1.00 0.00 C ATOM 479 OE1 GLN A 478 0.758 13.388 -3.017 1.00 0.00 O ATOM 480 NE2 GLN A 478 2.426 12.063 -2.305 1.00 0.00 N ATOM 0 H GLN A 478 -2.817 9.786 -3.385 1.00 0.00 H new ATOM 0 HA GLN A 478 -1.557 9.609 -0.851 1.00 0.00 H new ATOM 0 HB2 GLN A 478 -0.524 10.297 -3.056 1.00 0.00 H new ATOM 0 HB3 GLN A 478 -1.400 11.811 -2.946 1.00 0.00 H new ATOM 0 HG2 GLN A 478 -0.243 12.235 -0.736 1.00 0.00 H new ATOM 0 HG3 GLN A 478 0.725 10.803 -1.026 1.00 0.00 H new ATOM 0 HE21 GLN A 478 2.708 11.265 -1.736 1.00 0.00 H new ATOM 0 HE22 GLN A 478 3.123 12.579 -2.842 1.00 0.00 H new ATOM 489 N THR A 479 -3.582 12.181 -1.332 1.00 0.00 N ATOM 490 CA THR A 479 -4.350 13.211 -0.643 1.00 0.00 C ATOM 491 C THR A 479 -5.360 13.859 -1.586 1.00 0.00 C ATOM 492 O THR A 479 -5.291 15.058 -1.861 1.00 0.00 O ATOM 493 CB THR A 479 -3.414 14.277 -0.068 1.00 0.00 C ATOM 494 OG1 THR A 479 -2.242 14.393 -0.854 1.00 0.00 O ATOM 495 CG2 THR A 479 -2.986 13.994 1.357 1.00 0.00 C ATOM 0 H THR A 479 -3.727 12.152 -2.341 1.00 0.00 H new ATOM 0 HA THR A 479 -4.894 12.737 0.174 1.00 0.00 H new ATOM 0 HB THR A 479 -3.990 15.202 -0.080 1.00 0.00 H new ATOM 0 HG1 THR A 479 -1.658 15.080 -0.471 1.00 0.00 H new ATOM 0 HG21 THR A 479 -2.324 14.788 1.703 1.00 0.00 H new ATOM 0 HG22 THR A 479 -3.866 13.950 1.999 1.00 0.00 H new ATOM 0 HG23 THR A 479 -2.460 13.040 1.396 1.00 0.00 H new ATOM 503 N LYS A 480 -6.299 13.059 -2.080 1.00 0.00 N ATOM 504 CA LYS A 480 -7.323 13.554 -2.993 1.00 0.00 C ATOM 505 C LYS A 480 -8.438 14.263 -2.230 1.00 0.00 C ATOM 506 O LYS A 480 -8.529 15.490 -2.242 1.00 0.00 O ATOM 507 CB LYS A 480 -7.904 12.403 -3.816 1.00 0.00 C ATOM 508 CG LYS A 480 -6.905 11.780 -4.777 1.00 0.00 C ATOM 509 CD LYS A 480 -7.561 10.730 -5.659 1.00 0.00 C ATOM 510 CE LYS A 480 -6.546 10.044 -6.558 1.00 0.00 C ATOM 511 NZ LYS A 480 -5.880 11.006 -7.480 1.00 0.00 N ATOM 0 H LYS A 480 -6.372 12.065 -1.863 1.00 0.00 H new ATOM 0 HA LYS A 480 -6.855 14.272 -3.666 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -8.273 11.633 -3.139 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -8.761 12.768 -4.382 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -6.465 12.558 -5.401 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -6.091 11.326 -4.213 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -8.056 9.987 -5.034 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -8.333 11.198 -6.270 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -5.793 9.549 -5.944 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -7.043 9.268 -7.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -5.325 10.482 -8.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -6.601 11.580 -7.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -5.249 11.628 -6.936 1.00 0.00 H new ATOM 525 N LYS A 481 -9.284 13.481 -1.567 1.00 0.00 N ATOM 526 CA LYS A 481 -10.394 14.034 -0.799 1.00 0.00 C ATOM 527 C LYS A 481 -10.808 13.087 0.323 1.00 0.00 C ATOM 528 O LYS A 481 -11.967 13.070 0.738 1.00 0.00 O ATOM 529 CB LYS A 481 -11.587 14.310 -1.713 1.00 0.00 C ATOM 530 CG LYS A 481 -12.654 15.184 -1.075 1.00 0.00 C ATOM 531 CD LYS A 481 -14.047 14.777 -1.521 1.00 0.00 C ATOM 532 CE LYS A 481 -15.117 15.637 -0.868 1.00 0.00 C ATOM 533 NZ LYS A 481 -16.309 15.804 -1.745 1.00 0.00 N ATOM 0 H LYS A 481 -9.222 12.463 -1.546 1.00 0.00 H new ATOM 0 HA LYS A 481 -10.061 14.971 -0.354 1.00 0.00 H new ATOM 0 HB2 LYS A 481 -11.232 14.792 -2.624 1.00 0.00 H new ATOM 0 HB3 LYS A 481 -12.035 13.361 -2.008 1.00 0.00 H new ATOM 0 HG2 LYS A 481 -12.583 15.113 0.010 1.00 0.00 H new ATOM 0 HG3 LYS A 481 -12.477 16.227 -1.338 1.00 0.00 H new ATOM 0 HD2 LYS A 481 -14.122 14.862 -2.605 1.00 0.00 H new ATOM 0 HD3 LYS A 481 -14.218 13.730 -1.271 1.00 0.00 H new ATOM 0 HE2 LYS A 481 -15.421 15.183 0.075 1.00 0.00 H new ATOM 0 HE3 LYS A 481 -14.701 16.616 -0.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 -17.015 16.397 -1.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 -16.024 16.260 -2.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 -16.722 14.872 -1.951 1.00 0.00 H new ATOM 547 N THR A 482 -9.856 12.298 0.808 1.00 0.00 N ATOM 548 CA THR A 482 -10.123 11.348 1.881 1.00 0.00 C ATOM 549 C THR A 482 -10.480 12.073 3.175 1.00 0.00 C ATOM 550 O THR A 482 -11.229 11.555 4.002 1.00 0.00 O ATOM 551 CB THR A 482 -8.907 10.446 2.106 1.00 0.00 C ATOM 552 OG1 THR A 482 -7.755 11.220 2.394 1.00 0.00 O ATOM 553 CG2 THR A 482 -8.586 9.567 0.918 1.00 0.00 C ATOM 0 H THR A 482 -8.892 12.298 0.475 1.00 0.00 H new ATOM 0 HA THR A 482 -10.973 10.733 1.585 1.00 0.00 H new ATOM 0 HB THR A 482 -9.173 9.807 2.948 1.00 0.00 H new ATOM 0 HG1 THR A 482 -6.989 10.626 2.536 1.00 0.00 H new ATOM 0 HG21 THR A 482 -7.714 8.954 1.144 1.00 0.00 H new ATOM 0 HG22 THR A 482 -9.438 8.922 0.702 1.00 0.00 H new ATOM 0 HG23 THR A 482 -8.375 10.191 0.050 1.00 0.00 H new ATOM 561 N GLY A 483 -9.939 13.276 3.343 1.00 0.00 N ATOM 562 CA GLY A 483 -10.213 14.052 4.538 1.00 0.00 C ATOM 563 C GLY A 483 -9.105 13.943 5.568 1.00 0.00 C ATOM 564 O GLY A 483 -8.896 14.859 6.363 1.00 0.00 O ATOM 0 H GLY A 483 -9.316 13.727 2.673 1.00 0.00 H new ATOM 0 HA2 GLY A 483 -10.349 15.098 4.265 1.00 0.00 H new ATOM 0 HA3 GLY A 483 -11.150 13.714 4.980 1.00 0.00 H new ATOM 568 N LEU A 484 -8.394 12.821 5.553 1.00 0.00 N ATOM 569 CA LEU A 484 -7.302 12.595 6.492 1.00 0.00 C ATOM 570 C LEU A 484 -5.959 12.929 5.852 1.00 0.00 C ATOM 571 O LEU A 484 -5.739 12.664 4.670 1.00 0.00 O ATOM 572 CB LEU A 484 -7.306 11.142 6.972 1.00 0.00 C ATOM 573 CG LEU A 484 -8.630 10.660 7.565 1.00 0.00 C ATOM 574 CD1 LEU A 484 -8.496 9.234 8.078 1.00 0.00 C ATOM 575 CD2 LEU A 484 -9.083 11.589 8.681 1.00 0.00 C ATOM 0 H LEU A 484 -8.555 12.054 4.901 1.00 0.00 H new ATOM 0 HA LEU A 484 -7.450 13.252 7.349 1.00 0.00 H new ATOM 0 HB2 LEU A 484 -7.045 10.497 6.133 1.00 0.00 H new ATOM 0 HB3 LEU A 484 -6.524 11.021 7.722 1.00 0.00 H new ATOM 0 HG LEU A 484 -9.385 10.673 6.779 1.00 0.00 H new ATOM 0 HD11 LEU A 484 -9.448 8.907 8.497 1.00 0.00 H new ATOM 0 HD12 LEU A 484 -8.216 8.576 7.255 1.00 0.00 H new ATOM 0 HD13 LEU A 484 -7.728 9.196 8.850 1.00 0.00 H new ATOM 0 HD21 LEU A 484 -10.027 11.231 9.092 1.00 0.00 H new ATOM 0 HD22 LEU A 484 -8.329 11.608 9.468 1.00 0.00 H new ATOM 0 HD23 LEU A 484 -9.218 12.595 8.284 1.00 0.00 H new ATOM 587 N SER A 485 -5.062 13.513 6.641 1.00 0.00 N ATOM 588 CA SER A 485 -3.739 13.883 6.153 1.00 0.00 C ATOM 589 C SER A 485 -2.958 12.650 5.709 1.00 0.00 C ATOM 590 O SER A 485 -3.339 11.520 6.011 1.00 0.00 O ATOM 591 CB SER A 485 -2.962 14.630 7.238 1.00 0.00 C ATOM 592 OG SER A 485 -3.663 15.786 7.663 1.00 0.00 O ATOM 0 H SER A 485 -5.228 13.740 7.621 1.00 0.00 H new ATOM 0 HA SER A 485 -3.868 14.539 5.292 1.00 0.00 H new ATOM 0 HB2 SER A 485 -2.793 13.970 8.089 1.00 0.00 H new ATOM 0 HB3 SER A 485 -1.982 14.915 6.857 1.00 0.00 H new ATOM 0 HG SER A 485 -3.146 16.245 8.358 1.00 0.00 H new ATOM 598 N SER A 486 -1.863 12.878 4.989 1.00 0.00 N ATOM 599 CA SER A 486 -1.026 11.785 4.503 1.00 0.00 C ATOM 600 C SER A 486 -0.548 10.908 5.657 1.00 0.00 C ATOM 601 O SER A 486 -0.495 9.684 5.538 1.00 0.00 O ATOM 602 CB SER A 486 0.176 12.339 3.737 1.00 0.00 C ATOM 603 OG SER A 486 -0.238 13.184 2.678 1.00 0.00 O ATOM 0 H SER A 486 -1.535 13.808 4.729 1.00 0.00 H new ATOM 0 HA SER A 486 -1.627 11.172 3.831 1.00 0.00 H new ATOM 0 HB2 SER A 486 0.821 12.894 4.418 1.00 0.00 H new ATOM 0 HB3 SER A 486 0.768 11.515 3.338 1.00 0.00 H new ATOM 0 HG SER A 486 0.549 13.526 2.206 1.00 0.00 H new ATOM 609 N GLU A 487 -0.204 11.543 6.772 1.00 0.00 N ATOM 610 CA GLU A 487 0.267 10.820 7.947 1.00 0.00 C ATOM 611 C GLU A 487 -0.838 9.935 8.517 1.00 0.00 C ATOM 612 O GLU A 487 -0.597 8.788 8.893 1.00 0.00 O ATOM 613 CB GLU A 487 0.754 11.801 9.015 1.00 0.00 C ATOM 614 CG GLU A 487 1.385 11.123 10.221 1.00 0.00 C ATOM 615 CD GLU A 487 1.770 12.107 11.310 1.00 0.00 C ATOM 616 OE1 GLU A 487 1.511 13.316 11.138 1.00 0.00 O ATOM 617 OE2 GLU A 487 2.332 11.667 12.335 1.00 0.00 O ATOM 0 H GLU A 487 -0.242 12.556 6.887 1.00 0.00 H new ATOM 0 HA GLU A 487 1.099 10.184 7.644 1.00 0.00 H new ATOM 0 HB2 GLU A 487 1.481 12.480 8.569 1.00 0.00 H new ATOM 0 HB3 GLU A 487 -0.087 12.409 9.349 1.00 0.00 H new ATOM 0 HG2 GLU A 487 0.687 10.391 10.628 1.00 0.00 H new ATOM 0 HG3 GLU A 487 2.271 10.575 9.902 1.00 0.00 H new ATOM 624 N GLN A 488 -2.050 10.477 8.576 1.00 0.00 N ATOM 625 CA GLN A 488 -3.193 9.739 9.098 1.00 0.00 C ATOM 626 C GLN A 488 -3.552 8.572 8.183 1.00 0.00 C ATOM 627 O GLN A 488 -3.926 7.496 8.649 1.00 0.00 O ATOM 628 CB GLN A 488 -4.399 10.668 9.255 1.00 0.00 C ATOM 629 CG GLN A 488 -4.175 11.794 10.250 1.00 0.00 C ATOM 630 CD GLN A 488 -4.057 11.296 11.677 1.00 0.00 C ATOM 631 OE1 GLN A 488 -3.201 10.469 11.989 1.00 0.00 O ATOM 632 NE2 GLN A 488 -4.920 11.800 12.552 1.00 0.00 N ATOM 0 H GLN A 488 -2.265 11.425 8.268 1.00 0.00 H new ATOM 0 HA GLN A 488 -2.920 9.341 10.075 1.00 0.00 H new ATOM 0 HB2 GLN A 488 -4.646 11.097 8.284 1.00 0.00 H new ATOM 0 HB3 GLN A 488 -5.261 10.080 9.572 1.00 0.00 H new ATOM 0 HG2 GLN A 488 -3.268 12.336 9.982 1.00 0.00 H new ATOM 0 HG3 GLN A 488 -5.001 12.502 10.183 1.00 0.00 H new ATOM 0 HE21 GLN A 488 -5.613 12.484 12.249 1.00 0.00 H new ATOM 0 HE22 GLN A 488 -4.889 11.503 13.527 1.00 0.00 H new ATOM 641 N THR A 489 -3.433 8.793 6.877 1.00 0.00 N ATOM 642 CA THR A 489 -3.744 7.760 5.895 1.00 0.00 C ATOM 643 C THR A 489 -2.861 6.534 6.099 1.00 0.00 C ATOM 644 O THR A 489 -3.309 5.399 5.927 1.00 0.00 O ATOM 645 CB THR A 489 -3.562 8.304 4.477 1.00 0.00 C ATOM 646 OG1 THR A 489 -4.306 9.496 4.297 1.00 0.00 O ATOM 647 CG2 THR A 489 -3.990 7.329 3.403 1.00 0.00 C ATOM 0 H THR A 489 -3.124 9.678 6.475 1.00 0.00 H new ATOM 0 HA THR A 489 -4.784 7.464 6.032 1.00 0.00 H new ATOM 0 HB THR A 489 -2.493 8.487 4.373 1.00 0.00 H new ATOM 0 HG1 THR A 489 -3.894 10.220 4.813 1.00 0.00 H new ATOM 0 HG21 THR A 489 -3.835 7.777 2.422 1.00 0.00 H new ATOM 0 HG22 THR A 489 -3.399 6.417 3.483 1.00 0.00 H new ATOM 0 HG23 THR A 489 -5.046 7.089 3.529 1.00 0.00 H new ATOM 655 N VAL A 490 -1.607 6.768 6.467 1.00 0.00 N ATOM 656 CA VAL A 490 -0.661 5.682 6.694 1.00 0.00 C ATOM 657 C VAL A 490 -1.139 4.765 7.814 1.00 0.00 C ATOM 658 O VAL A 490 -0.948 3.550 7.759 1.00 0.00 O ATOM 659 CB VAL A 490 0.739 6.222 7.047 1.00 0.00 C ATOM 660 CG1 VAL A 490 1.739 5.082 7.168 1.00 0.00 C ATOM 661 CG2 VAL A 490 1.198 7.236 6.009 1.00 0.00 C ATOM 0 H VAL A 490 -1.221 7.701 6.615 1.00 0.00 H new ATOM 0 HA VAL A 490 -0.599 5.115 5.765 1.00 0.00 H new ATOM 0 HB VAL A 490 0.680 6.725 8.012 1.00 0.00 H new ATOM 0 HG11 VAL A 490 2.721 5.484 7.418 1.00 0.00 H new ATOM 0 HG12 VAL A 490 1.417 4.397 7.953 1.00 0.00 H new ATOM 0 HG13 VAL A 490 1.797 4.546 6.220 1.00 0.00 H new ATOM 0 HG21 VAL A 490 2.188 7.606 6.275 1.00 0.00 H new ATOM 0 HG22 VAL A 490 1.240 6.760 5.029 1.00 0.00 H new ATOM 0 HG23 VAL A 490 0.495 8.069 5.978 1.00 0.00 H new ATOM 671 N ASN A 491 -1.760 5.353 8.831 1.00 0.00 N ATOM 672 CA ASN A 491 -2.265 4.588 9.966 1.00 0.00 C ATOM 673 C ASN A 491 -3.273 3.537 9.511 1.00 0.00 C ATOM 674 O ASN A 491 -3.209 2.380 9.926 1.00 0.00 O ATOM 675 CB ASN A 491 -2.912 5.521 10.990 1.00 0.00 C ATOM 676 CG ASN A 491 -1.927 6.520 11.565 1.00 0.00 C ATOM 677 OD1 ASN A 491 -2.185 7.723 11.584 1.00 0.00 O ATOM 678 ND2 ASN A 491 -0.789 6.024 12.039 1.00 0.00 N ATOM 0 H ASN A 491 -1.926 6.358 8.893 1.00 0.00 H new ATOM 0 HA ASN A 491 -1.421 4.078 10.431 1.00 0.00 H new ATOM 0 HB2 ASN A 491 -3.736 6.057 10.519 1.00 0.00 H new ATOM 0 HB3 ASN A 491 -3.338 4.928 11.799 1.00 0.00 H new ATOM 0 HD21 ASN A 491 -0.088 6.648 12.439 1.00 0.00 H new ATOM 0 HD22 ASN A 491 -0.616 5.019 12.003 1.00 0.00 H new ATOM 685 N VAL A 492 -4.203 3.948 8.655 1.00 0.00 N ATOM 686 CA VAL A 492 -5.223 3.041 8.144 1.00 0.00 C ATOM 687 C VAL A 492 -4.634 2.080 7.116 1.00 0.00 C ATOM 688 O VAL A 492 -4.886 0.876 7.161 1.00 0.00 O ATOM 689 CB VAL A 492 -6.391 3.813 7.500 1.00 0.00 C ATOM 690 CG1 VAL A 492 -7.501 2.858 7.081 1.00 0.00 C ATOM 691 CG2 VAL A 492 -6.921 4.872 8.456 1.00 0.00 C ATOM 0 H VAL A 492 -4.271 4.902 8.301 1.00 0.00 H new ATOM 0 HA VAL A 492 -5.600 2.474 8.995 1.00 0.00 H new ATOM 0 HB VAL A 492 -6.021 4.314 6.606 1.00 0.00 H new ATOM 0 HG11 VAL A 492 -8.316 3.423 6.629 1.00 0.00 H new ATOM 0 HG12 VAL A 492 -7.111 2.142 6.358 1.00 0.00 H new ATOM 0 HG13 VAL A 492 -7.872 2.325 7.956 1.00 0.00 H new ATOM 0 HG21 VAL A 492 -7.745 5.408 7.985 1.00 0.00 H new ATOM 0 HG22 VAL A 492 -7.274 4.394 9.370 1.00 0.00 H new ATOM 0 HG23 VAL A 492 -6.124 5.574 8.699 1.00 0.00 H new ATOM 701 N LEU A 493 -3.849 2.621 6.191 1.00 0.00 N ATOM 702 CA LEU A 493 -3.222 1.813 5.151 1.00 0.00 C ATOM 703 C LEU A 493 -2.226 0.828 5.754 1.00 0.00 C ATOM 704 O LEU A 493 -2.007 -0.256 5.217 1.00 0.00 O ATOM 705 CB LEU A 493 -2.519 2.713 4.133 1.00 0.00 C ATOM 706 CG LEU A 493 -2.497 2.176 2.700 1.00 0.00 C ATOM 707 CD1 LEU A 493 -1.938 0.763 2.667 1.00 0.00 C ATOM 708 CD2 LEU A 493 -3.892 2.215 2.096 1.00 0.00 C ATOM 0 H LEU A 493 -3.631 3.616 6.140 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.003 1.245 4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -3.009 3.687 4.132 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -1.492 2.873 4.461 1.00 0.00 H new ATOM 0 HG LEU A 493 -1.846 2.814 2.103 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -1.930 0.399 1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -0.921 0.765 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -2.561 0.111 3.279 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -3.858 1.830 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -4.565 1.600 2.694 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.254 3.243 2.083 1.00 0.00 H new ATOM 720 N ALA A 494 -1.624 1.213 6.875 1.00 0.00 N ATOM 721 CA ALA A 494 -0.653 0.360 7.548 1.00 0.00 C ATOM 722 C ALA A 494 -1.340 -0.826 8.216 1.00 0.00 C ATOM 723 O ALA A 494 -0.813 -1.938 8.225 1.00 0.00 O ATOM 724 CB ALA A 494 0.135 1.163 8.573 1.00 0.00 C ATOM 0 H ALA A 494 -1.791 2.108 7.335 1.00 0.00 H new ATOM 0 HA ALA A 494 0.038 -0.026 6.799 1.00 0.00 H new ATOM 0 HB1 ALA A 494 0.856 0.513 9.068 1.00 0.00 H new ATOM 0 HB2 ALA A 494 0.662 1.975 8.072 1.00 0.00 H new ATOM 0 HB3 ALA A 494 -0.548 1.577 9.314 1.00 0.00 H new ATOM 730 N GLN A 495 -2.520 -0.578 8.771 1.00 0.00 N ATOM 731 CA GLN A 495 -3.286 -1.623 9.442 1.00 0.00 C ATOM 732 C GLN A 495 -3.979 -2.528 8.429 1.00 0.00 C ATOM 733 O GLN A 495 -3.996 -3.749 8.584 1.00 0.00 O ATOM 734 CB GLN A 495 -4.322 -1.001 10.381 1.00 0.00 C ATOM 735 CG GLN A 495 -3.709 -0.244 11.548 1.00 0.00 C ATOM 736 CD GLN A 495 -4.753 0.428 12.419 1.00 0.00 C ATOM 737 OE1 GLN A 495 -5.903 0.593 12.013 1.00 0.00 O ATOM 738 NE2 GLN A 495 -4.355 0.819 13.623 1.00 0.00 N ATOM 0 H GLN A 495 -2.968 0.338 8.770 1.00 0.00 H new ATOM 0 HA GLN A 495 -2.592 -2.228 10.026 1.00 0.00 H new ATOM 0 HB2 GLN A 495 -4.955 -0.322 9.811 1.00 0.00 H new ATOM 0 HB3 GLN A 495 -4.968 -1.789 10.769 1.00 0.00 H new ATOM 0 HG2 GLN A 495 -3.123 -0.933 12.156 1.00 0.00 H new ATOM 0 HG3 GLN A 495 -3.020 0.509 11.166 1.00 0.00 H new ATOM 0 HE21 GLN A 495 -3.391 0.661 13.918 1.00 0.00 H new ATOM 0 HE22 GLN A 495 -5.013 1.277 14.254 1.00 0.00 H new ATOM 747 N ILE A 496 -4.549 -1.921 7.393 1.00 0.00 N ATOM 748 CA ILE A 496 -5.244 -2.674 6.356 1.00 0.00 C ATOM 749 C ILE A 496 -4.299 -3.661 5.676 1.00 0.00 C ATOM 750 O ILE A 496 -4.647 -4.819 5.449 1.00 0.00 O ATOM 751 CB ILE A 496 -5.872 -1.728 5.303 1.00 0.00 C ATOM 752 CG1 ILE A 496 -7.139 -2.353 4.717 1.00 0.00 C ATOM 753 CG2 ILE A 496 -4.886 -1.381 4.194 1.00 0.00 C ATOM 754 CD1 ILE A 496 -8.002 -1.369 3.958 1.00 0.00 C ATOM 0 H ILE A 496 -4.543 -0.911 7.250 1.00 0.00 H new ATOM 0 HA ILE A 496 -6.046 -3.233 6.837 1.00 0.00 H new ATOM 0 HB ILE A 496 -6.135 -0.799 5.809 1.00 0.00 H new ATOM 0 HG12 ILE A 496 -6.858 -3.167 4.050 1.00 0.00 H new ATOM 0 HG13 ILE A 496 -7.726 -2.791 5.525 1.00 0.00 H new ATOM 0 HG21 ILE A 496 -5.365 -0.716 3.476 1.00 0.00 H new ATOM 0 HG22 ILE A 496 -4.015 -0.885 4.623 1.00 0.00 H new ATOM 0 HG23 ILE A 496 -4.571 -2.294 3.689 1.00 0.00 H new ATOM 0 HD11 ILE A 496 -8.883 -1.881 3.570 1.00 0.00 H new ATOM 0 HD12 ILE A 496 -8.314 -0.567 4.627 1.00 0.00 H new ATOM 0 HD13 ILE A 496 -7.432 -0.949 3.129 1.00 0.00 H new ATOM 766 N LEU A 497 -3.102 -3.186 5.360 1.00 0.00 N ATOM 767 CA LEU A 497 -2.094 -4.014 4.709 1.00 0.00 C ATOM 768 C LEU A 497 -1.685 -5.179 5.603 1.00 0.00 C ATOM 769 O LEU A 497 -1.471 -6.291 5.124 1.00 0.00 O ATOM 770 CB LEU A 497 -0.865 -3.175 4.351 1.00 0.00 C ATOM 771 CG LEU A 497 -0.903 -2.534 2.963 1.00 0.00 C ATOM 772 CD1 LEU A 497 0.130 -1.422 2.861 1.00 0.00 C ATOM 773 CD2 LEU A 497 -0.668 -3.585 1.887 1.00 0.00 C ATOM 0 H LEU A 497 -2.804 -2.228 5.544 1.00 0.00 H new ATOM 0 HA LEU A 497 -2.529 -4.417 3.794 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -0.752 -2.387 5.096 1.00 0.00 H new ATOM 0 HB3 LEU A 497 0.020 -3.807 4.419 1.00 0.00 H new ATOM 0 HG LEU A 497 -1.890 -2.099 2.809 1.00 0.00 H new ATOM 0 HD11 LEU A 497 0.089 -0.977 1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -0.082 -0.658 3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 497 1.125 -1.833 3.034 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -0.698 -3.113 0.905 1.00 0.00 H new ATOM 0 HD22 LEU A 497 0.307 -4.048 2.037 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -1.445 -4.347 1.947 1.00 0.00 H new ATOM 785 N LYS A 498 -1.577 -4.919 6.906 1.00 0.00 N ATOM 786 CA LYS A 498 -1.188 -5.953 7.864 1.00 0.00 C ATOM 787 C LYS A 498 -1.985 -7.232 7.649 1.00 0.00 C ATOM 788 O LYS A 498 -1.432 -8.326 7.651 1.00 0.00 O ATOM 789 CB LYS A 498 -1.385 -5.456 9.293 1.00 0.00 C ATOM 790 CG LYS A 498 -0.957 -6.461 10.351 1.00 0.00 C ATOM 791 CD LYS A 498 0.556 -6.562 10.442 1.00 0.00 C ATOM 792 CE LYS A 498 0.985 -7.696 11.359 1.00 0.00 C ATOM 793 NZ LYS A 498 2.173 -7.329 12.179 1.00 0.00 N ATOM 0 H LYS A 498 -1.753 -4.004 7.321 1.00 0.00 H new ATOM 0 HA LYS A 498 -0.133 -6.174 7.703 1.00 0.00 H new ATOM 0 HB2 LYS A 498 -0.820 -4.534 9.429 1.00 0.00 H new ATOM 0 HB3 LYS A 498 -2.436 -5.210 9.442 1.00 0.00 H new ATOM 0 HG2 LYS A 498 -1.362 -6.167 11.319 1.00 0.00 H new ATOM 0 HG3 LYS A 498 -1.375 -7.440 10.115 1.00 0.00 H new ATOM 0 HD2 LYS A 498 0.972 -6.721 9.447 1.00 0.00 H new ATOM 0 HD3 LYS A 498 0.963 -5.621 10.811 1.00 0.00 H new ATOM 0 HE2 LYS A 498 0.158 -7.963 12.017 1.00 0.00 H new ATOM 0 HE3 LYS A 498 1.215 -8.578 10.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 2.433 -8.129 12.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 2.970 -7.099 11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 1.946 -6.503 12.768 1.00 0.00 H new ATOM 807 N ARG A 499 -3.288 -7.097 7.468 1.00 0.00 N ATOM 808 CA ARG A 499 -4.135 -8.259 7.251 1.00 0.00 C ATOM 809 C ARG A 499 -4.061 -8.740 5.802 1.00 0.00 C ATOM 810 O ARG A 499 -4.477 -9.855 5.488 1.00 0.00 O ATOM 811 CB ARG A 499 -5.583 -7.950 7.632 1.00 0.00 C ATOM 812 CG ARG A 499 -5.766 -7.608 9.102 1.00 0.00 C ATOM 813 CD ARG A 499 -7.235 -7.438 9.454 1.00 0.00 C ATOM 814 NE ARG A 499 -7.416 -6.887 10.795 1.00 0.00 N ATOM 815 CZ ARG A 499 -7.255 -7.590 11.913 1.00 0.00 C ATOM 816 NH1 ARG A 499 -6.906 -8.870 11.857 1.00 0.00 N ATOM 817 NH2 ARG A 499 -7.440 -7.012 13.092 1.00 0.00 N ATOM 0 H ARG A 499 -3.780 -6.203 7.467 1.00 0.00 H new ATOM 0 HA ARG A 499 -3.766 -9.060 7.892 1.00 0.00 H new ATOM 0 HB2 ARG A 499 -5.939 -7.116 7.027 1.00 0.00 H new ATOM 0 HB3 ARG A 499 -6.206 -8.811 7.388 1.00 0.00 H new ATOM 0 HG2 ARG A 499 -5.332 -8.396 9.717 1.00 0.00 H new ATOM 0 HG3 ARG A 499 -5.226 -6.690 9.333 1.00 0.00 H new ATOM 0 HD2 ARG A 499 -7.709 -6.781 8.725 1.00 0.00 H new ATOM 0 HD3 ARG A 499 -7.738 -8.403 9.388 1.00 0.00 H new ATOM 0 HE ARG A 499 -7.681 -5.906 10.879 1.00 0.00 H new ATOM 0 HH11 ARG A 499 -6.760 -9.320 10.953 1.00 0.00 H new ATOM 0 HH12 ARG A 499 -6.784 -9.404 12.718 1.00 0.00 H new ATOM 0 HH21 ARG A 499 -7.706 -6.028 13.142 1.00 0.00 H new ATOM 0 HH22 ARG A 499 -7.317 -7.551 13.949 1.00 0.00 H new ATOM 831 N LEU A 500 -3.545 -7.888 4.921 1.00 0.00 N ATOM 832 CA LEU A 500 -3.436 -8.222 3.507 1.00 0.00 C ATOM 833 C LEU A 500 -2.652 -9.506 3.284 1.00 0.00 C ATOM 834 O LEU A 500 -3.135 -10.437 2.639 1.00 0.00 O ATOM 835 CB LEU A 500 -2.791 -7.069 2.735 1.00 0.00 C ATOM 836 CG LEU A 500 -2.983 -7.116 1.217 1.00 0.00 C ATOM 837 CD1 LEU A 500 -4.452 -7.300 0.868 1.00 0.00 C ATOM 838 CD2 LEU A 500 -2.437 -5.851 0.572 1.00 0.00 C ATOM 0 H LEU A 500 -3.196 -6.961 5.163 1.00 0.00 H new ATOM 0 HA LEU A 500 -4.447 -8.384 3.133 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -3.199 -6.129 3.108 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -1.723 -7.061 2.950 1.00 0.00 H new ATOM 0 HG LEU A 500 -2.428 -7.970 0.827 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -4.567 -7.331 -0.215 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -4.814 -8.234 1.298 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -5.029 -6.467 1.271 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -2.582 -5.901 -0.507 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -2.964 -4.983 0.969 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -1.373 -5.761 0.792 1.00 0.00 H new ATOM 850 N ASN A 501 -1.442 -9.550 3.812 1.00 0.00 N ATOM 851 CA ASN A 501 -0.587 -10.719 3.663 1.00 0.00 C ATOM 852 C ASN A 501 -0.276 -10.986 2.189 1.00 0.00 C ATOM 853 O ASN A 501 -0.485 -12.094 1.695 1.00 0.00 O ATOM 854 CB ASN A 501 -1.257 -11.947 4.285 1.00 0.00 C ATOM 855 CG ASN A 501 -0.253 -12.921 4.867 1.00 0.00 C ATOM 856 OD1 ASN A 501 0.587 -13.466 4.151 1.00 0.00 O ATOM 857 ND2 ASN A 501 -0.334 -13.148 6.173 1.00 0.00 N ATOM 0 H ASN A 501 -1.027 -8.789 4.349 1.00 0.00 H new ATOM 0 HA ASN A 501 0.351 -10.521 4.182 1.00 0.00 H new ATOM 0 HB2 ASN A 501 -1.943 -11.625 5.069 1.00 0.00 H new ATOM 0 HB3 ASN A 501 -1.854 -12.454 3.527 1.00 0.00 H new ATOM 0 HD21 ASN A 501 0.316 -13.795 6.619 1.00 0.00 H new ATOM 0 HD22 ASN A 501 -1.046 -12.675 6.730 1.00 0.00 H new ATOM 864 N PRO A 502 0.233 -9.973 1.459 1.00 0.00 N ATOM 865 CA PRO A 502 0.569 -10.119 0.038 1.00 0.00 C ATOM 866 C PRO A 502 1.754 -11.052 -0.183 1.00 0.00 C ATOM 867 O PRO A 502 2.370 -11.527 0.771 1.00 0.00 O ATOM 868 CB PRO A 502 0.930 -8.695 -0.411 1.00 0.00 C ATOM 869 CG PRO A 502 0.472 -7.796 0.687 1.00 0.00 C ATOM 870 CD PRO A 502 0.523 -8.612 1.944 1.00 0.00 C ATOM 0 HA PRO A 502 -0.257 -10.556 -0.522 1.00 0.00 H new ATOM 0 HB2 PRO A 502 2.003 -8.597 -0.575 1.00 0.00 H new ATOM 0 HB3 PRO A 502 0.439 -8.445 -1.352 1.00 0.00 H new ATOM 0 HG2 PRO A 502 1.115 -6.919 0.766 1.00 0.00 H new ATOM 0 HG3 PRO A 502 -0.539 -7.435 0.498 1.00 0.00 H new ATOM 0 HD2 PRO A 502 1.499 -8.553 2.426 1.00 0.00 H new ATOM 0 HD3 PRO A 502 -0.213 -8.277 2.674 1.00 0.00 H new ATOM 878 N GLU A 503 2.072 -11.304 -1.448 1.00 0.00 N ATOM 879 CA GLU A 503 3.188 -12.172 -1.800 1.00 0.00 C ATOM 880 C GLU A 503 4.309 -11.365 -2.446 1.00 0.00 C ATOM 881 O GLU A 503 4.072 -10.583 -3.367 1.00 0.00 O ATOM 882 CB GLU A 503 2.726 -13.280 -2.748 1.00 0.00 C ATOM 883 CG GLU A 503 1.653 -14.180 -2.157 1.00 0.00 C ATOM 884 CD GLU A 503 2.128 -14.917 -0.920 1.00 0.00 C ATOM 885 OE1 GLU A 503 3.357 -15.005 -0.715 1.00 0.00 O ATOM 886 OE2 GLU A 503 1.270 -15.408 -0.155 1.00 0.00 O ATOM 0 H GLU A 503 1.571 -10.918 -2.248 1.00 0.00 H new ATOM 0 HA GLU A 503 3.567 -12.629 -0.886 1.00 0.00 H new ATOM 0 HB2 GLU A 503 2.345 -12.828 -3.663 1.00 0.00 H new ATOM 0 HB3 GLU A 503 3.586 -13.889 -3.027 1.00 0.00 H new ATOM 0 HG2 GLU A 503 0.779 -13.580 -1.905 1.00 0.00 H new ATOM 0 HG3 GLU A 503 1.337 -14.904 -2.908 1.00 0.00 H new ATOM 893 N ARG A 504 5.528 -11.556 -1.956 1.00 0.00 N ATOM 894 CA ARG A 504 6.683 -10.839 -2.484 1.00 0.00 C ATOM 895 C ARG A 504 7.011 -11.291 -3.903 1.00 0.00 C ATOM 896 O ARG A 504 6.966 -12.482 -4.213 1.00 0.00 O ATOM 897 CB ARG A 504 7.897 -11.049 -1.577 1.00 0.00 C ATOM 898 CG ARG A 504 7.718 -10.478 -0.180 1.00 0.00 C ATOM 899 CD ARG A 504 8.985 -10.625 0.649 1.00 0.00 C ATOM 900 NE ARG A 504 9.410 -12.018 0.755 1.00 0.00 N ATOM 901 CZ ARG A 504 10.427 -12.427 1.510 1.00 0.00 C ATOM 902 NH1 ARG A 504 11.125 -11.553 2.226 1.00 0.00 N ATOM 903 NH2 ARG A 504 10.748 -13.713 1.551 1.00 0.00 N ATOM 0 H ARG A 504 5.742 -12.200 -1.195 1.00 0.00 H new ATOM 0 HA ARG A 504 6.435 -9.778 -2.512 1.00 0.00 H new ATOM 0 HB2 ARG A 504 8.103 -12.117 -1.501 1.00 0.00 H new ATOM 0 HB3 ARG A 504 8.770 -10.589 -2.040 1.00 0.00 H new ATOM 0 HG2 ARG A 504 7.447 -9.424 -0.248 1.00 0.00 H new ATOM 0 HG3 ARG A 504 6.894 -10.987 0.320 1.00 0.00 H new ATOM 0 HD2 ARG A 504 9.784 -10.035 0.199 1.00 0.00 H new ATOM 0 HD3 ARG A 504 8.814 -10.221 1.647 1.00 0.00 H new ATOM 0 HE ARG A 504 8.898 -12.719 0.219 1.00 0.00 H new ATOM 0 HH11 ARG A 504 10.883 -10.563 2.199 1.00 0.00 H new ATOM 0 HH12 ARG A 504 11.903 -11.872 2.803 1.00 0.00 H new ATOM 0 HH21 ARG A 504 10.215 -14.389 1.004 1.00 0.00 H new ATOM 0 HH22 ARG A 504 11.527 -14.026 2.130 1.00 0.00 H new ATOM 917 N LYS A 505 7.344 -10.332 -4.759 1.00 0.00 N ATOM 918 CA LYS A 505 7.685 -10.625 -6.147 1.00 0.00 C ATOM 919 C LYS A 505 8.662 -9.591 -6.694 1.00 0.00 C ATOM 920 O LYS A 505 8.378 -8.394 -6.698 1.00 0.00 O ATOM 921 CB LYS A 505 6.422 -10.656 -7.010 1.00 0.00 C ATOM 922 CG LYS A 505 6.681 -11.060 -8.452 1.00 0.00 C ATOM 923 CD LYS A 505 5.453 -10.845 -9.321 1.00 0.00 C ATOM 924 CE LYS A 505 4.390 -11.898 -9.054 1.00 0.00 C ATOM 925 NZ LYS A 505 3.592 -12.205 -10.273 1.00 0.00 N ATOM 0 H LYS A 505 7.385 -9.342 -4.516 1.00 0.00 H new ATOM 0 HA LYS A 505 8.162 -11.605 -6.179 1.00 0.00 H new ATOM 0 HB2 LYS A 505 5.708 -11.351 -6.569 1.00 0.00 H new ATOM 0 HB3 LYS A 505 5.958 -9.670 -6.995 1.00 0.00 H new ATOM 0 HG2 LYS A 505 7.515 -10.481 -8.849 1.00 0.00 H new ATOM 0 HG3 LYS A 505 6.975 -12.109 -8.490 1.00 0.00 H new ATOM 0 HD2 LYS A 505 5.041 -9.854 -9.131 1.00 0.00 H new ATOM 0 HD3 LYS A 505 5.740 -10.875 -10.372 1.00 0.00 H new ATOM 0 HE2 LYS A 505 4.865 -12.810 -8.692 1.00 0.00 H new ATOM 0 HE3 LYS A 505 3.725 -11.550 -8.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 505 2.878 -12.927 -10.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 505 3.117 -11.341 -10.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 505 4.222 -12.562 -11.020 1.00 0.00 H new ATOM 939 N MET A 506 9.819 -10.059 -7.154 1.00 0.00 N ATOM 940 CA MET A 506 10.838 -9.173 -7.702 1.00 0.00 C ATOM 941 C MET A 506 10.584 -8.896 -9.179 1.00 0.00 C ATOM 942 O MET A 506 10.785 -9.765 -10.028 1.00 0.00 O ATOM 943 CB MET A 506 12.228 -9.786 -7.517 1.00 0.00 C ATOM 944 CG MET A 506 12.643 -9.927 -6.061 1.00 0.00 C ATOM 945 SD MET A 506 14.351 -10.474 -5.877 1.00 0.00 S ATOM 946 CE MET A 506 15.235 -8.993 -6.358 1.00 0.00 C ATOM 0 H MET A 506 10.073 -11.047 -7.158 1.00 0.00 H new ATOM 0 HA MET A 506 10.790 -8.227 -7.162 1.00 0.00 H new ATOM 0 HB2 MET A 506 12.248 -10.769 -7.988 1.00 0.00 H new ATOM 0 HB3 MET A 506 12.960 -9.168 -8.037 1.00 0.00 H new ATOM 0 HG2 MET A 506 12.516 -8.969 -5.556 1.00 0.00 H new ATOM 0 HG3 MET A 506 11.982 -10.638 -5.566 1.00 0.00 H new ATOM 0 HE1 MET A 506 16.273 -9.067 -6.033 1.00 0.00 H new ATOM 0 HE2 MET A 506 15.201 -8.885 -7.442 1.00 0.00 H new ATOM 0 HE3 MET A 506 14.770 -8.124 -5.892 1.00 0.00 H new ATOM 956 N ILE A 507 10.143 -7.680 -9.481 1.00 0.00 N ATOM 957 CA ILE A 507 9.863 -7.287 -10.857 1.00 0.00 C ATOM 958 C ILE A 507 10.625 -6.020 -11.232 1.00 0.00 C ATOM 959 O ILE A 507 10.541 -5.005 -10.539 1.00 0.00 O ATOM 960 CB ILE A 507 8.355 -7.052 -11.079 1.00 0.00 C ATOM 961 CG1 ILE A 507 7.552 -8.253 -10.577 1.00 0.00 C ATOM 962 CG2 ILE A 507 8.068 -6.794 -12.551 1.00 0.00 C ATOM 963 CD1 ILE A 507 6.055 -8.039 -10.620 1.00 0.00 C ATOM 0 H ILE A 507 9.972 -6.949 -8.791 1.00 0.00 H new ATOM 0 HA ILE A 507 10.192 -8.108 -11.494 1.00 0.00 H new ATOM 0 HB ILE A 507 8.052 -6.172 -10.512 1.00 0.00 H new ATOM 0 HG12 ILE A 507 7.804 -9.126 -11.180 1.00 0.00 H new ATOM 0 HG13 ILE A 507 7.850 -8.476 -9.553 1.00 0.00 H new ATOM 0 HG21 ILE A 507 6.999 -6.630 -12.690 1.00 0.00 H new ATOM 0 HG22 ILE A 507 8.616 -5.911 -12.879 1.00 0.00 H new ATOM 0 HG23 ILE A 507 8.383 -7.656 -13.140 1.00 0.00 H new ATOM 0 HD11 ILE A 507 5.549 -8.931 -10.250 1.00 0.00 H new ATOM 0 HD12 ILE A 507 5.791 -7.186 -9.994 1.00 0.00 H new ATOM 0 HD13 ILE A 507 5.744 -7.846 -11.647 1.00 0.00 H new ATOM 975 N ASN A 508 11.367 -6.085 -12.332 1.00 0.00 N ATOM 976 CA ASN A 508 12.144 -4.942 -12.800 1.00 0.00 C ATOM 977 C ASN A 508 13.132 -4.481 -11.733 1.00 0.00 C ATOM 978 O ASN A 508 13.317 -3.282 -11.519 1.00 0.00 O ATOM 979 CB ASN A 508 11.213 -3.790 -13.184 1.00 0.00 C ATOM 980 CG ASN A 508 11.944 -2.669 -13.897 1.00 0.00 C ATOM 981 OD1 ASN A 508 12.213 -1.619 -13.316 1.00 0.00 O ATOM 982 ND2 ASN A 508 12.269 -2.889 -15.166 1.00 0.00 N ATOM 0 H ASN A 508 11.447 -6.917 -12.917 1.00 0.00 H new ATOM 0 HA ASN A 508 12.708 -5.253 -13.679 1.00 0.00 H new ATOM 0 HB2 ASN A 508 10.418 -4.168 -13.827 1.00 0.00 H new ATOM 0 HB3 ASN A 508 10.737 -3.396 -12.286 1.00 0.00 H new ATOM 0 HD21 ASN A 508 12.762 -2.172 -15.698 1.00 0.00 H new ATOM 0 HD22 ASN A 508 12.026 -3.775 -15.608 1.00 0.00 H new ATOM 989 N ASP A 509 13.765 -5.440 -11.066 1.00 0.00 N ATOM 990 CA ASP A 509 14.735 -5.135 -10.020 1.00 0.00 C ATOM 991 C ASP A 509 14.097 -4.300 -8.912 1.00 0.00 C ATOM 992 O ASP A 509 14.723 -3.390 -8.369 1.00 0.00 O ATOM 993 CB ASP A 509 15.934 -4.390 -10.611 1.00 0.00 C ATOM 994 CG ASP A 509 16.707 -5.235 -11.604 1.00 0.00 C ATOM 995 OD1 ASP A 509 16.543 -6.473 -11.585 1.00 0.00 O ATOM 996 OD2 ASP A 509 17.478 -4.658 -12.399 1.00 0.00 O ATOM 0 H ASP A 509 13.624 -6.437 -11.231 1.00 0.00 H new ATOM 0 HA ASP A 509 15.077 -6.076 -9.589 1.00 0.00 H new ATOM 0 HB2 ASP A 509 15.587 -3.482 -11.104 1.00 0.00 H new ATOM 0 HB3 ASP A 509 16.600 -4.081 -9.805 1.00 0.00 H new ATOM 1001 N LYS A 510 12.850 -4.619 -8.582 1.00 0.00 N ATOM 1002 CA LYS A 510 12.128 -3.901 -7.538 1.00 0.00 C ATOM 1003 C LYS A 510 11.198 -4.840 -6.778 1.00 0.00 C ATOM 1004 O LYS A 510 10.774 -5.869 -7.302 1.00 0.00 O ATOM 1005 CB LYS A 510 11.327 -2.747 -8.143 1.00 0.00 C ATOM 1006 CG LYS A 510 10.787 -1.774 -7.108 1.00 0.00 C ATOM 1007 CD LYS A 510 10.225 -0.521 -7.760 1.00 0.00 C ATOM 1008 CE LYS A 510 8.939 -0.814 -8.517 1.00 0.00 C ATOM 1009 NZ LYS A 510 9.197 -1.134 -9.948 1.00 0.00 N ATOM 0 H LYS A 510 12.318 -5.370 -9.022 1.00 0.00 H new ATOM 0 HA LYS A 510 12.858 -3.496 -6.837 1.00 0.00 H new ATOM 0 HB2 LYS A 510 11.961 -2.204 -8.844 1.00 0.00 H new ATOM 0 HB3 LYS A 510 10.494 -3.155 -8.716 1.00 0.00 H new ATOM 0 HG2 LYS A 510 10.008 -2.261 -6.521 1.00 0.00 H new ATOM 0 HG3 LYS A 510 11.583 -1.499 -6.416 1.00 0.00 H new ATOM 0 HD2 LYS A 510 10.035 0.233 -6.997 1.00 0.00 H new ATOM 0 HD3 LYS A 510 10.964 -0.103 -8.444 1.00 0.00 H new ATOM 0 HE2 LYS A 510 8.423 -1.650 -8.045 1.00 0.00 H new ATOM 0 HE3 LYS A 510 8.275 0.048 -8.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 8.552 -0.582 -10.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 10.181 -0.895 -10.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 9.038 -2.149 -10.111 1.00 0.00 H new ATOM 1023 N MET A 511 10.886 -4.479 -5.538 1.00 0.00 N ATOM 1024 CA MET A 511 10.008 -5.291 -4.703 1.00 0.00 C ATOM 1025 C MET A 511 8.541 -5.007 -5.013 1.00 0.00 C ATOM 1026 O MET A 511 8.109 -3.855 -5.021 1.00 0.00 O ATOM 1027 CB MET A 511 10.289 -5.026 -3.223 1.00 0.00 C ATOM 1028 CG MET A 511 9.503 -5.926 -2.284 1.00 0.00 C ATOM 1029 SD MET A 511 9.746 -5.500 -0.549 1.00 0.00 S ATOM 1030 CE MET A 511 8.842 -3.957 -0.449 1.00 0.00 C ATOM 0 H MET A 511 11.228 -3.629 -5.089 1.00 0.00 H new ATOM 0 HA MET A 511 10.209 -6.340 -4.923 1.00 0.00 H new ATOM 0 HB2 MET A 511 11.354 -5.160 -3.034 1.00 0.00 H new ATOM 0 HB3 MET A 511 10.054 -3.986 -2.998 1.00 0.00 H new ATOM 0 HG2 MET A 511 8.442 -5.859 -2.526 1.00 0.00 H new ATOM 0 HG3 MET A 511 9.802 -6.962 -2.445 1.00 0.00 H new ATOM 0 HE1 MET A 511 8.562 -3.766 0.587 1.00 0.00 H new ATOM 0 HE2 MET A 511 9.470 -3.143 -0.811 1.00 0.00 H new ATOM 0 HE3 MET A 511 7.943 -4.022 -1.062 1.00 0.00 H new ATOM 1040 N HIS A 512 7.781 -6.069 -5.265 1.00 0.00 N ATOM 1041 CA HIS A 512 6.362 -5.939 -5.573 1.00 0.00 C ATOM 1042 C HIS A 512 5.542 -6.957 -4.787 1.00 0.00 C ATOM 1043 O HIS A 512 6.063 -7.986 -4.354 1.00 0.00 O ATOM 1044 CB HIS A 512 6.122 -6.128 -7.073 1.00 0.00 C ATOM 1045 CG HIS A 512 6.607 -4.984 -7.907 1.00 0.00 C ATOM 1046 ND1 HIS A 512 6.010 -3.813 -8.237 1.00 0.00 N flip ATOM 1047 CD2 HIS A 512 7.844 -4.967 -8.517 1.00 0.00 C flip ATOM 1048 CE1 HIS A 512 6.890 -3.119 -9.030 1.00 0.00 C flip ATOM 1049 NE2 HIS A 512 7.988 -3.835 -9.183 1.00 0.00 N flip ATOM 0 H HIS A 512 8.125 -7.029 -5.262 1.00 0.00 H new ATOM 0 HA HIS A 512 6.044 -4.937 -5.285 1.00 0.00 H new ATOM 0 HB2 HIS A 512 6.619 -7.041 -7.400 1.00 0.00 H new ATOM 0 HB3 HIS A 512 5.055 -6.267 -7.247 1.00 0.00 H new ATOM 0 HD1 HIS A 512 5.081 -3.505 -7.950 1.00 0.00 H new ATOM 0 HD2 HIS A 512 8.580 -5.756 -8.459 1.00 0.00 H new ATOM 0 HE1 HIS A 512 6.712 -2.144 -9.459 1.00 0.00 H new ATOM 1058 N PHE A 513 4.257 -6.668 -4.608 1.00 0.00 N ATOM 1059 CA PHE A 513 3.368 -7.562 -3.876 1.00 0.00 C ATOM 1060 C PHE A 513 2.338 -8.187 -4.811 1.00 0.00 C ATOM 1061 O PHE A 513 1.784 -7.513 -5.680 1.00 0.00 O ATOM 1062 CB PHE A 513 2.657 -6.805 -2.752 1.00 0.00 C ATOM 1063 CG PHE A 513 3.567 -6.395 -1.628 1.00 0.00 C ATOM 1064 CD1 PHE A 513 4.534 -7.263 -1.145 1.00 0.00 C ATOM 1065 CD2 PHE A 513 3.455 -5.138 -1.054 1.00 0.00 C ATOM 1066 CE1 PHE A 513 5.369 -6.887 -0.111 1.00 0.00 C ATOM 1067 CE2 PHE A 513 4.288 -4.757 -0.021 1.00 0.00 C ATOM 1068 CZ PHE A 513 5.246 -5.631 0.452 1.00 0.00 C ATOM 0 H PHE A 513 3.809 -5.822 -4.960 1.00 0.00 H new ATOM 0 HA PHE A 513 3.973 -8.358 -3.442 1.00 0.00 H new ATOM 0 HB2 PHE A 513 2.185 -5.915 -3.168 1.00 0.00 H new ATOM 0 HB3 PHE A 513 1.860 -7.432 -2.352 1.00 0.00 H new ATOM 0 HD1 PHE A 513 4.636 -8.245 -1.583 1.00 0.00 H new ATOM 0 HD2 PHE A 513 2.708 -4.449 -1.419 1.00 0.00 H new ATOM 0 HE1 PHE A 513 6.117 -7.574 0.257 1.00 0.00 H new ATOM 0 HE2 PHE A 513 4.190 -3.775 0.417 1.00 0.00 H new ATOM 0 HZ PHE A 513 5.898 -5.334 1.260 1.00 0.00 H new ATOM 1078 N SER A 514 2.085 -9.479 -4.626 1.00 0.00 N ATOM 1079 CA SER A 514 1.120 -10.194 -5.453 1.00 0.00 C ATOM 1080 C SER A 514 0.161 -11.004 -4.587 1.00 0.00 C ATOM 1081 O SER A 514 0.533 -11.492 -3.520 1.00 0.00 O ATOM 1082 CB SER A 514 1.843 -11.115 -6.437 1.00 0.00 C ATOM 1083 OG SER A 514 2.578 -12.115 -5.753 1.00 0.00 O ATOM 0 H SER A 514 2.535 -10.051 -3.911 1.00 0.00 H new ATOM 0 HA SER A 514 0.542 -9.460 -6.014 1.00 0.00 H new ATOM 0 HB2 SER A 514 1.117 -11.583 -7.102 1.00 0.00 H new ATOM 0 HB3 SER A 514 2.516 -10.528 -7.062 1.00 0.00 H new ATOM 0 HG SER A 514 3.030 -12.692 -6.404 1.00 0.00 H new ATOM 1089 N LEU A 515 -1.076 -11.144 -5.053 1.00 0.00 N ATOM 1090 CA LEU A 515 -2.088 -11.895 -4.321 1.00 0.00 C ATOM 1091 C LEU A 515 -2.642 -13.036 -5.166 1.00 0.00 C ATOM 1092 O LEU A 515 -2.774 -12.913 -6.384 1.00 0.00 O ATOM 1093 CB LEU A 515 -3.226 -10.971 -3.886 1.00 0.00 C ATOM 1094 CG LEU A 515 -2.965 -10.182 -2.603 1.00 0.00 C ATOM 1095 CD1 LEU A 515 -3.979 -9.059 -2.453 1.00 0.00 C ATOM 1096 CD2 LEU A 515 -3.006 -11.107 -1.395 1.00 0.00 C ATOM 0 H LEU A 515 -1.401 -10.747 -5.934 1.00 0.00 H new ATOM 0 HA LEU A 515 -1.614 -12.320 -3.436 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.430 -10.267 -4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -4.127 -11.569 -3.750 1.00 0.00 H new ATOM 0 HG LEU A 515 -1.971 -9.739 -2.664 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -3.778 -8.508 -1.534 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -3.903 -8.384 -3.305 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -4.984 -9.479 -2.412 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -2.818 -10.531 -0.489 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -3.987 -11.577 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -2.242 -11.877 -1.500 1.00 0.00 H new ATOM 1108 N LYS A 516 -2.968 -14.146 -4.512 1.00 0.00 N ATOM 1109 CA LYS A 516 -3.511 -15.309 -5.202 1.00 0.00 C ATOM 1110 C LYS A 516 -4.839 -15.733 -4.585 1.00 0.00 C ATOM 1111 O LYS A 516 -4.870 -16.476 -3.604 1.00 0.00 O ATOM 1112 CB LYS A 516 -2.517 -16.470 -5.148 1.00 0.00 C ATOM 1113 CG LYS A 516 -1.219 -16.195 -5.889 1.00 0.00 C ATOM 1114 CD LYS A 516 -0.255 -17.364 -5.776 1.00 0.00 C ATOM 1115 CE LYS A 516 -0.767 -18.583 -6.526 1.00 0.00 C ATOM 1116 NZ LYS A 516 0.200 -19.714 -6.474 1.00 0.00 N ATOM 0 H LYS A 516 -2.865 -14.264 -3.504 1.00 0.00 H new ATOM 0 HA LYS A 516 -3.684 -15.036 -6.243 1.00 0.00 H new ATOM 0 HB2 LYS A 516 -2.290 -16.695 -4.106 1.00 0.00 H new ATOM 0 HB3 LYS A 516 -2.986 -17.359 -5.571 1.00 0.00 H new ATOM 0 HG2 LYS A 516 -1.433 -15.999 -6.940 1.00 0.00 H new ATOM 0 HG3 LYS A 516 -0.752 -15.297 -5.486 1.00 0.00 H new ATOM 0 HD2 LYS A 516 0.718 -17.074 -6.172 1.00 0.00 H new ATOM 0 HD3 LYS A 516 -0.109 -17.616 -4.726 1.00 0.00 H new ATOM 0 HE2 LYS A 516 -1.718 -18.899 -6.098 1.00 0.00 H new ATOM 0 HE3 LYS A 516 -0.958 -18.316 -7.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 -0.187 -20.526 -6.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 1.100 -19.421 -6.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 0.363 -19.986 -5.484 1.00 0.00 H new ATOM 1130 N GLU A 517 -5.935 -15.253 -5.168 1.00 0.00 N ATOM 1131 CA GLU A 517 -7.279 -15.574 -4.687 1.00 0.00 C ATOM 1132 C GLU A 517 -7.364 -15.478 -3.165 1.00 0.00 C ATOM 1133 O GLU A 517 -6.472 -14.844 -2.562 1.00 0.00 O ATOM 1134 CB GLU A 517 -7.696 -16.973 -5.153 1.00 0.00 C ATOM 1135 CG GLU A 517 -6.925 -18.106 -4.488 1.00 0.00 C ATOM 1136 CD GLU A 517 -5.686 -18.505 -5.265 1.00 0.00 C ATOM 1137 OE1 GLU A 517 -5.597 -18.155 -6.461 1.00 0.00 O ATOM 1138 OE2 GLU A 517 -4.804 -19.166 -4.677 1.00 0.00 O ATOM 1139 OXT GLU A 517 -8.322 -16.037 -2.590 1.00 0.00 O ATOM 0 H GLU A 517 -5.919 -14.636 -5.980 1.00 0.00 H new ATOM 0 HA GLU A 517 -7.966 -14.841 -5.110 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -8.760 -17.108 -4.957 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -7.560 -17.040 -6.232 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -6.636 -17.802 -3.482 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -7.578 -18.972 -4.384 1.00 0.00 H new TER 1146 GLU A 517 ATOM 1147 N GLY B 941 14.090 18.989 4.950 1.00 0.00 N ATOM 1148 CA GLY B 941 14.581 18.192 3.791 1.00 0.00 C ATOM 1149 C GLY B 941 13.549 18.077 2.687 1.00 0.00 C ATOM 1150 O GLY B 941 12.433 18.579 2.818 1.00 0.00 O ATOM 0 HA2 GLY B 941 15.484 18.654 3.393 1.00 0.00 H new ATOM 0 HA3 GLY B 941 14.857 17.194 4.131 1.00 0.00 H new ATOM 1154 N SER B 942 13.922 17.414 1.598 1.00 0.00 N ATOM 1155 CA SER B 942 13.020 17.234 0.465 1.00 0.00 C ATOM 1156 C SER B 942 12.775 15.752 0.197 1.00 0.00 C ATOM 1157 O SER B 942 13.634 14.912 0.464 1.00 0.00 O ATOM 1158 CB SER B 942 13.597 17.902 -0.784 1.00 0.00 C ATOM 1159 OG SER B 942 14.806 17.280 -1.184 1.00 0.00 O ATOM 0 H SER B 942 14.843 16.992 1.475 1.00 0.00 H new ATOM 0 HA SER B 942 12.067 17.703 0.711 1.00 0.00 H new ATOM 0 HB2 SER B 942 12.872 17.850 -1.596 1.00 0.00 H new ATOM 0 HB3 SER B 942 13.777 18.958 -0.585 1.00 0.00 H new ATOM 0 HG SER B 942 15.153 17.725 -1.985 1.00 0.00 H new ATOM 1165 N SER B 943 11.598 15.439 -0.335 1.00 0.00 N ATOM 1166 CA SER B 943 11.237 14.060 -0.641 1.00 0.00 C ATOM 1167 C SER B 943 11.333 13.178 0.601 1.00 0.00 C ATOM 1168 O SER B 943 11.526 11.966 0.499 1.00 0.00 O ATOM 1169 CB SER B 943 12.144 13.507 -1.742 1.00 0.00 C ATOM 1170 OG SER B 943 11.760 12.194 -2.109 1.00 0.00 O ATOM 0 H SER B 943 10.877 16.123 -0.563 1.00 0.00 H new ATOM 0 HA SER B 943 10.204 14.053 -0.989 1.00 0.00 H new ATOM 0 HB2 SER B 943 12.101 14.159 -2.614 1.00 0.00 H new ATOM 0 HB3 SER B 943 13.178 13.504 -1.398 1.00 0.00 H new ATOM 0 HG SER B 943 11.551 11.677 -1.303 1.00 0.00 H new ATOM 1176 N SER B 944 11.194 13.792 1.773 1.00 0.00 N ATOM 1177 CA SER B 944 11.265 13.059 3.031 1.00 0.00 C ATOM 1178 C SER B 944 9.875 12.620 3.485 1.00 0.00 C ATOM 1179 O SER B 944 9.697 11.509 3.984 1.00 0.00 O ATOM 1180 CB SER B 944 11.917 13.923 4.112 1.00 0.00 C ATOM 1181 OG SER B 944 13.317 13.708 4.160 1.00 0.00 O ATOM 0 H SER B 944 11.032 14.794 1.876 1.00 0.00 H new ATOM 0 HA SER B 944 11.873 12.169 2.870 1.00 0.00 H new ATOM 0 HB2 SER B 944 11.714 14.975 3.913 1.00 0.00 H new ATOM 0 HB3 SER B 944 11.477 13.692 5.082 1.00 0.00 H new ATOM 0 HG SER B 944 13.711 14.273 4.857 1.00 0.00 H new ATOM 1187 N GLU B 945 8.895 13.500 3.306 1.00 0.00 N ATOM 1188 CA GLU B 945 7.522 13.204 3.696 1.00 0.00 C ATOM 1189 C GLU B 945 6.984 12.005 2.924 1.00 0.00 C ATOM 1190 O GLU B 945 6.250 11.180 3.469 1.00 0.00 O ATOM 1191 CB GLU B 945 6.628 14.422 3.457 1.00 0.00 C ATOM 1192 CG GLU B 945 5.206 14.243 3.964 1.00 0.00 C ATOM 1193 CD GLU B 945 4.314 15.424 3.633 1.00 0.00 C ATOM 1194 OE1 GLU B 945 4.792 16.362 2.964 1.00 0.00 O ATOM 1195 OE2 GLU B 945 3.134 15.408 4.044 1.00 0.00 O ATOM 0 H GLU B 945 9.027 14.424 2.893 1.00 0.00 H new ATOM 0 HA GLU B 945 7.517 12.961 4.759 1.00 0.00 H new ATOM 0 HB2 GLU B 945 7.072 15.289 3.945 1.00 0.00 H new ATOM 0 HB3 GLU B 945 6.599 14.637 2.389 1.00 0.00 H new ATOM 0 HG2 GLU B 945 4.781 13.338 3.529 1.00 0.00 H new ATOM 0 HG3 GLU B 945 5.225 14.099 5.044 1.00 0.00 H new ATOM 1202 N ALA B 946 7.353 11.914 1.649 1.00 0.00 N ATOM 1203 CA ALA B 946 6.906 10.815 0.802 1.00 0.00 C ATOM 1204 C ALA B 946 7.512 9.490 1.254 1.00 0.00 C ATOM 1205 O ALA B 946 6.803 8.497 1.417 1.00 0.00 O ATOM 1206 CB ALA B 946 7.264 11.092 -0.651 1.00 0.00 C ATOM 0 H ALA B 946 7.960 12.588 1.181 1.00 0.00 H new ATOM 0 HA ALA B 946 5.822 10.737 0.891 1.00 0.00 H new ATOM 0 HB1 ALA B 946 6.925 10.264 -1.273 1.00 0.00 H new ATOM 0 HB2 ALA B 946 6.779 12.013 -0.976 1.00 0.00 H new ATOM 0 HB3 ALA B 946 8.345 11.198 -0.746 1.00 0.00 H new ATOM 1212 N ASP B 947 8.826 9.483 1.453 1.00 0.00 N ATOM 1213 CA ASP B 947 9.525 8.280 1.886 1.00 0.00 C ATOM 1214 C ASP B 947 9.012 7.809 3.243 1.00 0.00 C ATOM 1215 O ASP B 947 8.799 6.615 3.457 1.00 0.00 O ATOM 1216 CB ASP B 947 11.032 8.540 1.960 1.00 0.00 C ATOM 1217 CG ASP B 947 11.824 7.274 2.225 1.00 0.00 C ATOM 1218 OD1 ASP B 947 12.117 6.544 1.254 1.00 0.00 O ATOM 1219 OD2 ASP B 947 12.151 7.014 3.401 1.00 0.00 O ATOM 0 H ASP B 947 9.427 10.296 1.321 1.00 0.00 H new ATOM 0 HA ASP B 947 9.333 7.496 1.154 1.00 0.00 H new ATOM 0 HB2 ASP B 947 11.368 8.986 1.024 1.00 0.00 H new ATOM 0 HB3 ASP B 947 11.235 9.264 2.749 1.00 0.00 H new ATOM 1224 N GLU B 948 8.815 8.754 4.156 1.00 0.00 N ATOM 1225 CA GLU B 948 8.326 8.436 5.492 1.00 0.00 C ATOM 1226 C GLU B 948 6.913 7.864 5.434 1.00 0.00 C ATOM 1227 O GLU B 948 6.571 6.950 6.186 1.00 0.00 O ATOM 1228 CB GLU B 948 8.348 9.685 6.376 1.00 0.00 C ATOM 1229 CG GLU B 948 7.978 9.411 7.825 1.00 0.00 C ATOM 1230 CD GLU B 948 9.032 8.600 8.552 1.00 0.00 C ATOM 1231 OE1 GLU B 948 10.208 8.640 8.130 1.00 0.00 O ATOM 1232 OE2 GLU B 948 8.682 7.924 9.543 1.00 0.00 O ATOM 0 H GLU B 948 8.987 9.746 3.995 1.00 0.00 H new ATOM 0 HA GLU B 948 8.985 7.682 5.923 1.00 0.00 H new ATOM 0 HB2 GLU B 948 9.344 10.127 6.341 1.00 0.00 H new ATOM 0 HB3 GLU B 948 7.657 10.422 5.966 1.00 0.00 H new ATOM 0 HG2 GLU B 948 7.832 10.358 8.344 1.00 0.00 H new ATOM 0 HG3 GLU B 948 7.028 8.879 7.859 1.00 0.00 H new ATOM 1239 N MET B 949 6.098 8.408 4.538 1.00 0.00 N ATOM 1240 CA MET B 949 4.721 7.952 4.381 1.00 0.00 C ATOM 1241 C MET B 949 4.678 6.477 3.990 1.00 0.00 C ATOM 1242 O MET B 949 3.856 5.714 4.496 1.00 0.00 O ATOM 1243 CB MET B 949 4.000 8.793 3.326 1.00 0.00 C ATOM 1244 CG MET B 949 2.497 8.569 3.291 1.00 0.00 C ATOM 1245 SD MET B 949 1.698 9.443 1.930 1.00 0.00 S ATOM 1246 CE MET B 949 -0.022 9.327 2.415 1.00 0.00 C ATOM 0 H MET B 949 6.366 9.165 3.909 1.00 0.00 H new ATOM 0 HA MET B 949 4.214 8.071 5.338 1.00 0.00 H new ATOM 0 HB2 MET B 949 4.197 9.848 3.518 1.00 0.00 H new ATOM 0 HB3 MET B 949 4.416 8.564 2.345 1.00 0.00 H new ATOM 0 HG2 MET B 949 2.294 7.502 3.202 1.00 0.00 H new ATOM 0 HG3 MET B 949 2.062 8.898 4.235 1.00 0.00 H new ATOM 0 HE1 MET B 949 -0.504 8.523 1.858 1.00 0.00 H new ATOM 0 HE2 MET B 949 -0.086 9.117 3.483 1.00 0.00 H new ATOM 0 HE3 MET B 949 -0.525 10.270 2.200 1.00 0.00 H new ATOM 1256 N ALA B 950 5.568 6.085 3.085 1.00 0.00 N ATOM 1257 CA ALA B 950 5.633 4.704 2.623 1.00 0.00 C ATOM 1258 C ALA B 950 6.502 3.854 3.545 1.00 0.00 C ATOM 1259 O ALA B 950 6.285 2.650 3.681 1.00 0.00 O ATOM 1260 CB ALA B 950 6.162 4.649 1.198 1.00 0.00 C ATOM 0 H ALA B 950 6.255 6.705 2.656 1.00 0.00 H new ATOM 0 HA ALA B 950 4.623 4.294 2.641 1.00 0.00 H new ATOM 0 HB1 ALA B 950 6.205 3.612 0.866 1.00 0.00 H new ATOM 0 HB2 ALA B 950 5.499 5.213 0.542 1.00 0.00 H new ATOM 0 HB3 ALA B 950 7.161 5.083 1.164 1.00 0.00 H new ATOM 1266 N LYS B 951 7.488 4.487 4.174 1.00 0.00 N ATOM 1267 CA LYS B 951 8.391 3.785 5.080 1.00 0.00 C ATOM 1268 C LYS B 951 7.619 3.115 6.212 1.00 0.00 C ATOM 1269 O LYS B 951 7.835 1.941 6.513 1.00 0.00 O ATOM 1270 CB LYS B 951 9.422 4.758 5.657 1.00 0.00 C ATOM 1271 CG LYS B 951 10.475 4.083 6.522 1.00 0.00 C ATOM 1272 CD LYS B 951 11.442 5.097 7.113 1.00 0.00 C ATOM 1273 CE LYS B 951 12.579 4.413 7.854 1.00 0.00 C ATOM 1274 NZ LYS B 951 13.762 5.306 8.001 1.00 0.00 N ATOM 0 H LYS B 951 7.682 5.483 4.073 1.00 0.00 H new ATOM 0 HA LYS B 951 8.906 3.011 4.511 1.00 0.00 H new ATOM 0 HB2 LYS B 951 9.916 5.280 4.837 1.00 0.00 H new ATOM 0 HB3 LYS B 951 8.906 5.513 6.250 1.00 0.00 H new ATOM 0 HG2 LYS B 951 9.988 3.531 7.326 1.00 0.00 H new ATOM 0 HG3 LYS B 951 11.027 3.357 5.925 1.00 0.00 H new ATOM 0 HD2 LYS B 951 11.848 5.721 6.317 1.00 0.00 H new ATOM 0 HD3 LYS B 951 10.907 5.758 7.795 1.00 0.00 H new ATOM 0 HE2 LYS B 951 12.234 4.102 8.840 1.00 0.00 H new ATOM 0 HE3 LYS B 951 12.870 3.510 7.318 1.00 0.00 H new ATOM 0 HZ1 LYS B 951 14.516 4.803 8.511 1.00 0.00 H new ATOM 0 HZ2 LYS B 951 14.107 5.583 7.060 1.00 0.00 H new ATOM 0 HZ3 LYS B 951 13.491 6.157 8.535 1.00 0.00 H new ATOM 1288 N ALA B 952 6.718 3.867 6.835 1.00 0.00 N ATOM 1289 CA ALA B 952 5.914 3.343 7.932 1.00 0.00 C ATOM 1290 C ALA B 952 4.939 2.280 7.439 1.00 0.00 C ATOM 1291 O ALA B 952 4.729 1.262 8.098 1.00 0.00 O ATOM 1292 CB ALA B 952 5.163 4.472 8.622 1.00 0.00 C ATOM 0 H ALA B 952 6.527 4.841 6.599 1.00 0.00 H new ATOM 0 HA ALA B 952 6.586 2.876 8.652 1.00 0.00 H new ATOM 0 HB1 ALA B 952 4.567 4.066 9.439 1.00 0.00 H new ATOM 0 HB2 ALA B 952 5.876 5.195 9.018 1.00 0.00 H new ATOM 0 HB3 ALA B 952 4.507 4.965 7.904 1.00 0.00 H new ATOM 1298 N LEU B 953 4.347 2.524 6.274 1.00 0.00 N ATOM 1299 CA LEU B 953 3.394 1.588 5.690 1.00 0.00 C ATOM 1300 C LEU B 953 4.053 0.241 5.408 1.00 0.00 C ATOM 1301 O LEU B 953 3.589 -0.799 5.875 1.00 0.00 O ATOM 1302 CB LEU B 953 2.814 2.164 4.396 1.00 0.00 C ATOM 1303 CG LEU B 953 1.849 1.241 3.648 1.00 0.00 C ATOM 1304 CD1 LEU B 953 0.898 2.054 2.784 1.00 0.00 C ATOM 1305 CD2 LEU B 953 2.619 0.239 2.800 1.00 0.00 C ATOM 0 H LEU B 953 4.511 3.362 5.716 1.00 0.00 H new ATOM 0 HA LEU B 953 2.588 1.433 6.408 1.00 0.00 H new ATOM 0 HB2 LEU B 953 2.294 3.093 4.631 1.00 0.00 H new ATOM 0 HB3 LEU B 953 3.638 2.419 3.729 1.00 0.00 H new ATOM 0 HG LEU B 953 1.261 0.689 4.381 1.00 0.00 H new ATOM 0 HD11 LEU B 953 0.219 1.382 2.259 1.00 0.00 H new ATOM 0 HD12 LEU B 953 0.323 2.732 3.415 1.00 0.00 H new ATOM 0 HD13 LEU B 953 1.470 2.632 2.058 1.00 0.00 H new ATOM 0 HD21 LEU B 953 1.917 -0.409 2.275 1.00 0.00 H new ATOM 0 HD22 LEU B 953 3.233 0.772 2.074 1.00 0.00 H new ATOM 0 HD23 LEU B 953 3.260 -0.365 3.442 1.00 0.00 H new ATOM 1317 N GLU B 954 5.136 0.270 4.638 1.00 0.00 N ATOM 1318 CA GLU B 954 5.859 -0.948 4.289 1.00 0.00 C ATOM 1319 C GLU B 954 6.448 -1.611 5.529 1.00 0.00 C ATOM 1320 O GLU B 954 6.521 -2.837 5.612 1.00 0.00 O ATOM 1321 CB GLU B 954 6.972 -0.633 3.288 1.00 0.00 C ATOM 1322 CG GLU B 954 7.692 -1.869 2.770 1.00 0.00 C ATOM 1323 CD GLU B 954 8.872 -1.526 1.882 1.00 0.00 C ATOM 1324 OE1 GLU B 954 8.648 -0.975 0.784 1.00 0.00 O ATOM 1325 OE2 GLU B 954 10.020 -1.809 2.285 1.00 0.00 O ATOM 0 H GLU B 954 5.532 1.123 4.244 1.00 0.00 H new ATOM 0 HA GLU B 954 5.152 -1.641 3.833 1.00 0.00 H new ATOM 0 HB2 GLU B 954 6.547 -0.090 2.444 1.00 0.00 H new ATOM 0 HB3 GLU B 954 7.698 0.029 3.761 1.00 0.00 H new ATOM 0 HG2 GLU B 954 8.039 -2.464 3.615 1.00 0.00 H new ATOM 0 HG3 GLU B 954 6.989 -2.487 2.212 1.00 0.00 H new ATOM 1332 N ALA B 955 6.872 -0.795 6.488 1.00 0.00 N ATOM 1333 CA ALA B 955 7.460 -1.305 7.722 1.00 0.00 C ATOM 1334 C ALA B 955 6.479 -2.195 8.479 1.00 0.00 C ATOM 1335 O ALA B 955 6.870 -3.199 9.073 1.00 0.00 O ATOM 1336 CB ALA B 955 7.914 -0.151 8.602 1.00 0.00 C ATOM 0 H ALA B 955 6.820 0.222 6.435 1.00 0.00 H new ATOM 0 HA ALA B 955 8.325 -1.913 7.457 1.00 0.00 H new ATOM 0 HB1 ALA B 955 8.351 -0.544 9.520 1.00 0.00 H new ATOM 0 HB2 ALA B 955 8.659 0.441 8.070 1.00 0.00 H new ATOM 0 HB3 ALA B 955 7.058 0.478 8.848 1.00 0.00 H new ATOM 1342 N GLU B 956 5.205 -1.818 8.459 1.00 0.00 N ATOM 1343 CA GLU B 956 4.172 -2.584 9.149 1.00 0.00 C ATOM 1344 C GLU B 956 3.996 -3.963 8.521 1.00 0.00 C ATOM 1345 O GLU B 956 3.951 -4.973 9.223 1.00 0.00 O ATOM 1346 CB GLU B 956 2.842 -1.826 9.119 1.00 0.00 C ATOM 1347 CG GLU B 956 1.750 -2.482 9.946 1.00 0.00 C ATOM 1348 CD GLU B 956 2.038 -2.437 11.434 1.00 0.00 C ATOM 1349 OE1 GLU B 956 2.776 -1.528 11.868 1.00 0.00 O ATOM 1350 OE2 GLU B 956 1.523 -3.309 12.166 1.00 0.00 O ATOM 0 H GLU B 956 4.863 -0.989 7.974 1.00 0.00 H new ATOM 0 HA GLU B 956 4.488 -2.717 10.184 1.00 0.00 H new ATOM 0 HB2 GLU B 956 3.003 -0.812 9.484 1.00 0.00 H new ATOM 0 HB3 GLU B 956 2.504 -1.743 8.086 1.00 0.00 H new ATOM 0 HG2 GLU B 956 0.801 -1.984 9.748 1.00 0.00 H new ATOM 0 HG3 GLU B 956 1.636 -3.520 9.633 1.00 0.00 H new ATOM 1357 N LEU B 957 3.895 -3.999 7.197 1.00 0.00 N ATOM 1358 CA LEU B 957 3.721 -5.255 6.476 1.00 0.00 C ATOM 1359 C LEU B 957 5.064 -5.941 6.214 1.00 0.00 C ATOM 1360 O LEU B 957 5.106 -7.089 5.774 1.00 0.00 O ATOM 1361 CB LEU B 957 2.990 -5.012 5.153 1.00 0.00 C ATOM 1362 CG LEU B 957 2.146 -6.188 4.650 1.00 0.00 C ATOM 1363 CD1 LEU B 957 1.148 -6.623 5.713 1.00 0.00 C ATOM 1364 CD2 LEU B 957 1.424 -5.815 3.363 1.00 0.00 C ATOM 0 H LEU B 957 3.931 -3.172 6.601 1.00 0.00 H new ATOM 0 HA LEU B 957 3.121 -5.916 7.101 1.00 0.00 H new ATOM 0 HB2 LEU B 957 2.342 -4.143 5.268 1.00 0.00 H new ATOM 0 HB3 LEU B 957 3.727 -4.761 4.390 1.00 0.00 H new ATOM 0 HG LEU B 957 2.813 -7.024 4.441 1.00 0.00 H new ATOM 0 HD11 LEU B 957 0.558 -7.459 5.338 1.00 0.00 H new ATOM 0 HD12 LEU B 957 1.684 -6.931 6.611 1.00 0.00 H new ATOM 0 HD13 LEU B 957 0.486 -5.791 5.953 1.00 0.00 H new ATOM 0 HD21 LEU B 957 0.830 -6.662 3.021 1.00 0.00 H new ATOM 0 HD22 LEU B 957 0.769 -4.963 3.547 1.00 0.00 H new ATOM 0 HD23 LEU B 957 2.155 -5.552 2.599 1.00 0.00 H new ATOM 1376 N ASN B 958 6.161 -5.232 6.482 1.00 0.00 N ATOM 1377 CA ASN B 958 7.497 -5.781 6.268 1.00 0.00 C ATOM 1378 C ASN B 958 7.666 -7.117 6.987 1.00 0.00 C ATOM 1379 O ASN B 958 8.139 -8.091 6.403 1.00 0.00 O ATOM 1380 CB ASN B 958 8.561 -4.794 6.753 1.00 0.00 C ATOM 1381 CG ASN B 958 9.966 -5.228 6.382 1.00 0.00 C ATOM 1382 OD1 ASN B 958 10.303 -5.337 5.203 1.00 0.00 O ATOM 1383 ND2 ASN B 958 10.792 -5.480 7.390 1.00 0.00 N ATOM 0 H ASN B 958 6.149 -4.279 6.846 1.00 0.00 H new ATOM 0 HA ASN B 958 7.622 -5.948 5.198 1.00 0.00 H new ATOM 0 HB2 ASN B 958 8.363 -3.811 6.325 1.00 0.00 H new ATOM 0 HB3 ASN B 958 8.490 -4.691 7.836 1.00 0.00 H new ATOM 0 HD21 ASN B 958 11.750 -5.777 7.203 1.00 0.00 H new ATOM 0 HD22 ASN B 958 10.469 -5.376 8.352 1.00 0.00 H new ATOM 1390 N ASP B 959 7.271 -7.157 8.255 1.00 0.00 N ATOM 1391 CA ASP B 959 7.375 -8.377 9.047 1.00 0.00 C ATOM 1392 C ASP B 959 6.411 -9.436 8.526 1.00 0.00 C ATOM 1393 O ASP B 959 6.692 -10.633 8.588 1.00 0.00 O ATOM 1394 CB ASP B 959 7.083 -8.083 10.520 1.00 0.00 C ATOM 1395 CG ASP B 959 8.117 -7.167 11.144 1.00 0.00 C ATOM 1396 OD1 ASP B 959 9.212 -7.023 10.561 1.00 0.00 O ATOM 1397 OD2 ASP B 959 7.832 -6.592 12.216 1.00 0.00 O ATOM 0 H ASP B 959 6.877 -6.360 8.755 1.00 0.00 H new ATOM 0 HA ASP B 959 8.393 -8.757 8.959 1.00 0.00 H new ATOM 0 HB2 ASP B 959 6.097 -7.626 10.608 1.00 0.00 H new ATOM 0 HB3 ASP B 959 7.050 -9.021 11.075 1.00 0.00 H new ATOM 1402 N LEU B 960 5.275 -8.983 8.010 1.00 0.00 N ATOM 1403 CA LEU B 960 4.262 -9.881 7.470 1.00 0.00 C ATOM 1404 C LEU B 960 4.801 -10.639 6.259 1.00 0.00 C ATOM 1405 O LEU B 960 4.460 -11.802 6.039 1.00 0.00 O ATOM 1406 CB LEU B 960 3.011 -9.082 7.088 1.00 0.00 C ATOM 1407 CG LEU B 960 2.030 -9.792 6.149 1.00 0.00 C ATOM 1408 CD1 LEU B 960 0.594 -9.452 6.523 1.00 0.00 C ATOM 1409 CD2 LEU B 960 2.313 -9.410 4.703 1.00 0.00 C ATOM 0 H LEU B 960 5.032 -7.994 7.954 1.00 0.00 H new ATOM 0 HA LEU B 960 3.998 -10.611 8.235 1.00 0.00 H new ATOM 0 HB2 LEU B 960 2.481 -8.813 8.002 1.00 0.00 H new ATOM 0 HB3 LEU B 960 3.327 -8.151 6.617 1.00 0.00 H new ATOM 0 HG LEU B 960 2.165 -10.869 6.254 1.00 0.00 H new ATOM 0 HD11 LEU B 960 -0.089 -9.965 5.846 1.00 0.00 H new ATOM 0 HD12 LEU B 960 0.399 -9.772 7.547 1.00 0.00 H new ATOM 0 HD13 LEU B 960 0.443 -8.375 6.445 1.00 0.00 H new ATOM 0 HD21 LEU B 960 1.609 -9.922 4.047 1.00 0.00 H new ATOM 0 HD22 LEU B 960 2.203 -8.332 4.583 1.00 0.00 H new ATOM 0 HD23 LEU B 960 3.330 -9.702 4.442 1.00 0.00 H new ATOM 1421 N MET B 961 5.643 -9.972 5.477 1.00 0.00 N ATOM 1422 CA MET B 961 6.229 -10.582 4.289 1.00 0.00 C ATOM 1423 C MET B 961 7.472 -11.390 4.649 1.00 0.00 C ATOM 1424 O MET B 961 7.724 -12.415 3.979 1.00 0.00 O ATOM 1425 CB MET B 961 6.585 -9.506 3.261 1.00 0.00 C ATOM 1426 CG MET B 961 7.658 -8.540 3.738 1.00 0.00 C ATOM 1427 SD MET B 961 8.472 -7.680 2.378 1.00 0.00 S ATOM 1428 CE MET B 961 7.882 -6.008 2.634 1.00 0.00 C ATOM 1429 OXT MET B 961 8.182 -10.993 5.596 1.00 0.00 O ATOM 0 H MET B 961 5.935 -9.009 5.644 1.00 0.00 H new ATOM 0 HA MET B 961 5.492 -11.258 3.856 1.00 0.00 H new ATOM 0 HB2 MET B 961 6.924 -9.989 2.345 1.00 0.00 H new ATOM 0 HB3 MET B 961 5.686 -8.943 3.011 1.00 0.00 H new ATOM 0 HG2 MET B 961 7.210 -7.808 4.409 1.00 0.00 H new ATOM 0 HG3 MET B 961 8.404 -9.087 4.315 1.00 0.00 H new ATOM 0 HE1 MET B 961 7.790 -5.503 1.672 1.00 0.00 H new ATOM 0 HE2 MET B 961 6.909 -6.037 3.124 1.00 0.00 H new ATOM 0 HE3 MET B 961 8.588 -5.465 3.262 1.00 0.00 H new TER 1439 MET B 961