USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 837 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 448 SER OG : rot 180:sc= 0 USER MOD Single : A 449 SER OG : rot 6:sc= 1.15 USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 452 SER OG : rot 22:sc= 0.813 USER MOD Single : A 454 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 457 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00636) USER MOD Single : A 459 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 460 THR OG1 : rot 43:sc= 0.143 USER MOD Single : A 461 THR OG1 : rot 180:sc= 0 USER MOD Single : A 462 SER OG : rot 52:sc= 1.17 USER MOD Single : A 463 LYS NZ :NH3+ 150:sc= -1.17 (180deg=-2.02) USER MOD Single : A 468 ASN : amide:sc= 0.69 K(o=0.69,f=-0.16) USER MOD Single : A 472 GLN : amide:sc=-0.00633 X(o=-0.0063,f=-0.0062) USER MOD Single : A 474 ASN : amide:sc= -0.384 K(o=-0.38,f=-2.8!) USER MOD Single : A 475 GLN : amide:sc= 0.0997 X(o=0.1,f=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 THR OG1 : rot 67:sc= 1.11 USER MOD Single : A 489 LYS NZ :NH3+ -165:sc= -0.0913 (180deg=-0.398) USER MOD Single : A 490 THR OG1 : rot 180:sc= 0 USER MOD Single : A 495 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 496 LYS NZ :NH3+ 148:sc= 0.0149 (180deg=-0.169) USER MOD Single : A 497 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 46:sc= 0.461 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 503 HIS : no HD1:sc= -0.837 K(o=-0.84,f=-1.8!) USER MOD Single : A 513 THR OG1 : rot 165:sc= -0.316 USER MOD Single : A 514 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 515 GLN : amide:sc= -0.422 X(o=-0.42,f=-0.37) USER MOD Single : A 518 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 522 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 525 CYS SG : rot 180:sc= 0 USER MOD Single : A 526 HIS : no HD1:sc= -1.34 K(o=-1.3,f=-0.64) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 THR OG1 : rot -32:sc= 0.353 USER MOD Single : A 529 HIS : no HD1:sc= -1.4 K(o=-1.4,f=-2.7!) USER MOD Single : A 531 TYR OH : rot 30:sc= 0 USER MOD Single : A 542 SER OG : rot 180:sc= 0 USER MOD Single : A 545 THR OG1 : rot 180:sc= 0 USER MOD Single : A 547 GLN : amide:sc=-0.00489 K(o=-0.0049,f=-1.3) USER MOD Single : A 548 SER OG : rot 180:sc= 0 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 447 -28.319 8.455 -22.582 1.00 0.00 N ATOM 2 CA GLY A 447 -27.328 8.630 -21.537 1.00 0.00 C ATOM 3 C GLY A 447 -27.105 7.366 -20.731 1.00 0.00 C ATOM 4 O GLY A 447 -27.852 7.078 -19.796 1.00 0.00 O ATOM 0 HA2 GLY A 447 -26.385 8.943 -21.984 1.00 0.00 H new ATOM 0 HA3 GLY A 447 -27.646 9.431 -20.870 1.00 0.00 H new ATOM 8 N SER A 448 -26.075 6.608 -21.095 1.00 0.00 N ATOM 9 CA SER A 448 -25.759 5.364 -20.402 1.00 0.00 C ATOM 10 C SER A 448 -24.448 4.775 -20.914 1.00 0.00 C ATOM 11 O SER A 448 -24.347 4.372 -22.073 1.00 0.00 O ATOM 12 CB SER A 448 -26.892 4.352 -20.585 1.00 0.00 C ATOM 13 OG SER A 448 -26.736 3.248 -19.710 1.00 0.00 O ATOM 0 H SER A 448 -25.446 6.833 -21.865 1.00 0.00 H new ATOM 0 HA SER A 448 -25.647 5.586 -19.341 1.00 0.00 H new ATOM 0 HB2 SER A 448 -27.850 4.836 -20.397 1.00 0.00 H new ATOM 0 HB3 SER A 448 -26.908 4.002 -21.617 1.00 0.00 H new ATOM 0 HG SER A 448 -27.473 2.617 -19.845 1.00 0.00 H new ATOM 19 N SER A 449 -23.447 4.729 -20.041 1.00 0.00 N ATOM 20 CA SER A 449 -22.140 4.193 -20.405 1.00 0.00 C ATOM 21 C SER A 449 -21.330 3.846 -19.159 1.00 0.00 C ATOM 22 O SER A 449 -21.627 4.315 -18.061 1.00 0.00 O ATOM 23 CB SER A 449 -21.373 5.201 -21.262 1.00 0.00 C ATOM 24 OG SER A 449 -21.877 5.232 -22.586 1.00 0.00 O ATOM 0 H SER A 449 -23.516 5.056 -19.077 1.00 0.00 H new ATOM 0 HA SER A 449 -22.296 3.281 -20.982 1.00 0.00 H new ATOM 0 HB2 SER A 449 -21.449 6.193 -20.817 1.00 0.00 H new ATOM 0 HB3 SER A 449 -20.315 4.939 -21.278 1.00 0.00 H new ATOM 0 HG SER A 449 -22.675 4.666 -22.646 1.00 0.00 H new ATOM 30 N GLY A 450 -20.304 3.020 -19.340 1.00 0.00 N ATOM 31 CA GLY A 450 -19.465 2.624 -18.223 1.00 0.00 C ATOM 32 C GLY A 450 -18.590 1.430 -18.550 1.00 0.00 C ATOM 33 O GLY A 450 -19.064 0.295 -18.583 1.00 0.00 O ATOM 0 H GLY A 450 -20.039 2.618 -20.239 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -18.834 3.464 -17.931 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -20.095 2.385 -17.366 1.00 0.00 H new ATOM 37 N SER A 451 -17.309 1.687 -18.795 1.00 0.00 N ATOM 38 CA SER A 451 -16.367 0.625 -19.127 1.00 0.00 C ATOM 39 C SER A 451 -15.009 0.882 -18.480 1.00 0.00 C ATOM 40 O SER A 451 -14.740 1.978 -17.989 1.00 0.00 O ATOM 41 CB SER A 451 -16.207 0.512 -20.644 1.00 0.00 C ATOM 42 OG SER A 451 -17.465 0.352 -21.279 1.00 0.00 O ATOM 0 H SER A 451 -16.900 2.621 -18.770 1.00 0.00 H new ATOM 0 HA SER A 451 -16.764 -0.313 -18.739 1.00 0.00 H new ATOM 0 HB2 SER A 451 -15.713 1.404 -21.028 1.00 0.00 H new ATOM 0 HB3 SER A 451 -15.565 -0.336 -20.883 1.00 0.00 H new ATOM 0 HG SER A 451 -17.336 0.284 -22.248 1.00 0.00 H new ATOM 48 N SER A 452 -14.157 -0.139 -18.482 1.00 0.00 N ATOM 49 CA SER A 452 -12.829 -0.027 -17.891 1.00 0.00 C ATOM 50 C SER A 452 -11.888 -1.081 -18.466 1.00 0.00 C ATOM 51 O SER A 452 -12.301 -2.201 -18.766 1.00 0.00 O ATOM 52 CB SER A 452 -12.909 -0.173 -16.371 1.00 0.00 C ATOM 53 OG SER A 452 -13.310 1.042 -15.762 1.00 0.00 O ATOM 0 H SER A 452 -14.363 -1.052 -18.886 1.00 0.00 H new ATOM 0 HA SER A 452 -12.433 0.959 -18.133 1.00 0.00 H new ATOM 0 HB2 SER A 452 -13.616 -0.962 -16.115 1.00 0.00 H new ATOM 0 HB3 SER A 452 -11.938 -0.476 -15.980 1.00 0.00 H new ATOM 0 HG SER A 452 -13.782 1.597 -16.418 1.00 0.00 H new ATOM 59 N GLY A 453 -10.619 -0.714 -18.618 1.00 0.00 N ATOM 60 CA GLY A 453 -9.639 -1.639 -19.156 1.00 0.00 C ATOM 61 C GLY A 453 -8.318 -1.580 -18.415 1.00 0.00 C ATOM 62 O GLY A 453 -8.142 -0.762 -17.512 1.00 0.00 O ATOM 0 H GLY A 453 -10.252 0.207 -18.378 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -10.035 -2.653 -19.106 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -9.472 -1.414 -20.209 1.00 0.00 H new ATOM 66 N GLN A 454 -7.388 -2.449 -18.796 1.00 0.00 N ATOM 67 CA GLN A 454 -6.077 -2.494 -18.159 1.00 0.00 C ATOM 68 C GLN A 454 -5.007 -1.907 -19.073 1.00 0.00 C ATOM 69 O GLN A 454 -4.887 -2.297 -20.235 1.00 0.00 O ATOM 70 CB GLN A 454 -5.715 -3.933 -17.788 1.00 0.00 C ATOM 71 CG GLN A 454 -4.310 -4.082 -17.228 1.00 0.00 C ATOM 72 CD GLN A 454 -4.179 -5.263 -16.286 1.00 0.00 C ATOM 73 OE1 GLN A 454 -4.449 -6.404 -16.662 1.00 0.00 O ATOM 74 NE2 GLN A 454 -3.764 -4.995 -15.054 1.00 0.00 N ATOM 0 H GLN A 454 -7.518 -3.132 -19.543 1.00 0.00 H new ATOM 0 HA GLN A 454 -6.122 -1.893 -17.251 1.00 0.00 H new ATOM 0 HB2 GLN A 454 -6.431 -4.301 -17.053 1.00 0.00 H new ATOM 0 HB3 GLN A 454 -5.813 -4.563 -18.672 1.00 0.00 H new ATOM 0 HG2 GLN A 454 -3.605 -4.199 -18.051 1.00 0.00 H new ATOM 0 HG3 GLN A 454 -4.035 -3.169 -16.700 1.00 0.00 H new ATOM 0 HE21 GLN A 454 -3.551 -4.034 -14.785 1.00 0.00 H new ATOM 0 HE22 GLN A 454 -3.658 -5.750 -14.376 1.00 0.00 H new ATOM 83 N VAL A 455 -4.231 -0.968 -18.542 1.00 0.00 N ATOM 84 CA VAL A 455 -3.170 -0.328 -19.310 1.00 0.00 C ATOM 85 C VAL A 455 -1.836 -1.035 -19.099 1.00 0.00 C ATOM 86 O VAL A 455 -1.542 -1.550 -18.021 1.00 0.00 O ATOM 87 CB VAL A 455 -3.018 1.157 -18.928 1.00 0.00 C ATOM 88 CG1 VAL A 455 -4.281 1.930 -19.275 1.00 0.00 C ATOM 89 CG2 VAL A 455 -2.688 1.295 -17.449 1.00 0.00 C ATOM 0 H VAL A 455 -4.317 -0.633 -17.582 1.00 0.00 H new ATOM 0 HA VAL A 455 -3.453 -0.398 -20.360 1.00 0.00 H new ATOM 0 HB VAL A 455 -2.193 1.579 -19.502 1.00 0.00 H new ATOM 0 HG11 VAL A 455 -4.155 2.977 -18.998 1.00 0.00 H new ATOM 0 HG12 VAL A 455 -4.469 1.858 -20.346 1.00 0.00 H new ATOM 0 HG13 VAL A 455 -5.126 1.510 -18.730 1.00 0.00 H new ATOM 0 HG21 VAL A 455 -2.584 2.350 -17.196 1.00 0.00 H new ATOM 0 HG22 VAL A 455 -3.490 0.857 -16.855 1.00 0.00 H new ATOM 0 HG23 VAL A 455 -1.753 0.777 -17.235 1.00 0.00 H new ATOM 99 N PRO A 456 -1.007 -1.061 -20.154 1.00 0.00 N ATOM 100 CA PRO A 456 0.311 -1.701 -20.109 1.00 0.00 C ATOM 101 C PRO A 456 1.296 -0.939 -19.229 1.00 0.00 C ATOM 102 O PRO A 456 1.652 0.203 -19.522 1.00 0.00 O ATOM 103 CB PRO A 456 0.768 -1.675 -21.570 1.00 0.00 C ATOM 104 CG PRO A 456 0.034 -0.528 -22.176 1.00 0.00 C ATOM 105 CD PRO A 456 -1.293 -0.466 -21.470 1.00 0.00 C ATOM 0 HA PRO A 456 0.263 -2.702 -19.681 1.00 0.00 H new ATOM 0 HB2 PRO A 456 1.847 -1.539 -21.645 1.00 0.00 H new ATOM 0 HB3 PRO A 456 0.529 -2.610 -22.076 1.00 0.00 H new ATOM 0 HG2 PRO A 456 0.588 0.402 -22.047 1.00 0.00 H new ATOM 0 HG3 PRO A 456 -0.101 -0.673 -23.248 1.00 0.00 H new ATOM 0 HD2 PRO A 456 -1.652 0.559 -21.378 1.00 0.00 H new ATOM 0 HD3 PRO A 456 -2.060 -1.025 -22.006 1.00 0.00 H new ATOM 113 N LYS A 457 1.734 -1.577 -18.149 1.00 0.00 N ATOM 114 CA LYS A 457 2.680 -0.961 -17.226 1.00 0.00 C ATOM 115 C LYS A 457 4.108 -1.086 -17.747 1.00 0.00 C ATOM 116 O LYS A 457 4.662 -2.183 -17.813 1.00 0.00 O ATOM 117 CB LYS A 457 2.571 -1.609 -15.844 1.00 0.00 C ATOM 118 CG LYS A 457 1.301 -1.240 -15.098 1.00 0.00 C ATOM 119 CD LYS A 457 1.041 -2.187 -13.938 1.00 0.00 C ATOM 120 CE LYS A 457 1.933 -1.869 -12.748 1.00 0.00 C ATOM 121 NZ LYS A 457 1.680 -2.788 -11.604 1.00 0.00 N ATOM 0 H LYS A 457 1.449 -2.522 -17.891 1.00 0.00 H new ATOM 0 HA LYS A 457 2.433 0.098 -17.144 1.00 0.00 H new ATOM 0 HB2 LYS A 457 2.615 -2.692 -15.955 1.00 0.00 H new ATOM 0 HB3 LYS A 457 3.433 -1.315 -15.245 1.00 0.00 H new ATOM 0 HG2 LYS A 457 1.381 -0.219 -14.725 1.00 0.00 H new ATOM 0 HG3 LYS A 457 0.455 -1.263 -15.785 1.00 0.00 H new ATOM 0 HD2 LYS A 457 -0.005 -2.119 -13.639 1.00 0.00 H new ATOM 0 HD3 LYS A 457 1.214 -3.214 -14.260 1.00 0.00 H new ATOM 0 HE2 LYS A 457 2.978 -1.942 -13.048 1.00 0.00 H new ATOM 0 HE3 LYS A 457 1.763 -0.840 -12.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 457 2.307 -2.539 -10.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 457 0.689 -2.700 -11.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 457 1.867 -3.768 -11.898 1.00 0.00 H new ATOM 135 N LYS A 458 4.700 0.045 -18.116 1.00 0.00 N ATOM 136 CA LYS A 458 6.064 0.064 -18.628 1.00 0.00 C ATOM 137 C LYS A 458 7.068 -0.217 -17.514 1.00 0.00 C ATOM 138 O LYS A 458 7.976 -1.031 -17.676 1.00 0.00 O ATOM 139 CB LYS A 458 6.370 1.417 -19.275 1.00 0.00 C ATOM 140 CG LYS A 458 5.878 1.530 -20.708 1.00 0.00 C ATOM 141 CD LYS A 458 6.247 2.872 -21.319 1.00 0.00 C ATOM 142 CE LYS A 458 5.322 3.232 -22.472 1.00 0.00 C ATOM 143 NZ LYS A 458 5.450 2.276 -23.606 1.00 0.00 N ATOM 0 H LYS A 458 4.255 0.962 -18.070 1.00 0.00 H new ATOM 0 HA LYS A 458 6.153 -0.720 -19.380 1.00 0.00 H new ATOM 0 HB2 LYS A 458 5.913 2.207 -18.679 1.00 0.00 H new ATOM 0 HB3 LYS A 458 7.447 1.585 -19.255 1.00 0.00 H new ATOM 0 HG2 LYS A 458 6.308 0.726 -21.306 1.00 0.00 H new ATOM 0 HG3 LYS A 458 4.796 1.403 -20.733 1.00 0.00 H new ATOM 0 HD2 LYS A 458 6.196 3.647 -20.555 1.00 0.00 H new ATOM 0 HD3 LYS A 458 7.277 2.841 -21.674 1.00 0.00 H new ATOM 0 HE2 LYS A 458 4.290 3.242 -22.120 1.00 0.00 H new ATOM 0 HE3 LYS A 458 5.550 4.240 -22.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 458 4.841 2.585 -24.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 458 6.439 2.247 -23.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 458 5.159 1.327 -23.295 1.00 0.00 H new ATOM 157 N GLN A 459 6.896 0.462 -16.385 1.00 0.00 N ATOM 158 CA GLN A 459 7.787 0.284 -15.244 1.00 0.00 C ATOM 159 C GLN A 459 7.027 -0.261 -14.040 1.00 0.00 C ATOM 160 O GLN A 459 5.810 -0.102 -13.935 1.00 0.00 O ATOM 161 CB GLN A 459 8.456 1.611 -14.881 1.00 0.00 C ATOM 162 CG GLN A 459 7.470 2.719 -14.549 1.00 0.00 C ATOM 163 CD GLN A 459 8.142 4.068 -14.386 1.00 0.00 C ATOM 164 OE1 GLN A 459 8.611 4.414 -13.300 1.00 0.00 O ATOM 165 NE2 GLN A 459 8.192 4.840 -15.465 1.00 0.00 N ATOM 0 H GLN A 459 6.149 1.140 -16.235 1.00 0.00 H new ATOM 0 HA GLN A 459 8.555 -0.438 -15.524 1.00 0.00 H new ATOM 0 HB2 GLN A 459 9.115 1.454 -14.027 1.00 0.00 H new ATOM 0 HB3 GLN A 459 9.083 1.932 -15.713 1.00 0.00 H new ATOM 0 HG2 GLN A 459 6.722 2.783 -15.339 1.00 0.00 H new ATOM 0 HG3 GLN A 459 6.942 2.467 -13.629 1.00 0.00 H new ATOM 0 HE21 GLN A 459 7.791 4.514 -16.344 1.00 0.00 H new ATOM 0 HE22 GLN A 459 8.631 5.759 -15.415 1.00 0.00 H new ATOM 174 N THR A 460 7.752 -0.907 -13.131 1.00 0.00 N ATOM 175 CA THR A 460 7.147 -1.478 -11.935 1.00 0.00 C ATOM 176 C THR A 460 7.028 -0.437 -10.828 1.00 0.00 C ATOM 177 O THR A 460 8.032 0.019 -10.280 1.00 0.00 O ATOM 178 CB THR A 460 7.960 -2.677 -11.412 1.00 0.00 C ATOM 179 OG1 THR A 460 9.356 -2.360 -11.413 1.00 0.00 O ATOM 180 CG2 THR A 460 7.714 -3.912 -12.265 1.00 0.00 C ATOM 0 H THR A 460 8.760 -1.047 -13.201 1.00 0.00 H new ATOM 0 HA THR A 460 6.151 -1.819 -12.217 1.00 0.00 H new ATOM 0 HB THR A 460 7.637 -2.890 -10.393 1.00 0.00 H new ATOM 0 HG1 THR A 460 9.485 -1.448 -11.077 1.00 0.00 H new ATOM 0 HG21 THR A 460 8.299 -4.745 -11.876 1.00 0.00 H new ATOM 0 HG22 THR A 460 6.655 -4.168 -12.238 1.00 0.00 H new ATOM 0 HG23 THR A 460 8.012 -3.709 -13.294 1.00 0.00 H new ATOM 188 N THR A 461 5.794 -0.064 -10.503 1.00 0.00 N ATOM 189 CA THR A 461 5.545 0.925 -9.461 1.00 0.00 C ATOM 190 C THR A 461 5.486 0.271 -8.085 1.00 0.00 C ATOM 191 O THR A 461 4.783 -0.720 -7.888 1.00 0.00 O ATOM 192 CB THR A 461 4.229 1.685 -9.712 1.00 0.00 C ATOM 193 OG1 THR A 461 4.049 2.696 -8.714 1.00 0.00 O ATOM 194 CG2 THR A 461 3.042 0.733 -9.696 1.00 0.00 C ATOM 0 H THR A 461 4.952 -0.432 -10.946 1.00 0.00 H new ATOM 0 HA THR A 461 6.375 1.631 -9.490 1.00 0.00 H new ATOM 0 HB THR A 461 4.287 2.152 -10.695 1.00 0.00 H new ATOM 0 HG1 THR A 461 3.211 3.176 -8.882 1.00 0.00 H new ATOM 0 HG21 THR A 461 2.124 1.293 -9.875 1.00 0.00 H new ATOM 0 HG22 THR A 461 3.167 -0.018 -10.476 1.00 0.00 H new ATOM 0 HG23 THR A 461 2.983 0.241 -8.725 1.00 0.00 H new ATOM 202 N SER A 462 6.229 0.832 -7.136 1.00 0.00 N ATOM 203 CA SER A 462 6.263 0.301 -5.779 1.00 0.00 C ATOM 204 C SER A 462 5.217 0.982 -4.902 1.00 0.00 C ATOM 205 O SER A 462 5.505 1.968 -4.222 1.00 0.00 O ATOM 206 CB SER A 462 7.655 0.487 -5.171 1.00 0.00 C ATOM 207 OG SER A 462 7.963 1.862 -5.014 1.00 0.00 O ATOM 0 H SER A 462 6.815 1.654 -7.282 1.00 0.00 H new ATOM 0 HA SER A 462 6.034 -0.764 -5.826 1.00 0.00 H new ATOM 0 HB2 SER A 462 7.702 -0.012 -4.203 1.00 0.00 H new ATOM 0 HB3 SER A 462 8.401 0.015 -5.810 1.00 0.00 H new ATOM 0 HG SER A 462 7.234 2.308 -4.534 1.00 0.00 H new ATOM 213 N LYS A 463 4.000 0.450 -4.922 1.00 0.00 N ATOM 214 CA LYS A 463 2.909 1.004 -4.129 1.00 0.00 C ATOM 215 C LYS A 463 1.966 -0.098 -3.657 1.00 0.00 C ATOM 216 O LYS A 463 1.280 -0.728 -4.462 1.00 0.00 O ATOM 217 CB LYS A 463 2.132 2.039 -4.946 1.00 0.00 C ATOM 218 CG LYS A 463 2.744 3.428 -4.907 1.00 0.00 C ATOM 219 CD LYS A 463 2.210 4.241 -3.740 1.00 0.00 C ATOM 220 CE LYS A 463 0.963 5.021 -4.128 1.00 0.00 C ATOM 221 NZ LYS A 463 -0.230 4.137 -4.243 1.00 0.00 N ATOM 0 H LYS A 463 3.744 -0.365 -5.479 1.00 0.00 H new ATOM 0 HA LYS A 463 3.340 1.490 -3.253 1.00 0.00 H new ATOM 0 HB2 LYS A 463 2.076 1.705 -5.982 1.00 0.00 H new ATOM 0 HB3 LYS A 463 1.109 2.091 -4.573 1.00 0.00 H new ATOM 0 HG2 LYS A 463 3.828 3.347 -4.829 1.00 0.00 H new ATOM 0 HG3 LYS A 463 2.530 3.947 -5.841 1.00 0.00 H new ATOM 0 HD2 LYS A 463 1.980 3.576 -2.907 1.00 0.00 H new ATOM 0 HD3 LYS A 463 2.979 4.931 -3.394 1.00 0.00 H new ATOM 0 HE2 LYS A 463 0.772 5.794 -3.384 1.00 0.00 H new ATOM 0 HE3 LYS A 463 1.132 5.528 -5.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -1.086 4.676 -4.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -0.306 3.782 -5.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -0.132 3.334 -3.589 1.00 0.00 H new ATOM 235 N ILE A 464 1.936 -0.323 -2.348 1.00 0.00 N ATOM 236 CA ILE A 464 1.074 -1.347 -1.769 1.00 0.00 C ATOM 237 C ILE A 464 -0.083 -0.721 -0.999 1.00 0.00 C ATOM 238 O ILE A 464 0.126 0.029 -0.044 1.00 0.00 O ATOM 239 CB ILE A 464 1.861 -2.277 -0.826 1.00 0.00 C ATOM 240 CG1 ILE A 464 2.971 -2.998 -1.593 1.00 0.00 C ATOM 241 CG2 ILE A 464 0.925 -3.281 -0.170 1.00 0.00 C ATOM 242 CD1 ILE A 464 3.850 -3.861 -0.716 1.00 0.00 C ATOM 0 H ILE A 464 2.498 0.189 -1.668 1.00 0.00 H new ATOM 0 HA ILE A 464 0.679 -1.933 -2.599 1.00 0.00 H new ATOM 0 HB ILE A 464 2.320 -1.672 -0.044 1.00 0.00 H new ATOM 0 HG12 ILE A 464 2.521 -3.620 -2.367 1.00 0.00 H new ATOM 0 HG13 ILE A 464 3.591 -2.258 -2.099 1.00 0.00 H new ATOM 0 HG21 ILE A 464 1.496 -3.931 0.493 1.00 0.00 H new ATOM 0 HG22 ILE A 464 0.167 -2.750 0.406 1.00 0.00 H new ATOM 0 HG23 ILE A 464 0.440 -3.883 -0.939 1.00 0.00 H new ATOM 0 HD11 ILE A 464 4.614 -4.341 -1.327 1.00 0.00 H new ATOM 0 HD12 ILE A 464 4.328 -3.241 0.042 1.00 0.00 H new ATOM 0 HD13 ILE A 464 3.242 -4.624 -0.230 1.00 0.00 H new ATOM 254 N LEU A 465 -1.304 -1.034 -1.418 1.00 0.00 N ATOM 255 CA LEU A 465 -2.497 -0.504 -0.767 1.00 0.00 C ATOM 256 C LEU A 465 -3.278 -1.615 -0.073 1.00 0.00 C ATOM 257 O LEU A 465 -3.817 -2.510 -0.725 1.00 0.00 O ATOM 258 CB LEU A 465 -3.389 0.201 -1.790 1.00 0.00 C ATOM 259 CG LEU A 465 -4.850 0.398 -1.382 1.00 0.00 C ATOM 260 CD1 LEU A 465 -4.966 1.474 -0.314 1.00 0.00 C ATOM 261 CD2 LEU A 465 -5.698 0.754 -2.595 1.00 0.00 C ATOM 0 H LEU A 465 -1.494 -1.653 -2.206 1.00 0.00 H new ATOM 0 HA LEU A 465 -2.180 0.217 -0.013 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -2.958 1.178 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -3.365 -0.370 -2.718 1.00 0.00 H new ATOM 0 HG LEU A 465 -5.221 -0.539 -0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -6.013 1.600 -0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -4.391 1.179 0.564 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -4.578 2.416 -0.702 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -6.735 0.891 -2.287 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.327 1.677 -3.040 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -5.640 -0.051 -3.328 1.00 0.00 H new ATOM 273 N VAL A 466 -3.337 -1.551 1.253 1.00 0.00 N ATOM 274 CA VAL A 466 -4.055 -2.550 2.036 1.00 0.00 C ATOM 275 C VAL A 466 -5.473 -2.087 2.349 1.00 0.00 C ATOM 276 O VAL A 466 -5.682 -0.969 2.820 1.00 0.00 O ATOM 277 CB VAL A 466 -3.325 -2.860 3.356 1.00 0.00 C ATOM 278 CG1 VAL A 466 -3.008 -1.576 4.106 1.00 0.00 C ATOM 279 CG2 VAL A 466 -4.157 -3.798 4.217 1.00 0.00 C ATOM 0 H VAL A 466 -2.896 -0.818 1.808 1.00 0.00 H new ATOM 0 HA VAL A 466 -4.096 -3.456 1.431 1.00 0.00 H new ATOM 0 HB VAL A 466 -2.384 -3.357 3.122 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.492 -1.816 5.036 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -2.370 -0.943 3.490 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.935 -1.048 4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -3.626 -4.006 5.146 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -5.115 -3.330 4.444 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -4.327 -4.731 3.679 1.00 0.00 H new ATOM 289 N ARG A 467 -6.445 -2.954 2.084 1.00 0.00 N ATOM 290 CA ARG A 467 -7.845 -2.634 2.337 1.00 0.00 C ATOM 291 C ARG A 467 -8.462 -3.628 3.316 1.00 0.00 C ATOM 292 O ARG A 467 -7.873 -4.666 3.615 1.00 0.00 O ATOM 293 CB ARG A 467 -8.635 -2.634 1.027 1.00 0.00 C ATOM 294 CG ARG A 467 -8.666 -1.282 0.333 1.00 0.00 C ATOM 295 CD ARG A 467 -9.454 -1.340 -0.965 1.00 0.00 C ATOM 296 NE ARG A 467 -9.466 -0.054 -1.657 1.00 0.00 N ATOM 297 CZ ARG A 467 -10.254 0.958 -1.313 1.00 0.00 C ATOM 298 NH1 ARG A 467 -11.090 0.834 -0.292 1.00 0.00 N ATOM 299 NH2 ARG A 467 -10.206 2.098 -1.991 1.00 0.00 N ATOM 0 H ARG A 467 -6.289 -3.884 1.694 1.00 0.00 H new ATOM 0 HA ARG A 467 -7.890 -1.639 2.780 1.00 0.00 H new ATOM 0 HB2 ARG A 467 -8.200 -3.370 0.351 1.00 0.00 H new ATOM 0 HB3 ARG A 467 -9.658 -2.952 1.230 1.00 0.00 H new ATOM 0 HG2 ARG A 467 -9.111 -0.541 0.997 1.00 0.00 H new ATOM 0 HG3 ARG A 467 -7.647 -0.954 0.127 1.00 0.00 H new ATOM 0 HD2 ARG A 467 -9.022 -2.099 -1.618 1.00 0.00 H new ATOM 0 HD3 ARG A 467 -10.478 -1.647 -0.754 1.00 0.00 H new ATOM 0 HE ARG A 467 -8.835 0.074 -2.448 1.00 0.00 H new ATOM 0 HH11 ARG A 467 -11.129 -0.040 0.232 1.00 0.00 H new ATOM 0 HH12 ARG A 467 -11.694 1.613 -0.030 1.00 0.00 H new ATOM 0 HH21 ARG A 467 -9.564 2.197 -2.777 1.00 0.00 H new ATOM 0 HH22 ARG A 467 -10.812 2.875 -1.726 1.00 0.00 H new ATOM 313 N ASN A 468 -9.650 -3.302 3.813 1.00 0.00 N ATOM 314 CA ASN A 468 -10.347 -4.165 4.759 1.00 0.00 C ATOM 315 C ASN A 468 -9.588 -4.248 6.081 1.00 0.00 C ATOM 316 O ASN A 468 -9.471 -5.320 6.675 1.00 0.00 O ATOM 317 CB ASN A 468 -10.521 -5.567 4.170 1.00 0.00 C ATOM 318 CG ASN A 468 -11.753 -6.270 4.705 1.00 0.00 C ATOM 319 OD1 ASN A 468 -12.862 -5.740 4.638 1.00 0.00 O ATOM 320 ND2 ASN A 468 -11.564 -7.470 5.242 1.00 0.00 N ATOM 0 H ASN A 468 -10.151 -2.446 3.576 1.00 0.00 H new ATOM 0 HA ASN A 468 -11.330 -3.733 4.950 1.00 0.00 H new ATOM 0 HB2 ASN A 468 -10.589 -5.496 3.084 1.00 0.00 H new ATOM 0 HB3 ASN A 468 -9.638 -6.165 4.396 1.00 0.00 H new ATOM 0 HD21 ASN A 468 -12.356 -7.990 5.620 1.00 0.00 H new ATOM 0 HD22 ASN A 468 -10.627 -7.871 5.277 1.00 0.00 H new ATOM 327 N ILE A 469 -9.075 -3.109 6.534 1.00 0.00 N ATOM 328 CA ILE A 469 -8.330 -3.052 7.785 1.00 0.00 C ATOM 329 C ILE A 469 -9.265 -2.857 8.974 1.00 0.00 C ATOM 330 O ILE A 469 -10.207 -2.066 8.931 1.00 0.00 O ATOM 331 CB ILE A 469 -7.292 -1.914 7.771 1.00 0.00 C ATOM 332 CG1 ILE A 469 -6.367 -2.053 6.560 1.00 0.00 C ATOM 333 CG2 ILE A 469 -6.488 -1.914 9.062 1.00 0.00 C ATOM 334 CD1 ILE A 469 -5.609 -0.786 6.230 1.00 0.00 C ATOM 0 H ILE A 469 -9.162 -2.214 6.053 1.00 0.00 H new ATOM 0 HA ILE A 469 -7.811 -4.005 7.886 1.00 0.00 H new ATOM 0 HB ILE A 469 -7.819 -0.963 7.695 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -5.653 -2.855 6.748 1.00 0.00 H new ATOM 0 HG13 ILE A 469 -6.958 -2.349 5.693 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -5.759 -1.104 9.037 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -7.159 -1.771 9.909 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -5.969 -2.867 9.167 1.00 0.00 H new ATOM 0 HD11 ILE A 469 -4.973 -0.958 5.361 1.00 0.00 H new ATOM 0 HD12 ILE A 469 -6.316 0.014 6.010 1.00 0.00 H new ATOM 0 HD13 ILE A 469 -4.991 -0.500 7.081 1.00 0.00 H new ATOM 346 N PRO A 470 -8.999 -3.595 10.062 1.00 0.00 N ATOM 347 CA PRO A 470 -9.804 -3.519 11.285 1.00 0.00 C ATOM 348 C PRO A 470 -9.623 -2.194 12.018 1.00 0.00 C ATOM 349 O PRO A 470 -8.669 -1.459 11.764 1.00 0.00 O ATOM 350 CB PRO A 470 -9.271 -4.677 12.133 1.00 0.00 C ATOM 351 CG PRO A 470 -7.877 -4.889 11.650 1.00 0.00 C ATOM 352 CD PRO A 470 -7.892 -4.558 10.183 1.00 0.00 C ATOM 0 HA PRO A 470 -10.872 -3.583 11.074 1.00 0.00 H new ATOM 0 HB2 PRO A 470 -9.289 -4.431 13.195 1.00 0.00 H new ATOM 0 HB3 PRO A 470 -9.876 -5.574 12.003 1.00 0.00 H new ATOM 0 HG2 PRO A 470 -7.176 -4.250 12.187 1.00 0.00 H new ATOM 0 HG3 PRO A 470 -7.559 -5.919 11.814 1.00 0.00 H new ATOM 0 HD2 PRO A 470 -6.946 -4.125 9.859 1.00 0.00 H new ATOM 0 HD3 PRO A 470 -8.062 -5.445 9.573 1.00 0.00 H new ATOM 360 N PHE A 471 -10.544 -1.896 12.929 1.00 0.00 N ATOM 361 CA PHE A 471 -10.485 -0.659 13.698 1.00 0.00 C ATOM 362 C PHE A 471 -9.286 -0.662 14.642 1.00 0.00 C ATOM 363 O PHE A 471 -8.579 0.338 14.765 1.00 0.00 O ATOM 364 CB PHE A 471 -11.776 -0.469 14.497 1.00 0.00 C ATOM 365 CG PHE A 471 -11.604 0.384 15.721 1.00 0.00 C ATOM 366 CD1 PHE A 471 -11.001 1.629 15.635 1.00 0.00 C ATOM 367 CD2 PHE A 471 -12.045 -0.058 16.958 1.00 0.00 C ATOM 368 CE1 PHE A 471 -10.841 2.416 16.760 1.00 0.00 C ATOM 369 CE2 PHE A 471 -11.887 0.724 18.086 1.00 0.00 C ATOM 370 CZ PHE A 471 -11.285 1.963 17.987 1.00 0.00 C ATOM 0 H PHE A 471 -11.339 -2.494 13.152 1.00 0.00 H new ATOM 0 HA PHE A 471 -10.373 0.169 12.999 1.00 0.00 H new ATOM 0 HB2 PHE A 471 -12.530 -0.017 13.852 1.00 0.00 H new ATOM 0 HB3 PHE A 471 -12.156 -1.446 14.795 1.00 0.00 H new ATOM 0 HD1 PHE A 471 -10.652 1.988 14.678 1.00 0.00 H new ATOM 0 HD2 PHE A 471 -12.518 -1.025 17.041 1.00 0.00 H new ATOM 0 HE1 PHE A 471 -10.369 3.384 16.680 1.00 0.00 H new ATOM 0 HE2 PHE A 471 -12.234 0.367 19.044 1.00 0.00 H new ATOM 0 HZ PHE A 471 -11.162 2.576 18.867 1.00 0.00 H new ATOM 380 N GLN A 472 -9.065 -1.792 15.305 1.00 0.00 N ATOM 381 CA GLN A 472 -7.953 -1.924 16.239 1.00 0.00 C ATOM 382 C GLN A 472 -6.627 -1.604 15.555 1.00 0.00 C ATOM 383 O GLN A 472 -5.714 -1.061 16.175 1.00 0.00 O ATOM 384 CB GLN A 472 -7.912 -3.339 16.819 1.00 0.00 C ATOM 385 CG GLN A 472 -8.724 -3.497 18.094 1.00 0.00 C ATOM 386 CD GLN A 472 -10.180 -3.819 17.823 1.00 0.00 C ATOM 387 OE1 GLN A 472 -11.063 -2.989 18.042 1.00 0.00 O ATOM 388 NE2 GLN A 472 -10.440 -5.030 17.342 1.00 0.00 N ATOM 0 H GLN A 472 -9.641 -2.629 15.213 1.00 0.00 H new ATOM 0 HA GLN A 472 -8.105 -1.211 17.049 1.00 0.00 H new ATOM 0 HB2 GLN A 472 -8.284 -4.040 16.072 1.00 0.00 H new ATOM 0 HB3 GLN A 472 -6.876 -3.610 17.022 1.00 0.00 H new ATOM 0 HG2 GLN A 472 -8.288 -4.290 18.702 1.00 0.00 H new ATOM 0 HG3 GLN A 472 -8.662 -2.578 18.676 1.00 0.00 H new ATOM 0 HE21 GLN A 472 -9.678 -5.687 17.175 1.00 0.00 H new ATOM 0 HE22 GLN A 472 -11.402 -5.303 17.139 1.00 0.00 H new ATOM 397 N ALA A 473 -6.531 -1.944 14.274 1.00 0.00 N ATOM 398 CA ALA A 473 -5.318 -1.691 13.506 1.00 0.00 C ATOM 399 C ALA A 473 -5.185 -0.212 13.161 1.00 0.00 C ATOM 400 O ALA A 473 -6.154 0.430 12.758 1.00 0.00 O ATOM 401 CB ALA A 473 -5.311 -2.533 12.239 1.00 0.00 C ATOM 0 H ALA A 473 -7.278 -2.395 13.746 1.00 0.00 H new ATOM 0 HA ALA A 473 -4.463 -1.972 14.121 1.00 0.00 H new ATOM 0 HB1 ALA A 473 -4.400 -2.334 11.675 1.00 0.00 H new ATOM 0 HB2 ALA A 473 -5.350 -3.590 12.504 1.00 0.00 H new ATOM 0 HB3 ALA A 473 -6.178 -2.279 11.629 1.00 0.00 H new ATOM 407 N ASN A 474 -3.979 0.323 13.323 1.00 0.00 N ATOM 408 CA ASN A 474 -3.720 1.728 13.030 1.00 0.00 C ATOM 409 C ASN A 474 -2.474 1.882 12.164 1.00 0.00 C ATOM 410 O ASN A 474 -1.777 0.907 11.884 1.00 0.00 O ATOM 411 CB ASN A 474 -3.553 2.519 14.329 1.00 0.00 C ATOM 412 CG ASN A 474 -4.882 2.846 14.982 1.00 0.00 C ATOM 413 OD1 ASN A 474 -5.918 2.286 14.622 1.00 0.00 O ATOM 414 ND2 ASN A 474 -4.858 3.757 15.948 1.00 0.00 N ATOM 0 H ASN A 474 -3.166 -0.195 13.656 1.00 0.00 H new ATOM 0 HA ASN A 474 -4.574 2.122 12.480 1.00 0.00 H new ATOM 0 HB2 ASN A 474 -2.941 1.945 15.025 1.00 0.00 H new ATOM 0 HB3 ASN A 474 -3.016 3.444 14.121 1.00 0.00 H new ATOM 0 HD21 ASN A 474 -5.721 4.018 16.424 1.00 0.00 H new ATOM 0 HD22 ASN A 474 -3.976 4.195 16.214 1.00 0.00 H new ATOM 421 N GLN A 475 -2.201 3.113 11.743 1.00 0.00 N ATOM 422 CA GLN A 475 -1.039 3.394 10.909 1.00 0.00 C ATOM 423 C GLN A 475 0.196 2.668 11.432 1.00 0.00 C ATOM 424 O GLN A 475 0.909 2.010 10.674 1.00 0.00 O ATOM 425 CB GLN A 475 -0.775 4.900 10.856 1.00 0.00 C ATOM 426 CG GLN A 475 0.537 5.265 10.180 1.00 0.00 C ATOM 427 CD GLN A 475 0.941 6.704 10.428 1.00 0.00 C ATOM 428 OE1 GLN A 475 1.330 7.069 11.538 1.00 0.00 O ATOM 429 NE2 GLN A 475 0.852 7.532 9.394 1.00 0.00 N ATOM 0 H GLN A 475 -2.768 3.931 11.966 1.00 0.00 H new ATOM 0 HA GLN A 475 -1.251 3.033 9.902 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -1.594 5.386 10.326 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -0.773 5.296 11.872 1.00 0.00 H new ATOM 0 HG2 GLN A 475 1.324 4.603 10.542 1.00 0.00 H new ATOM 0 HG3 GLN A 475 0.447 5.097 9.107 1.00 0.00 H new ATOM 0 HE21 GLN A 475 0.525 7.188 8.491 1.00 0.00 H new ATOM 0 HE22 GLN A 475 1.111 8.513 9.502 1.00 0.00 H new ATOM 438 N ARG A 476 0.443 2.791 12.732 1.00 0.00 N ATOM 439 CA ARG A 476 1.592 2.147 13.356 1.00 0.00 C ATOM 440 C ARG A 476 1.613 0.653 13.046 1.00 0.00 C ATOM 441 O ARG A 476 2.594 0.133 12.517 1.00 0.00 O ATOM 442 CB ARG A 476 1.567 2.365 14.870 1.00 0.00 C ATOM 443 CG ARG A 476 2.944 2.344 15.512 1.00 0.00 C ATOM 444 CD ARG A 476 3.420 0.922 15.763 1.00 0.00 C ATOM 445 NE ARG A 476 4.761 0.887 16.341 1.00 0.00 N ATOM 446 CZ ARG A 476 5.009 1.072 17.633 1.00 0.00 C ATOM 447 NH1 ARG A 476 4.012 1.303 18.476 1.00 0.00 N ATOM 448 NH2 ARG A 476 6.256 1.026 18.083 1.00 0.00 N ATOM 0 H ARG A 476 -0.138 3.331 13.374 1.00 0.00 H new ATOM 0 HA ARG A 476 2.496 2.598 12.946 1.00 0.00 H new ATOM 0 HB2 ARG A 476 1.091 3.322 15.083 1.00 0.00 H new ATOM 0 HB3 ARG A 476 0.950 1.593 15.329 1.00 0.00 H new ATOM 0 HG2 ARG A 476 3.656 2.858 14.866 1.00 0.00 H new ATOM 0 HG3 ARG A 476 2.916 2.891 16.454 1.00 0.00 H new ATOM 0 HD2 ARG A 476 2.723 0.420 16.434 1.00 0.00 H new ATOM 0 HD3 ARG A 476 3.415 0.367 14.825 1.00 0.00 H new ATOM 0 HE ARG A 476 5.550 0.711 15.719 1.00 0.00 H new ATOM 0 HH11 ARG A 476 3.052 1.339 18.133 1.00 0.00 H new ATOM 0 HH12 ARG A 476 4.205 1.445 19.468 1.00 0.00 H new ATOM 0 HH21 ARG A 476 7.025 0.849 17.437 1.00 0.00 H new ATOM 0 HH22 ARG A 476 6.446 1.168 19.075 1.00 0.00 H new ATOM 462 N GLU A 477 0.523 -0.030 13.382 1.00 0.00 N ATOM 463 CA GLU A 477 0.418 -1.465 13.141 1.00 0.00 C ATOM 464 C GLU A 477 0.879 -1.814 11.729 1.00 0.00 C ATOM 465 O GLU A 477 1.648 -2.756 11.532 1.00 0.00 O ATOM 466 CB GLU A 477 -1.023 -1.935 13.349 1.00 0.00 C ATOM 467 CG GLU A 477 -1.367 -2.217 14.802 1.00 0.00 C ATOM 468 CD GLU A 477 -0.307 -3.044 15.502 1.00 0.00 C ATOM 469 OE1 GLU A 477 -0.068 -4.192 15.071 1.00 0.00 O ATOM 470 OE2 GLU A 477 0.285 -2.543 16.482 1.00 0.00 O ATOM 0 H GLU A 477 -0.298 0.386 13.821 1.00 0.00 H new ATOM 0 HA GLU A 477 1.066 -1.976 13.853 1.00 0.00 H new ATOM 0 HB2 GLU A 477 -1.703 -1.175 12.964 1.00 0.00 H new ATOM 0 HB3 GLU A 477 -1.190 -2.839 12.763 1.00 0.00 H new ATOM 0 HG2 GLU A 477 -1.494 -1.273 15.331 1.00 0.00 H new ATOM 0 HG3 GLU A 477 -2.322 -2.741 14.850 1.00 0.00 H new ATOM 477 N ILE A 478 0.404 -1.050 10.751 1.00 0.00 N ATOM 478 CA ILE A 478 0.768 -1.279 9.358 1.00 0.00 C ATOM 479 C ILE A 478 2.261 -1.061 9.137 1.00 0.00 C ATOM 480 O ILE A 478 2.956 -1.935 8.620 1.00 0.00 O ATOM 481 CB ILE A 478 -0.020 -0.354 8.412 1.00 0.00 C ATOM 482 CG1 ILE A 478 -1.525 -0.582 8.576 1.00 0.00 C ATOM 483 CG2 ILE A 478 0.402 -0.589 6.969 1.00 0.00 C ATOM 484 CD1 ILE A 478 -1.953 -2.008 8.306 1.00 0.00 C ATOM 0 H ILE A 478 -0.234 -0.267 10.897 1.00 0.00 H new ATOM 0 HA ILE A 478 0.517 -2.315 9.132 1.00 0.00 H new ATOM 0 HB ILE A 478 0.202 0.681 8.672 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -1.817 -0.309 9.590 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -2.061 0.084 7.900 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.164 0.072 6.312 1.00 0.00 H new ATOM 0 HG22 ILE A 478 1.467 -0.382 6.863 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.206 -1.626 6.697 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.031 -2.096 8.441 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -1.692 -2.279 7.283 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -1.445 -2.678 8.999 1.00 0.00 H new ATOM 496 N ARG A 479 2.747 0.110 9.535 1.00 0.00 N ATOM 497 CA ARG A 479 4.158 0.443 9.381 1.00 0.00 C ATOM 498 C ARG A 479 5.042 -0.734 9.784 1.00 0.00 C ATOM 499 O ARG A 479 5.891 -1.177 9.011 1.00 0.00 O ATOM 500 CB ARG A 479 4.510 1.670 10.223 1.00 0.00 C ATOM 501 CG ARG A 479 5.639 2.505 9.642 1.00 0.00 C ATOM 502 CD ARG A 479 5.604 3.932 10.168 1.00 0.00 C ATOM 503 NE ARG A 479 5.642 3.979 11.627 1.00 0.00 N ATOM 504 CZ ARG A 479 6.729 3.711 12.343 1.00 0.00 C ATOM 505 NH1 ARG A 479 7.861 3.380 11.737 1.00 0.00 N ATOM 506 NH2 ARG A 479 6.684 3.775 13.668 1.00 0.00 N ATOM 0 H ARG A 479 2.185 0.844 9.966 1.00 0.00 H new ATOM 0 HA ARG A 479 4.339 0.668 8.330 1.00 0.00 H new ATOM 0 HB2 ARG A 479 3.623 2.295 10.326 1.00 0.00 H new ATOM 0 HB3 ARG A 479 4.789 1.344 11.225 1.00 0.00 H new ATOM 0 HG2 ARG A 479 6.597 2.048 9.891 1.00 0.00 H new ATOM 0 HG3 ARG A 479 5.563 2.515 8.555 1.00 0.00 H new ATOM 0 HD2 ARG A 479 6.451 4.488 9.765 1.00 0.00 H new ATOM 0 HD3 ARG A 479 4.700 4.427 9.813 1.00 0.00 H new ATOM 0 HE ARG A 479 4.788 4.231 12.124 1.00 0.00 H new ATOM 0 HH11 ARG A 479 7.899 3.331 10.719 1.00 0.00 H new ATOM 0 HH12 ARG A 479 8.694 3.175 12.289 1.00 0.00 H new ATOM 0 HH21 ARG A 479 5.815 4.030 14.137 1.00 0.00 H new ATOM 0 HH22 ARG A 479 7.519 3.569 14.217 1.00 0.00 H new ATOM 520 N GLU A 480 4.835 -1.234 10.998 1.00 0.00 N ATOM 521 CA GLU A 480 5.614 -2.358 11.503 1.00 0.00 C ATOM 522 C GLU A 480 5.303 -3.631 10.721 1.00 0.00 C ATOM 523 O GLU A 480 6.197 -4.422 10.419 1.00 0.00 O ATOM 524 CB GLU A 480 5.329 -2.578 12.990 1.00 0.00 C ATOM 525 CG GLU A 480 5.676 -1.381 13.860 1.00 0.00 C ATOM 526 CD GLU A 480 5.780 -1.738 15.330 1.00 0.00 C ATOM 527 OE1 GLU A 480 4.724 -1.870 15.983 1.00 0.00 O ATOM 528 OE2 GLU A 480 6.916 -1.885 15.827 1.00 0.00 O ATOM 0 H GLU A 480 4.135 -0.879 11.649 1.00 0.00 H new ATOM 0 HA GLU A 480 6.670 -2.122 11.374 1.00 0.00 H new ATOM 0 HB2 GLU A 480 4.273 -2.815 13.118 1.00 0.00 H new ATOM 0 HB3 GLU A 480 5.894 -3.444 13.335 1.00 0.00 H new ATOM 0 HG2 GLU A 480 6.622 -0.956 13.526 1.00 0.00 H new ATOM 0 HG3 GLU A 480 4.917 -0.610 13.730 1.00 0.00 H new ATOM 535 N LEU A 481 4.028 -3.822 10.397 1.00 0.00 N ATOM 536 CA LEU A 481 3.597 -4.999 9.651 1.00 0.00 C ATOM 537 C LEU A 481 4.487 -5.228 8.433 1.00 0.00 C ATOM 538 O LEU A 481 5.024 -6.319 8.240 1.00 0.00 O ATOM 539 CB LEU A 481 2.141 -4.842 9.210 1.00 0.00 C ATOM 540 CG LEU A 481 1.514 -6.054 8.521 1.00 0.00 C ATOM 541 CD1 LEU A 481 1.108 -7.101 9.546 1.00 0.00 C ATOM 542 CD2 LEU A 481 0.315 -5.632 7.684 1.00 0.00 C ATOM 0 H LEU A 481 3.276 -3.177 10.639 1.00 0.00 H new ATOM 0 HA LEU A 481 3.681 -5.865 10.307 1.00 0.00 H new ATOM 0 HB2 LEU A 481 1.541 -4.597 10.087 1.00 0.00 H new ATOM 0 HB3 LEU A 481 2.077 -3.991 8.532 1.00 0.00 H new ATOM 0 HG LEU A 481 2.258 -6.494 7.857 1.00 0.00 H new ATOM 0 HD11 LEU A 481 0.664 -7.956 9.036 1.00 0.00 H new ATOM 0 HD12 LEU A 481 1.987 -7.427 10.102 1.00 0.00 H new ATOM 0 HD13 LEU A 481 0.381 -6.672 10.236 1.00 0.00 H new ATOM 0 HD21 LEU A 481 -0.118 -6.508 7.201 1.00 0.00 H new ATOM 0 HD22 LEU A 481 -0.432 -5.166 8.327 1.00 0.00 H new ATOM 0 HD23 LEU A 481 0.635 -4.920 6.924 1.00 0.00 H new ATOM 554 N PHE A 482 4.640 -4.192 7.616 1.00 0.00 N ATOM 555 CA PHE A 482 5.466 -4.279 6.417 1.00 0.00 C ATOM 556 C PHE A 482 6.939 -4.069 6.755 1.00 0.00 C ATOM 557 O PHE A 482 7.801 -4.839 6.329 1.00 0.00 O ATOM 558 CB PHE A 482 5.016 -3.243 5.385 1.00 0.00 C ATOM 559 CG PHE A 482 3.719 -3.592 4.712 1.00 0.00 C ATOM 560 CD1 PHE A 482 2.508 -3.303 5.320 1.00 0.00 C ATOM 561 CD2 PHE A 482 3.712 -4.209 3.471 1.00 0.00 C ATOM 562 CE1 PHE A 482 1.313 -3.623 4.703 1.00 0.00 C ATOM 563 CE2 PHE A 482 2.520 -4.530 2.849 1.00 0.00 C ATOM 564 CZ PHE A 482 1.319 -4.238 3.467 1.00 0.00 C ATOM 0 H PHE A 482 4.203 -3.282 7.762 1.00 0.00 H new ATOM 0 HA PHE A 482 5.346 -5.277 5.996 1.00 0.00 H new ATOM 0 HB2 PHE A 482 4.913 -2.275 5.875 1.00 0.00 H new ATOM 0 HB3 PHE A 482 5.792 -3.136 4.627 1.00 0.00 H new ATOM 0 HD1 PHE A 482 2.497 -2.822 6.287 1.00 0.00 H new ATOM 0 HD2 PHE A 482 4.648 -4.441 2.985 1.00 0.00 H new ATOM 0 HE1 PHE A 482 0.376 -3.392 5.187 1.00 0.00 H new ATOM 0 HE2 PHE A 482 2.527 -5.009 1.881 1.00 0.00 H new ATOM 0 HZ PHE A 482 0.387 -4.490 2.984 1.00 0.00 H new ATOM 574 N SER A 483 7.221 -3.022 7.524 1.00 0.00 N ATOM 575 CA SER A 483 8.589 -2.708 7.917 1.00 0.00 C ATOM 576 C SER A 483 9.384 -3.982 8.184 1.00 0.00 C ATOM 577 O SER A 483 10.579 -4.056 7.894 1.00 0.00 O ATOM 578 CB SER A 483 8.594 -1.820 9.162 1.00 0.00 C ATOM 579 OG SER A 483 9.917 -1.565 9.602 1.00 0.00 O ATOM 0 H SER A 483 6.520 -2.377 7.887 1.00 0.00 H new ATOM 0 HA SER A 483 9.062 -2.171 7.095 1.00 0.00 H new ATOM 0 HB2 SER A 483 8.093 -0.877 8.942 1.00 0.00 H new ATOM 0 HB3 SER A 483 8.029 -2.303 9.959 1.00 0.00 H new ATOM 0 HG SER A 483 9.893 -0.994 10.398 1.00 0.00 H new ATOM 585 N THR A 484 8.712 -4.986 8.739 1.00 0.00 N ATOM 586 CA THR A 484 9.354 -6.258 9.047 1.00 0.00 C ATOM 587 C THR A 484 9.994 -6.866 7.805 1.00 0.00 C ATOM 588 O THR A 484 11.141 -7.313 7.840 1.00 0.00 O ATOM 589 CB THR A 484 8.350 -7.265 9.639 1.00 0.00 C ATOM 590 OG1 THR A 484 7.720 -6.706 10.797 1.00 0.00 O ATOM 591 CG2 THR A 484 9.045 -8.566 10.013 1.00 0.00 C ATOM 0 H THR A 484 7.723 -4.943 8.984 1.00 0.00 H new ATOM 0 HA THR A 484 10.128 -6.051 9.786 1.00 0.00 H new ATOM 0 HB THR A 484 7.595 -7.479 8.882 1.00 0.00 H new ATOM 0 HG1 THR A 484 7.151 -5.955 10.529 1.00 0.00 H new ATOM 0 HG21 THR A 484 8.316 -9.261 10.429 1.00 0.00 H new ATOM 0 HG22 THR A 484 9.499 -9.005 9.124 1.00 0.00 H new ATOM 0 HG23 THR A 484 9.819 -8.365 10.754 1.00 0.00 H new ATOM 599 N PHE A 485 9.247 -6.879 6.706 1.00 0.00 N ATOM 600 CA PHE A 485 9.742 -7.433 5.451 1.00 0.00 C ATOM 601 C PHE A 485 10.873 -6.578 4.888 1.00 0.00 C ATOM 602 O PHE A 485 11.784 -7.086 4.236 1.00 0.00 O ATOM 603 CB PHE A 485 8.606 -7.534 4.431 1.00 0.00 C ATOM 604 CG PHE A 485 7.684 -8.695 4.672 1.00 0.00 C ATOM 605 CD1 PHE A 485 6.648 -8.595 5.586 1.00 0.00 C ATOM 606 CD2 PHE A 485 7.854 -9.886 3.984 1.00 0.00 C ATOM 607 CE1 PHE A 485 5.799 -9.662 5.811 1.00 0.00 C ATOM 608 CE2 PHE A 485 7.007 -10.956 4.204 1.00 0.00 C ATOM 609 CZ PHE A 485 5.978 -10.844 5.118 1.00 0.00 C ATOM 0 H PHE A 485 8.296 -6.512 6.659 1.00 0.00 H new ATOM 0 HA PHE A 485 10.131 -8.431 5.651 1.00 0.00 H new ATOM 0 HB2 PHE A 485 8.027 -6.611 4.451 1.00 0.00 H new ATOM 0 HB3 PHE A 485 9.033 -7.621 3.432 1.00 0.00 H new ATOM 0 HD1 PHE A 485 6.502 -7.673 6.129 1.00 0.00 H new ATOM 0 HD2 PHE A 485 8.657 -9.979 3.268 1.00 0.00 H new ATOM 0 HE1 PHE A 485 4.996 -9.572 6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 485 7.150 -11.879 3.661 1.00 0.00 H new ATOM 0 HZ PHE A 485 5.315 -11.678 5.291 1.00 0.00 H new ATOM 619 N GLY A 486 10.806 -5.275 5.144 1.00 0.00 N ATOM 620 CA GLY A 486 11.829 -4.369 4.655 1.00 0.00 C ATOM 621 C GLY A 486 11.539 -2.923 5.007 1.00 0.00 C ATOM 622 O GLY A 486 10.430 -2.589 5.420 1.00 0.00 O ATOM 0 H GLY A 486 10.062 -4.831 5.681 1.00 0.00 H new ATOM 0 HA2 GLY A 486 12.794 -4.655 5.074 1.00 0.00 H new ATOM 0 HA3 GLY A 486 11.910 -4.467 3.572 1.00 0.00 H new ATOM 626 N GLU A 487 12.540 -2.064 4.844 1.00 0.00 N ATOM 627 CA GLU A 487 12.387 -0.647 5.150 1.00 0.00 C ATOM 628 C GLU A 487 11.316 -0.012 4.268 1.00 0.00 C ATOM 629 O GLU A 487 11.245 -0.280 3.067 1.00 0.00 O ATOM 630 CB GLU A 487 13.718 0.085 4.961 1.00 0.00 C ATOM 631 CG GLU A 487 13.751 1.463 5.601 1.00 0.00 C ATOM 632 CD GLU A 487 14.094 1.413 7.077 1.00 0.00 C ATOM 633 OE1 GLU A 487 13.377 0.722 7.830 1.00 0.00 O ATOM 634 OE2 GLU A 487 15.081 2.065 7.478 1.00 0.00 O ATOM 0 H GLU A 487 13.465 -2.325 4.502 1.00 0.00 H new ATOM 0 HA GLU A 487 12.076 -0.558 6.191 1.00 0.00 H new ATOM 0 HB2 GLU A 487 14.520 -0.521 5.383 1.00 0.00 H new ATOM 0 HB3 GLU A 487 13.920 0.184 3.895 1.00 0.00 H new ATOM 0 HG2 GLU A 487 14.483 2.083 5.083 1.00 0.00 H new ATOM 0 HG3 GLU A 487 12.780 1.942 5.474 1.00 0.00 H new ATOM 641 N LEU A 488 10.483 0.829 4.871 1.00 0.00 N ATOM 642 CA LEU A 488 9.414 1.502 4.142 1.00 0.00 C ATOM 643 C LEU A 488 9.746 2.975 3.926 1.00 0.00 C ATOM 644 O LEU A 488 10.561 3.551 4.646 1.00 0.00 O ATOM 645 CB LEU A 488 8.092 1.371 4.899 1.00 0.00 C ATOM 646 CG LEU A 488 7.676 -0.050 5.283 1.00 0.00 C ATOM 647 CD1 LEU A 488 6.433 -0.024 6.160 1.00 0.00 C ATOM 648 CD2 LEU A 488 7.434 -0.890 4.037 1.00 0.00 C ATOM 0 H LEU A 488 10.527 1.061 5.863 1.00 0.00 H new ATOM 0 HA LEU A 488 9.316 1.024 3.167 1.00 0.00 H new ATOM 0 HB2 LEU A 488 8.157 1.968 5.809 1.00 0.00 H new ATOM 0 HB3 LEU A 488 7.302 1.807 4.288 1.00 0.00 H new ATOM 0 HG LEU A 488 8.487 -0.504 5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 488 6.152 -1.044 6.423 1.00 0.00 H new ATOM 0 HD12 LEU A 488 6.641 0.541 7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 488 5.615 0.449 5.617 1.00 0.00 H new ATOM 0 HD21 LEU A 488 7.139 -1.898 4.329 1.00 0.00 H new ATOM 0 HD22 LEU A 488 6.641 -0.438 3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 488 8.349 -0.937 3.446 1.00 0.00 H new ATOM 660 N LYS A 489 9.107 3.580 2.930 1.00 0.00 N ATOM 661 CA LYS A 489 9.330 4.987 2.621 1.00 0.00 C ATOM 662 C LYS A 489 8.397 5.878 3.434 1.00 0.00 C ATOM 663 O LYS A 489 8.817 6.896 3.985 1.00 0.00 O ATOM 664 CB LYS A 489 9.121 5.241 1.126 1.00 0.00 C ATOM 665 CG LYS A 489 10.340 4.923 0.278 1.00 0.00 C ATOM 666 CD LYS A 489 10.192 5.459 -1.136 1.00 0.00 C ATOM 667 CE LYS A 489 11.422 5.157 -1.978 1.00 0.00 C ATOM 668 NZ LYS A 489 12.668 5.670 -1.345 1.00 0.00 N ATOM 0 H LYS A 489 8.430 3.117 2.323 1.00 0.00 H new ATOM 0 HA LYS A 489 10.359 5.232 2.885 1.00 0.00 H new ATOM 0 HB2 LYS A 489 8.280 4.641 0.778 1.00 0.00 H new ATOM 0 HB3 LYS A 489 8.849 6.286 0.978 1.00 0.00 H new ATOM 0 HG2 LYS A 489 11.228 5.354 0.740 1.00 0.00 H new ATOM 0 HG3 LYS A 489 10.490 3.844 0.245 1.00 0.00 H new ATOM 0 HD2 LYS A 489 9.312 5.017 -1.604 1.00 0.00 H new ATOM 0 HD3 LYS A 489 10.028 6.536 -1.103 1.00 0.00 H new ATOM 0 HE2 LYS A 489 11.506 4.080 -2.125 1.00 0.00 H new ATOM 0 HE3 LYS A 489 11.305 5.605 -2.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 489 13.436 5.677 -2.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 489 12.508 6.637 -0.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 489 12.931 5.055 -0.549 1.00 0.00 H new ATOM 682 N THR A 490 7.128 5.488 3.507 1.00 0.00 N ATOM 683 CA THR A 490 6.135 6.251 4.253 1.00 0.00 C ATOM 684 C THR A 490 4.800 5.517 4.302 1.00 0.00 C ATOM 685 O THR A 490 4.448 4.787 3.376 1.00 0.00 O ATOM 686 CB THR A 490 5.919 7.646 3.637 1.00 0.00 C ATOM 687 OG1 THR A 490 4.985 8.391 4.426 1.00 0.00 O ATOM 688 CG2 THR A 490 5.407 7.533 2.209 1.00 0.00 C ATOM 0 H THR A 490 6.764 4.648 3.058 1.00 0.00 H new ATOM 0 HA THR A 490 6.521 6.365 5.266 1.00 0.00 H new ATOM 0 HB THR A 490 6.877 8.165 3.623 1.00 0.00 H new ATOM 0 HG1 THR A 490 4.855 9.277 4.028 1.00 0.00 H new ATOM 0 HG21 THR A 490 5.262 8.531 1.795 1.00 0.00 H new ATOM 0 HG22 THR A 490 6.134 6.991 1.604 1.00 0.00 H new ATOM 0 HG23 THR A 490 4.458 6.996 2.204 1.00 0.00 H new ATOM 696 N VAL A 491 4.061 5.715 5.388 1.00 0.00 N ATOM 697 CA VAL A 491 2.762 5.073 5.557 1.00 0.00 C ATOM 698 C VAL A 491 1.654 6.107 5.720 1.00 0.00 C ATOM 699 O VAL A 491 1.702 6.946 6.619 1.00 0.00 O ATOM 700 CB VAL A 491 2.756 4.133 6.777 1.00 0.00 C ATOM 701 CG1 VAL A 491 1.382 3.505 6.960 1.00 0.00 C ATOM 702 CG2 VAL A 491 3.826 3.062 6.631 1.00 0.00 C ATOM 0 H VAL A 491 4.339 6.315 6.165 1.00 0.00 H new ATOM 0 HA VAL A 491 2.578 4.488 4.656 1.00 0.00 H new ATOM 0 HB VAL A 491 2.983 4.720 7.667 1.00 0.00 H new ATOM 0 HG11 VAL A 491 1.397 2.844 7.827 1.00 0.00 H new ATOM 0 HG12 VAL A 491 0.641 4.289 7.114 1.00 0.00 H new ATOM 0 HG13 VAL A 491 1.123 2.931 6.070 1.00 0.00 H new ATOM 0 HG21 VAL A 491 3.807 2.407 7.502 1.00 0.00 H new ATOM 0 HG22 VAL A 491 3.634 2.476 5.732 1.00 0.00 H new ATOM 0 HG23 VAL A 491 4.805 3.534 6.554 1.00 0.00 H new ATOM 712 N ARG A 492 0.658 6.041 4.843 1.00 0.00 N ATOM 713 CA ARG A 492 -0.463 6.973 4.889 1.00 0.00 C ATOM 714 C ARG A 492 -1.769 6.238 5.176 1.00 0.00 C ATOM 715 O ARG A 492 -2.256 5.469 4.347 1.00 0.00 O ATOM 716 CB ARG A 492 -0.574 7.735 3.567 1.00 0.00 C ATOM 717 CG ARG A 492 0.690 8.492 3.192 1.00 0.00 C ATOM 718 CD ARG A 492 0.568 9.134 1.819 1.00 0.00 C ATOM 719 NE ARG A 492 1.431 10.304 1.683 1.00 0.00 N ATOM 720 CZ ARG A 492 1.626 10.944 0.536 1.00 0.00 C ATOM 721 NH1 ARG A 492 1.022 10.530 -0.569 1.00 0.00 N ATOM 722 NH2 ARG A 492 2.427 12.002 0.493 1.00 0.00 N ATOM 0 H ARG A 492 0.604 5.353 4.092 1.00 0.00 H new ATOM 0 HA ARG A 492 -0.281 7.683 5.696 1.00 0.00 H new ATOM 0 HB2 ARG A 492 -0.815 7.031 2.771 1.00 0.00 H new ATOM 0 HB3 ARG A 492 -1.403 8.439 3.632 1.00 0.00 H new ATOM 0 HG2 ARG A 492 0.890 9.261 3.938 1.00 0.00 H new ATOM 0 HG3 ARG A 492 1.540 7.810 3.202 1.00 0.00 H new ATOM 0 HD2 ARG A 492 0.825 8.403 1.053 1.00 0.00 H new ATOM 0 HD3 ARG A 492 -0.468 9.426 1.646 1.00 0.00 H new ATOM 0 HE ARG A 492 1.910 10.649 2.515 1.00 0.00 H new ATOM 0 HH11 ARG A 492 0.406 9.718 -0.540 1.00 0.00 H new ATOM 0 HH12 ARG A 492 1.174 11.024 -1.449 1.00 0.00 H new ATOM 0 HH21 ARG A 492 2.893 12.324 1.341 1.00 0.00 H new ATOM 0 HH22 ARG A 492 2.576 12.493 -0.388 1.00 0.00 H new ATOM 736 N LEU A 493 -2.331 6.481 6.355 1.00 0.00 N ATOM 737 CA LEU A 493 -3.581 5.843 6.753 1.00 0.00 C ATOM 738 C LEU A 493 -4.577 6.874 7.273 1.00 0.00 C ATOM 739 O LEU A 493 -4.214 7.846 7.935 1.00 0.00 O ATOM 740 CB LEU A 493 -3.317 4.785 7.826 1.00 0.00 C ATOM 741 CG LEU A 493 -3.025 3.372 7.319 1.00 0.00 C ATOM 742 CD1 LEU A 493 -1.532 3.182 7.100 1.00 0.00 C ATOM 743 CD2 LEU A 493 -3.559 2.334 8.295 1.00 0.00 C ATOM 0 H LEU A 493 -1.941 7.115 7.052 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.011 5.361 5.875 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -2.472 5.114 8.432 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -4.184 4.741 8.485 1.00 0.00 H new ATOM 0 HG LEU A 493 -3.532 3.237 6.363 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -1.343 2.171 6.739 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -1.178 3.902 6.363 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -1.004 3.336 8.041 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -3.342 1.335 7.918 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -3.081 2.467 9.265 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.637 2.456 8.402 1.00 0.00 H new ATOM 755 N PRO A 494 -5.866 6.657 6.970 1.00 0.00 N ATOM 756 CA PRO A 494 -6.942 7.555 7.399 1.00 0.00 C ATOM 757 C PRO A 494 -7.184 7.492 8.903 1.00 0.00 C ATOM 758 O PRO A 494 -7.148 6.418 9.504 1.00 0.00 O ATOM 759 CB PRO A 494 -8.164 7.034 6.639 1.00 0.00 C ATOM 760 CG PRO A 494 -7.861 5.599 6.373 1.00 0.00 C ATOM 761 CD PRO A 494 -6.371 5.518 6.185 1.00 0.00 C ATOM 0 HA PRO A 494 -6.708 8.599 7.192 1.00 0.00 H new ATOM 0 HB2 PRO A 494 -9.074 7.144 7.229 1.00 0.00 H new ATOM 0 HB3 PRO A 494 -8.318 7.585 5.711 1.00 0.00 H new ATOM 0 HG2 PRO A 494 -8.184 4.972 7.204 1.00 0.00 H new ATOM 0 HG3 PRO A 494 -8.386 5.247 5.485 1.00 0.00 H new ATOM 0 HD2 PRO A 494 -5.971 4.571 6.548 1.00 0.00 H new ATOM 0 HD3 PRO A 494 -6.093 5.600 5.134 1.00 0.00 H new ATOM 769 N LYS A 495 -7.431 8.650 9.507 1.00 0.00 N ATOM 770 CA LYS A 495 -7.681 8.727 10.941 1.00 0.00 C ATOM 771 C LYS A 495 -9.054 9.331 11.223 1.00 0.00 C ATOM 772 O LYS A 495 -9.308 10.494 10.908 1.00 0.00 O ATOM 773 CB LYS A 495 -6.596 9.561 11.625 1.00 0.00 C ATOM 774 CG LYS A 495 -6.380 9.200 13.084 1.00 0.00 C ATOM 775 CD LYS A 495 -7.460 9.795 13.972 1.00 0.00 C ATOM 776 CE LYS A 495 -7.263 9.403 15.428 1.00 0.00 C ATOM 777 NZ LYS A 495 -7.666 7.992 15.682 1.00 0.00 N ATOM 0 H LYS A 495 -7.463 9.548 9.025 1.00 0.00 H new ATOM 0 HA LYS A 495 -7.659 7.714 11.342 1.00 0.00 H new ATOM 0 HB2 LYS A 495 -5.658 9.434 11.085 1.00 0.00 H new ATOM 0 HB3 LYS A 495 -6.863 10.616 11.556 1.00 0.00 H new ATOM 0 HG2 LYS A 495 -6.374 8.116 13.194 1.00 0.00 H new ATOM 0 HG3 LYS A 495 -5.403 9.559 13.408 1.00 0.00 H new ATOM 0 HD2 LYS A 495 -7.449 10.881 13.882 1.00 0.00 H new ATOM 0 HD3 LYS A 495 -8.439 9.457 13.632 1.00 0.00 H new ATOM 0 HE2 LYS A 495 -6.216 9.537 15.702 1.00 0.00 H new ATOM 0 HE3 LYS A 495 -7.846 10.068 16.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 495 -7.517 7.764 16.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 495 -8.671 7.870 15.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 495 -7.092 7.356 15.093 1.00 0.00 H new ATOM 791 N LYS A 496 -9.935 8.534 11.818 1.00 0.00 N ATOM 792 CA LYS A 496 -11.281 8.991 12.145 1.00 0.00 C ATOM 793 C LYS A 496 -11.416 9.258 13.640 1.00 0.00 C ATOM 794 O LYS A 496 -10.827 8.556 14.462 1.00 0.00 O ATOM 795 CB LYS A 496 -12.314 7.951 11.706 1.00 0.00 C ATOM 796 CG LYS A 496 -13.716 8.233 12.218 1.00 0.00 C ATOM 797 CD LYS A 496 -14.502 6.950 12.429 1.00 0.00 C ATOM 798 CE LYS A 496 -15.759 7.194 13.249 1.00 0.00 C ATOM 799 NZ LYS A 496 -16.526 8.370 12.751 1.00 0.00 N ATOM 0 H LYS A 496 -9.741 7.568 12.084 1.00 0.00 H new ATOM 0 HA LYS A 496 -11.462 9.923 11.610 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -12.335 7.910 10.617 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -11.999 6.968 12.056 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -13.657 8.783 13.157 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.242 8.870 11.507 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.774 6.526 11.462 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -13.874 6.216 12.934 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -16.392 6.307 13.216 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -15.487 7.353 14.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -17.542 8.215 12.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -16.222 9.224 13.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -16.350 8.494 11.733 1.00 0.00 H new ATOM 813 N MET A 497 -12.197 10.277 13.986 1.00 0.00 N ATOM 814 CA MET A 497 -12.411 10.634 15.384 1.00 0.00 C ATOM 815 C MET A 497 -13.243 9.572 16.096 1.00 0.00 C ATOM 816 O MET A 497 -13.936 8.779 15.456 1.00 0.00 O ATOM 817 CB MET A 497 -13.106 11.994 15.484 1.00 0.00 C ATOM 818 CG MET A 497 -12.244 13.153 15.012 1.00 0.00 C ATOM 819 SD MET A 497 -10.927 13.558 16.175 1.00 0.00 S ATOM 820 CE MET A 497 -11.360 15.242 16.604 1.00 0.00 C ATOM 0 H MET A 497 -12.691 10.869 13.319 1.00 0.00 H new ATOM 0 HA MET A 497 -11.438 10.694 15.871 1.00 0.00 H new ATOM 0 HB2 MET A 497 -14.022 11.969 14.894 1.00 0.00 H new ATOM 0 HB3 MET A 497 -13.399 12.168 16.519 1.00 0.00 H new ATOM 0 HG2 MET A 497 -11.806 12.905 14.045 1.00 0.00 H new ATOM 0 HG3 MET A 497 -12.873 14.030 14.861 1.00 0.00 H new ATOM 0 HE1 MET A 497 -10.636 15.633 17.319 1.00 0.00 H new ATOM 0 HE2 MET A 497 -11.353 15.859 15.706 1.00 0.00 H new ATOM 0 HE3 MET A 497 -12.355 15.260 17.049 1.00 0.00 H new ATOM 830 N THR A 498 -13.169 9.560 17.423 1.00 0.00 N ATOM 831 CA THR A 498 -13.913 8.594 18.221 1.00 0.00 C ATOM 832 C THR A 498 -15.411 8.868 18.160 1.00 0.00 C ATOM 833 O THR A 498 -15.891 9.870 18.687 1.00 0.00 O ATOM 834 CB THR A 498 -13.459 8.612 19.693 1.00 0.00 C ATOM 835 OG1 THR A 498 -13.556 9.941 20.219 1.00 0.00 O ATOM 836 CG2 THR A 498 -12.028 8.113 19.824 1.00 0.00 C ATOM 0 H THR A 498 -12.601 10.209 17.968 1.00 0.00 H new ATOM 0 HA THR A 498 -13.709 7.611 17.798 1.00 0.00 H new ATOM 0 HB THR A 498 -14.112 7.948 20.260 1.00 0.00 H new ATOM 0 HG1 THR A 498 -14.416 10.333 19.960 1.00 0.00 H new ATOM 0 HG21 THR A 498 -11.730 8.135 20.872 1.00 0.00 H new ATOM 0 HG22 THR A 498 -11.963 7.091 19.449 1.00 0.00 H new ATOM 0 HG23 THR A 498 -11.364 8.755 19.244 1.00 0.00 H new ATOM 844 N GLY A 499 -16.147 7.969 17.512 1.00 0.00 N ATOM 845 CA GLY A 499 -17.584 8.132 17.395 1.00 0.00 C ATOM 846 C GLY A 499 -18.232 7.013 16.605 1.00 0.00 C ATOM 847 O GLY A 499 -17.744 5.882 16.599 1.00 0.00 O ATOM 0 H GLY A 499 -15.773 7.131 17.066 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -18.024 8.171 18.391 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -17.800 9.085 16.913 1.00 0.00 H new ATOM 851 N THR A 500 -19.337 7.326 15.935 1.00 0.00 N ATOM 852 CA THR A 500 -20.055 6.338 15.140 1.00 0.00 C ATOM 853 C THR A 500 -19.132 5.672 14.125 1.00 0.00 C ATOM 854 O THR A 500 -18.805 6.255 13.093 1.00 0.00 O ATOM 855 CB THR A 500 -21.245 6.972 14.395 1.00 0.00 C ATOM 856 OG1 THR A 500 -22.042 7.736 15.307 1.00 0.00 O ATOM 857 CG2 THR A 500 -22.103 5.903 13.736 1.00 0.00 C ATOM 0 H THR A 500 -19.754 8.257 15.927 1.00 0.00 H new ATOM 0 HA THR A 500 -20.430 5.586 15.835 1.00 0.00 H new ATOM 0 HB THR A 500 -20.852 7.628 13.619 1.00 0.00 H new ATOM 0 HG1 THR A 500 -22.796 8.137 14.826 1.00 0.00 H new ATOM 0 HG21 THR A 500 -22.937 6.375 13.216 1.00 0.00 H new ATOM 0 HG22 THR A 500 -21.500 5.342 13.021 1.00 0.00 H new ATOM 0 HG23 THR A 500 -22.487 5.224 14.498 1.00 0.00 H new ATOM 865 N GLY A 501 -18.714 4.446 14.427 1.00 0.00 N ATOM 866 CA GLY A 501 -17.833 3.722 13.530 1.00 0.00 C ATOM 867 C GLY A 501 -16.371 4.041 13.771 1.00 0.00 C ATOM 868 O GLY A 501 -16.033 4.767 14.706 1.00 0.00 O ATOM 0 H GLY A 501 -18.970 3.942 15.276 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -17.993 2.651 13.654 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -18.090 3.965 12.499 1.00 0.00 H new ATOM 872 N ALA A 502 -15.501 3.496 12.927 1.00 0.00 N ATOM 873 CA ALA A 502 -14.067 3.728 13.053 1.00 0.00 C ATOM 874 C ALA A 502 -13.482 4.266 11.752 1.00 0.00 C ATOM 875 O ALA A 502 -14.211 4.540 10.798 1.00 0.00 O ATOM 876 CB ALA A 502 -13.359 2.444 13.461 1.00 0.00 C ATOM 0 H ALA A 502 -15.764 2.891 12.149 1.00 0.00 H new ATOM 0 HA ALA A 502 -13.912 4.478 13.828 1.00 0.00 H new ATOM 0 HB1 ALA A 502 -12.289 2.631 13.551 1.00 0.00 H new ATOM 0 HB2 ALA A 502 -13.750 2.102 14.419 1.00 0.00 H new ATOM 0 HB3 ALA A 502 -13.530 1.678 12.705 1.00 0.00 H new ATOM 882 N HIS A 503 -12.161 4.416 11.719 1.00 0.00 N ATOM 883 CA HIS A 503 -11.478 4.922 10.534 1.00 0.00 C ATOM 884 C HIS A 503 -11.831 4.088 9.306 1.00 0.00 C ATOM 885 O HIS A 503 -12.463 3.037 9.418 1.00 0.00 O ATOM 886 CB HIS A 503 -9.965 4.917 10.751 1.00 0.00 C ATOM 887 CG HIS A 503 -9.303 3.644 10.321 1.00 0.00 C ATOM 888 ND1 HIS A 503 -9.856 2.399 10.532 1.00 0.00 N ATOM 889 CD2 HIS A 503 -8.126 3.428 9.686 1.00 0.00 C ATOM 890 CE1 HIS A 503 -9.048 1.472 10.047 1.00 0.00 C ATOM 891 NE2 HIS A 503 -7.992 2.071 9.528 1.00 0.00 N ATOM 0 H HIS A 503 -11.543 4.194 12.499 1.00 0.00 H new ATOM 0 HA HIS A 503 -11.809 5.946 10.363 1.00 0.00 H new ATOM 0 HB2 HIS A 503 -9.525 5.749 10.202 1.00 0.00 H new ATOM 0 HB3 HIS A 503 -9.757 5.086 11.808 1.00 0.00 H new ATOM 0 HD2 HIS A 503 -7.424 4.183 9.364 1.00 0.00 H new ATOM 0 HE1 HIS A 503 -9.222 0.406 10.071 1.00 0.00 H new ATOM 0 HE2 HIS A 503 -7.204 1.601 9.082 1.00 0.00 H new ATOM 899 N ARG A 504 -11.420 4.564 8.135 1.00 0.00 N ATOM 900 CA ARG A 504 -11.695 3.864 6.887 1.00 0.00 C ATOM 901 C ARG A 504 -10.720 2.707 6.686 1.00 0.00 C ATOM 902 O ARG A 504 -9.529 2.829 6.972 1.00 0.00 O ATOM 903 CB ARG A 504 -11.605 4.831 5.704 1.00 0.00 C ATOM 904 CG ARG A 504 -12.476 6.066 5.861 1.00 0.00 C ATOM 905 CD ARG A 504 -12.087 7.152 4.870 1.00 0.00 C ATOM 906 NE ARG A 504 -13.207 8.036 4.559 1.00 0.00 N ATOM 907 CZ ARG A 504 -14.230 7.683 3.788 1.00 0.00 C ATOM 908 NH1 ARG A 504 -14.275 6.471 3.254 1.00 0.00 N ATOM 909 NH2 ARG A 504 -15.212 8.544 3.552 1.00 0.00 N ATOM 0 H ARG A 504 -10.895 5.432 8.025 1.00 0.00 H new ATOM 0 HA ARG A 504 -12.706 3.460 6.942 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -10.568 5.142 5.577 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -11.894 4.306 4.793 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -13.522 5.796 5.714 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -12.385 6.450 6.877 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -11.265 7.739 5.280 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -11.723 6.691 3.952 1.00 0.00 H new ATOM 0 HE ARG A 504 -13.204 8.976 4.955 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -13.523 5.806 3.434 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -15.062 6.203 2.663 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -15.182 9.477 3.963 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -15.997 8.272 2.960 1.00 0.00 H new ATOM 923 N GLY A 505 -11.234 1.585 6.193 1.00 0.00 N ATOM 924 CA GLY A 505 -10.396 0.422 5.964 1.00 0.00 C ATOM 925 C GLY A 505 -9.553 0.554 4.711 1.00 0.00 C ATOM 926 O GLY A 505 -9.828 -0.091 3.699 1.00 0.00 O ATOM 0 H GLY A 505 -12.216 1.460 5.948 1.00 0.00 H new ATOM 0 HA2 GLY A 505 -9.743 0.273 6.824 1.00 0.00 H new ATOM 0 HA3 GLY A 505 -11.024 -0.465 5.884 1.00 0.00 H new ATOM 930 N PHE A 506 -8.525 1.392 4.777 1.00 0.00 N ATOM 931 CA PHE A 506 -7.640 1.609 3.638 1.00 0.00 C ATOM 932 C PHE A 506 -6.343 2.281 4.077 1.00 0.00 C ATOM 933 O PHE A 506 -6.359 3.263 4.818 1.00 0.00 O ATOM 934 CB PHE A 506 -8.338 2.464 2.578 1.00 0.00 C ATOM 935 CG PHE A 506 -8.117 3.939 2.758 1.00 0.00 C ATOM 936 CD1 PHE A 506 -6.870 4.498 2.531 1.00 0.00 C ATOM 937 CD2 PHE A 506 -9.156 4.765 3.152 1.00 0.00 C ATOM 938 CE1 PHE A 506 -6.664 5.855 2.696 1.00 0.00 C ATOM 939 CE2 PHE A 506 -8.956 6.123 3.319 1.00 0.00 C ATOM 940 CZ PHE A 506 -7.708 6.668 3.089 1.00 0.00 C ATOM 0 H PHE A 506 -8.283 1.933 5.607 1.00 0.00 H new ATOM 0 HA PHE A 506 -7.397 0.637 3.208 1.00 0.00 H new ATOM 0 HB2 PHE A 506 -7.981 2.169 1.591 1.00 0.00 H new ATOM 0 HB3 PHE A 506 -9.408 2.259 2.604 1.00 0.00 H new ATOM 0 HD1 PHE A 506 -6.050 3.867 2.222 1.00 0.00 H new ATOM 0 HD2 PHE A 506 -10.134 4.344 3.331 1.00 0.00 H new ATOM 0 HE1 PHE A 506 -5.687 6.279 2.518 1.00 0.00 H new ATOM 0 HE2 PHE A 506 -9.774 6.756 3.629 1.00 0.00 H new ATOM 0 HZ PHE A 506 -7.549 7.729 3.216 1.00 0.00 H new ATOM 950 N GLY A 507 -5.218 1.743 3.613 1.00 0.00 N ATOM 951 CA GLY A 507 -3.927 2.303 3.968 1.00 0.00 C ATOM 952 C GLY A 507 -2.912 2.174 2.850 1.00 0.00 C ATOM 953 O GLY A 507 -2.853 1.149 2.170 1.00 0.00 O ATOM 0 H GLY A 507 -5.178 0.930 2.998 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -4.049 3.355 4.224 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -3.549 1.800 4.858 1.00 0.00 H new ATOM 957 N PHE A 508 -2.111 3.217 2.656 1.00 0.00 N ATOM 958 CA PHE A 508 -1.095 3.217 1.611 1.00 0.00 C ATOM 959 C PHE A 508 0.289 2.952 2.197 1.00 0.00 C ATOM 960 O PHE A 508 0.672 3.546 3.205 1.00 0.00 O ATOM 961 CB PHE A 508 -1.099 4.553 0.866 1.00 0.00 C ATOM 962 CG PHE A 508 -2.230 4.691 -0.113 1.00 0.00 C ATOM 963 CD1 PHE A 508 -2.278 3.901 -1.251 1.00 0.00 C ATOM 964 CD2 PHE A 508 -3.244 5.609 0.104 1.00 0.00 C ATOM 965 CE1 PHE A 508 -3.318 4.025 -2.154 1.00 0.00 C ATOM 966 CE2 PHE A 508 -4.286 5.737 -0.795 1.00 0.00 C ATOM 967 CZ PHE A 508 -4.322 4.945 -1.926 1.00 0.00 C ATOM 0 H PHE A 508 -2.146 4.073 3.209 1.00 0.00 H new ATOM 0 HA PHE A 508 -1.332 2.417 0.909 1.00 0.00 H new ATOM 0 HB2 PHE A 508 -1.156 5.364 1.592 1.00 0.00 H new ATOM 0 HB3 PHE A 508 -0.154 4.667 0.335 1.00 0.00 H new ATOM 0 HD1 PHE A 508 -1.495 3.181 -1.434 1.00 0.00 H new ATOM 0 HD2 PHE A 508 -3.220 6.232 0.986 1.00 0.00 H new ATOM 0 HE1 PHE A 508 -3.345 3.403 -3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 508 -5.071 6.456 -0.613 1.00 0.00 H new ATOM 0 HZ PHE A 508 -5.134 5.045 -2.631 1.00 0.00 H new ATOM 977 N VAL A 509 1.034 2.057 1.558 1.00 0.00 N ATOM 978 CA VAL A 509 2.376 1.713 2.014 1.00 0.00 C ATOM 979 C VAL A 509 3.393 1.853 0.887 1.00 0.00 C ATOM 980 O VAL A 509 3.125 1.476 -0.255 1.00 0.00 O ATOM 981 CB VAL A 509 2.430 0.276 2.565 1.00 0.00 C ATOM 982 CG1 VAL A 509 3.836 -0.062 3.038 1.00 0.00 C ATOM 983 CG2 VAL A 509 1.423 0.098 3.691 1.00 0.00 C ATOM 0 H VAL A 509 0.731 1.556 0.722 1.00 0.00 H new ATOM 0 HA VAL A 509 2.627 2.410 2.813 1.00 0.00 H new ATOM 0 HB VAL A 509 2.167 -0.412 1.762 1.00 0.00 H new ATOM 0 HG11 VAL A 509 3.855 -1.081 3.424 1.00 0.00 H new ATOM 0 HG12 VAL A 509 4.531 0.023 2.203 1.00 0.00 H new ATOM 0 HG13 VAL A 509 4.131 0.630 3.827 1.00 0.00 H new ATOM 0 HG21 VAL A 509 1.475 -0.923 4.068 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.652 0.795 4.497 1.00 0.00 H new ATOM 0 HG23 VAL A 509 0.419 0.295 3.316 1.00 0.00 H new ATOM 993 N ASP A 510 4.560 2.396 1.214 1.00 0.00 N ATOM 994 CA ASP A 510 5.618 2.585 0.229 1.00 0.00 C ATOM 995 C ASP A 510 6.902 1.889 0.671 1.00 0.00 C ATOM 996 O ASP A 510 7.233 1.869 1.857 1.00 0.00 O ATOM 997 CB ASP A 510 5.881 4.075 0.010 1.00 0.00 C ATOM 998 CG ASP A 510 4.694 4.788 -0.608 1.00 0.00 C ATOM 999 OD1 ASP A 510 4.349 4.472 -1.766 1.00 0.00 O ATOM 1000 OD2 ASP A 510 4.109 5.660 0.068 1.00 0.00 O ATOM 0 H ASP A 510 4.797 2.713 2.154 1.00 0.00 H new ATOM 0 HA ASP A 510 5.289 2.141 -0.710 1.00 0.00 H new ATOM 0 HB2 ASP A 510 6.125 4.542 0.964 1.00 0.00 H new ATOM 0 HB3 ASP A 510 6.751 4.196 -0.636 1.00 0.00 H new ATOM 1005 N PHE A 511 7.621 1.318 -0.290 1.00 0.00 N ATOM 1006 CA PHE A 511 8.867 0.619 0.001 1.00 0.00 C ATOM 1007 C PHE A 511 10.059 1.360 -0.599 1.00 0.00 C ATOM 1008 O PHE A 511 9.913 2.118 -1.559 1.00 0.00 O ATOM 1009 CB PHE A 511 8.814 -0.810 -0.543 1.00 0.00 C ATOM 1010 CG PHE A 511 8.244 -1.801 0.431 1.00 0.00 C ATOM 1011 CD1 PHE A 511 9.061 -2.434 1.354 1.00 0.00 C ATOM 1012 CD2 PHE A 511 6.891 -2.100 0.424 1.00 0.00 C ATOM 1013 CE1 PHE A 511 8.539 -3.347 2.252 1.00 0.00 C ATOM 1014 CE2 PHE A 511 6.364 -3.011 1.319 1.00 0.00 C ATOM 1015 CZ PHE A 511 7.189 -3.636 2.234 1.00 0.00 C ATOM 0 H PHE A 511 7.362 1.326 -1.277 1.00 0.00 H new ATOM 0 HA PHE A 511 8.991 0.584 1.083 1.00 0.00 H new ATOM 0 HB2 PHE A 511 8.215 -0.822 -1.454 1.00 0.00 H new ATOM 0 HB3 PHE A 511 9.821 -1.123 -0.820 1.00 0.00 H new ATOM 0 HD1 PHE A 511 10.118 -2.212 1.372 1.00 0.00 H new ATOM 0 HD2 PHE A 511 6.241 -1.615 -0.289 1.00 0.00 H new ATOM 0 HE1 PHE A 511 9.187 -3.833 2.967 1.00 0.00 H new ATOM 0 HE2 PHE A 511 5.307 -3.234 1.303 1.00 0.00 H new ATOM 0 HZ PHE A 511 6.779 -4.349 2.934 1.00 0.00 H new ATOM 1025 N ILE A 512 11.237 1.134 -0.028 1.00 0.00 N ATOM 1026 CA ILE A 512 12.453 1.779 -0.506 1.00 0.00 C ATOM 1027 C ILE A 512 12.852 1.251 -1.880 1.00 0.00 C ATOM 1028 O ILE A 512 13.225 2.018 -2.769 1.00 0.00 O ATOM 1029 CB ILE A 512 13.624 1.568 0.472 1.00 0.00 C ATOM 1030 CG1 ILE A 512 13.209 1.959 1.892 1.00 0.00 C ATOM 1031 CG2 ILE A 512 14.837 2.374 0.029 1.00 0.00 C ATOM 1032 CD1 ILE A 512 12.917 3.435 2.051 1.00 0.00 C ATOM 0 H ILE A 512 11.375 0.509 0.766 1.00 0.00 H new ATOM 0 HA ILE A 512 12.237 2.845 -0.577 1.00 0.00 H new ATOM 0 HB ILE A 512 13.893 0.512 0.470 1.00 0.00 H new ATOM 0 HG12 ILE A 512 12.323 1.389 2.173 1.00 0.00 H new ATOM 0 HG13 ILE A 512 14.002 1.677 2.584 1.00 0.00 H new ATOM 0 HG21 ILE A 512 15.656 2.214 0.730 1.00 0.00 H new ATOM 0 HG22 ILE A 512 15.144 2.053 -0.966 1.00 0.00 H new ATOM 0 HG23 ILE A 512 14.581 3.433 0.005 1.00 0.00 H new ATOM 0 HD11 ILE A 512 12.629 3.640 3.082 1.00 0.00 H new ATOM 0 HD12 ILE A 512 13.808 4.011 1.802 1.00 0.00 H new ATOM 0 HD13 ILE A 512 12.103 3.719 1.384 1.00 0.00 H new ATOM 1044 N THR A 513 12.769 -0.065 -2.049 1.00 0.00 N ATOM 1045 CA THR A 513 13.119 -0.696 -3.315 1.00 0.00 C ATOM 1046 C THR A 513 11.934 -1.457 -3.897 1.00 0.00 C ATOM 1047 O THR A 513 10.889 -1.583 -3.258 1.00 0.00 O ATOM 1048 CB THR A 513 14.305 -1.665 -3.150 1.00 0.00 C ATOM 1049 OG1 THR A 513 13.947 -2.731 -2.263 1.00 0.00 O ATOM 1050 CG2 THR A 513 15.527 -0.938 -2.609 1.00 0.00 C ATOM 0 H THR A 513 12.462 -0.714 -1.325 1.00 0.00 H new ATOM 0 HA THR A 513 13.404 0.104 -3.998 1.00 0.00 H new ATOM 0 HB THR A 513 14.550 -2.075 -4.130 1.00 0.00 H new ATOM 0 HG1 THR A 513 14.595 -3.461 -2.351 1.00 0.00 H new ATOM 0 HG21 THR A 513 16.351 -1.643 -2.501 1.00 0.00 H new ATOM 0 HG22 THR A 513 15.815 -0.146 -3.300 1.00 0.00 H new ATOM 0 HG23 THR A 513 15.291 -0.504 -1.637 1.00 0.00 H new ATOM 1058 N LYS A 514 12.102 -1.965 -5.113 1.00 0.00 N ATOM 1059 CA LYS A 514 11.046 -2.716 -5.782 1.00 0.00 C ATOM 1060 C LYS A 514 11.068 -4.181 -5.357 1.00 0.00 C ATOM 1061 O LYS A 514 10.022 -4.822 -5.259 1.00 0.00 O ATOM 1062 CB LYS A 514 11.202 -2.612 -7.301 1.00 0.00 C ATOM 1063 CG LYS A 514 10.593 -1.352 -7.890 1.00 0.00 C ATOM 1064 CD LYS A 514 11.479 -0.141 -7.654 1.00 0.00 C ATOM 1065 CE LYS A 514 12.647 -0.106 -8.629 1.00 0.00 C ATOM 1066 NZ LYS A 514 12.250 0.456 -9.949 1.00 0.00 N ATOM 0 H LYS A 514 12.960 -1.870 -5.656 1.00 0.00 H new ATOM 0 HA LYS A 514 10.088 -2.286 -5.491 1.00 0.00 H new ATOM 0 HB2 LYS A 514 12.262 -2.645 -7.552 1.00 0.00 H new ATOM 0 HB3 LYS A 514 10.737 -3.482 -7.766 1.00 0.00 H new ATOM 0 HG2 LYS A 514 10.438 -1.488 -8.960 1.00 0.00 H new ATOM 0 HG3 LYS A 514 9.613 -1.179 -7.446 1.00 0.00 H new ATOM 0 HD2 LYS A 514 10.889 0.769 -7.759 1.00 0.00 H new ATOM 0 HD3 LYS A 514 11.857 -0.159 -6.632 1.00 0.00 H new ATOM 0 HE2 LYS A 514 13.454 0.493 -8.207 1.00 0.00 H new ATOM 0 HE3 LYS A 514 13.036 -1.115 -8.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 514 13.073 0.463 -10.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 514 11.497 -0.130 -10.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 514 11.902 1.428 -9.822 1.00 0.00 H new ATOM 1080 N GLN A 515 12.264 -4.702 -5.105 1.00 0.00 N ATOM 1081 CA GLN A 515 12.420 -6.091 -4.690 1.00 0.00 C ATOM 1082 C GLN A 515 11.660 -6.360 -3.395 1.00 0.00 C ATOM 1083 O GLN A 515 10.948 -7.357 -3.278 1.00 0.00 O ATOM 1084 CB GLN A 515 13.901 -6.427 -4.506 1.00 0.00 C ATOM 1085 CG GLN A 515 14.696 -6.404 -5.801 1.00 0.00 C ATOM 1086 CD GLN A 515 13.974 -7.094 -6.942 1.00 0.00 C ATOM 1087 OE1 GLN A 515 14.078 -8.309 -7.113 1.00 0.00 O ATOM 1088 NE2 GLN A 515 13.235 -6.320 -7.729 1.00 0.00 N ATOM 0 H GLN A 515 13.139 -4.183 -5.181 1.00 0.00 H new ATOM 0 HA GLN A 515 12.005 -6.727 -5.472 1.00 0.00 H new ATOM 0 HB2 GLN A 515 14.342 -5.717 -3.806 1.00 0.00 H new ATOM 0 HB3 GLN A 515 13.987 -7.415 -4.054 1.00 0.00 H new ATOM 0 HG2 GLN A 515 14.901 -5.370 -6.078 1.00 0.00 H new ATOM 0 HG3 GLN A 515 15.659 -6.888 -5.640 1.00 0.00 H new ATOM 0 HE21 GLN A 515 13.178 -5.317 -7.550 1.00 0.00 H new ATOM 0 HE22 GLN A 515 12.725 -6.728 -8.512 1.00 0.00 H new ATOM 1097 N ASP A 516 11.818 -5.466 -2.426 1.00 0.00 N ATOM 1098 CA ASP A 516 11.146 -5.607 -1.139 1.00 0.00 C ATOM 1099 C ASP A 516 9.634 -5.483 -1.299 1.00 0.00 C ATOM 1100 O ASP A 516 8.875 -6.285 -0.756 1.00 0.00 O ATOM 1101 CB ASP A 516 11.655 -4.552 -0.156 1.00 0.00 C ATOM 1102 CG ASP A 516 13.158 -4.612 0.031 1.00 0.00 C ATOM 1103 OD1 ASP A 516 13.866 -4.915 -0.952 1.00 0.00 O ATOM 1104 OD2 ASP A 516 13.627 -4.356 1.160 1.00 0.00 O ATOM 0 H ASP A 516 12.405 -4.636 -2.507 1.00 0.00 H new ATOM 0 HA ASP A 516 11.372 -6.598 -0.746 1.00 0.00 H new ATOM 0 HB2 ASP A 516 11.376 -3.561 -0.514 1.00 0.00 H new ATOM 0 HB3 ASP A 516 11.166 -4.692 0.808 1.00 0.00 H new ATOM 1109 N ALA A 517 9.204 -4.472 -2.047 1.00 0.00 N ATOM 1110 CA ALA A 517 7.783 -4.244 -2.279 1.00 0.00 C ATOM 1111 C ALA A 517 7.082 -5.531 -2.701 1.00 0.00 C ATOM 1112 O ALA A 517 6.156 -5.993 -2.034 1.00 0.00 O ATOM 1113 CB ALA A 517 7.587 -3.165 -3.334 1.00 0.00 C ATOM 0 H ALA A 517 9.819 -3.798 -2.503 1.00 0.00 H new ATOM 0 HA ALA A 517 7.337 -3.908 -1.343 1.00 0.00 H new ATOM 0 HB1 ALA A 517 6.521 -3.005 -3.497 1.00 0.00 H new ATOM 0 HB2 ALA A 517 8.045 -2.236 -2.994 1.00 0.00 H new ATOM 0 HB3 ALA A 517 8.054 -3.480 -4.267 1.00 0.00 H new ATOM 1119 N LYS A 518 7.529 -6.106 -3.812 1.00 0.00 N ATOM 1120 CA LYS A 518 6.945 -7.341 -4.323 1.00 0.00 C ATOM 1121 C LYS A 518 6.997 -8.444 -3.270 1.00 0.00 C ATOM 1122 O LYS A 518 5.985 -9.077 -2.969 1.00 0.00 O ATOM 1123 CB LYS A 518 7.682 -7.793 -5.586 1.00 0.00 C ATOM 1124 CG LYS A 518 7.341 -6.969 -6.816 1.00 0.00 C ATOM 1125 CD LYS A 518 7.847 -7.629 -8.088 1.00 0.00 C ATOM 1126 CE LYS A 518 9.308 -7.296 -8.346 1.00 0.00 C ATOM 1127 NZ LYS A 518 10.004 -8.386 -9.084 1.00 0.00 N ATOM 0 H LYS A 518 8.294 -5.737 -4.376 1.00 0.00 H new ATOM 0 HA LYS A 518 5.901 -7.146 -4.568 1.00 0.00 H new ATOM 0 HB2 LYS A 518 8.756 -7.739 -5.409 1.00 0.00 H new ATOM 0 HB3 LYS A 518 7.443 -8.838 -5.782 1.00 0.00 H new ATOM 0 HG2 LYS A 518 6.261 -6.837 -6.879 1.00 0.00 H new ATOM 0 HG3 LYS A 518 7.779 -5.975 -6.722 1.00 0.00 H new ATOM 0 HD2 LYS A 518 7.727 -8.710 -8.011 1.00 0.00 H new ATOM 0 HD3 LYS A 518 7.243 -7.301 -8.934 1.00 0.00 H new ATOM 0 HE2 LYS A 518 9.374 -6.371 -8.918 1.00 0.00 H new ATOM 0 HE3 LYS A 518 9.813 -7.120 -7.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 518 10.997 -8.120 -9.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 518 9.964 -9.263 -8.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 518 9.538 -8.537 -10.001 1.00 0.00 H new ATOM 1141 N LYS A 519 8.182 -8.667 -2.712 1.00 0.00 N ATOM 1142 CA LYS A 519 8.366 -9.691 -1.691 1.00 0.00 C ATOM 1143 C LYS A 519 7.296 -9.580 -0.609 1.00 0.00 C ATOM 1144 O LYS A 519 6.595 -10.547 -0.314 1.00 0.00 O ATOM 1145 CB LYS A 519 9.756 -9.570 -1.062 1.00 0.00 C ATOM 1146 CG LYS A 519 10.825 -10.366 -1.792 1.00 0.00 C ATOM 1147 CD LYS A 519 12.217 -10.023 -1.287 1.00 0.00 C ATOM 1148 CE LYS A 519 12.483 -10.642 0.077 1.00 0.00 C ATOM 1149 NZ LYS A 519 13.832 -10.283 0.595 1.00 0.00 N ATOM 0 H LYS A 519 9.030 -8.152 -2.950 1.00 0.00 H new ATOM 0 HA LYS A 519 8.274 -10.666 -2.170 1.00 0.00 H new ATOM 0 HB2 LYS A 519 10.047 -8.520 -1.042 1.00 0.00 H new ATOM 0 HB3 LYS A 519 9.708 -9.907 -0.026 1.00 0.00 H new ATOM 0 HG2 LYS A 519 10.641 -11.432 -1.659 1.00 0.00 H new ATOM 0 HG3 LYS A 519 10.765 -10.163 -2.861 1.00 0.00 H new ATOM 0 HD2 LYS A 519 12.961 -10.377 -2.000 1.00 0.00 H new ATOM 0 HD3 LYS A 519 12.326 -8.940 -1.224 1.00 0.00 H new ATOM 0 HE2 LYS A 519 11.722 -10.307 0.782 1.00 0.00 H new ATOM 0 HE3 LYS A 519 12.398 -11.726 0.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 13.975 -10.724 1.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 14.560 -10.624 -0.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 13.905 -9.250 0.686 1.00 0.00 H new ATOM 1163 N ALA A 520 7.176 -8.393 -0.023 1.00 0.00 N ATOM 1164 CA ALA A 520 6.189 -8.154 1.023 1.00 0.00 C ATOM 1165 C ALA A 520 4.770 -8.293 0.481 1.00 0.00 C ATOM 1166 O ALA A 520 3.885 -8.818 1.157 1.00 0.00 O ATOM 1167 CB ALA A 520 6.390 -6.775 1.634 1.00 0.00 C ATOM 0 H ALA A 520 7.750 -7.582 -0.255 1.00 0.00 H new ATOM 0 HA ALA A 520 6.329 -8.907 1.799 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.646 -6.610 2.413 1.00 0.00 H new ATOM 0 HB2 ALA A 520 7.389 -6.711 2.066 1.00 0.00 H new ATOM 0 HB3 ALA A 520 6.280 -6.015 0.861 1.00 0.00 H new ATOM 1173 N PHE A 521 4.560 -7.817 -0.742 1.00 0.00 N ATOM 1174 CA PHE A 521 3.248 -7.887 -1.374 1.00 0.00 C ATOM 1175 C PHE A 521 2.760 -9.330 -1.459 1.00 0.00 C ATOM 1176 O PHE A 521 1.702 -9.671 -0.934 1.00 0.00 O ATOM 1177 CB PHE A 521 3.299 -7.271 -2.774 1.00 0.00 C ATOM 1178 CG PHE A 521 1.987 -7.327 -3.502 1.00 0.00 C ATOM 1179 CD1 PHE A 521 1.540 -8.513 -4.062 1.00 0.00 C ATOM 1180 CD2 PHE A 521 1.199 -6.194 -3.626 1.00 0.00 C ATOM 1181 CE1 PHE A 521 0.333 -8.567 -4.733 1.00 0.00 C ATOM 1182 CE2 PHE A 521 -0.009 -6.242 -4.296 1.00 0.00 C ATOM 1183 CZ PHE A 521 -0.443 -7.431 -4.850 1.00 0.00 C ATOM 0 H PHE A 521 5.281 -7.379 -1.315 1.00 0.00 H new ATOM 0 HA PHE A 521 2.547 -7.321 -0.760 1.00 0.00 H new ATOM 0 HB2 PHE A 521 3.616 -6.231 -2.693 1.00 0.00 H new ATOM 0 HB3 PHE A 521 4.055 -7.790 -3.363 1.00 0.00 H new ATOM 0 HD1 PHE A 521 2.142 -9.405 -3.973 1.00 0.00 H new ATOM 0 HD2 PHE A 521 1.533 -5.262 -3.194 1.00 0.00 H new ATOM 0 HE1 PHE A 521 -0.003 -9.498 -5.166 1.00 0.00 H new ATOM 0 HE2 PHE A 521 -0.613 -5.351 -4.386 1.00 0.00 H new ATOM 0 HZ PHE A 521 -1.387 -7.472 -5.373 1.00 0.00 H new ATOM 1193 N ASN A 522 3.542 -10.174 -2.126 1.00 0.00 N ATOM 1194 CA ASN A 522 3.190 -11.581 -2.282 1.00 0.00 C ATOM 1195 C ASN A 522 3.164 -12.288 -0.930 1.00 0.00 C ATOM 1196 O ASN A 522 2.213 -12.999 -0.608 1.00 0.00 O ATOM 1197 CB ASN A 522 4.184 -12.276 -3.215 1.00 0.00 C ATOM 1198 CG ASN A 522 3.939 -13.769 -3.311 1.00 0.00 C ATOM 1199 OD1 ASN A 522 4.495 -14.552 -2.540 1.00 0.00 O ATOM 1200 ND2 ASN A 522 3.102 -14.171 -4.261 1.00 0.00 N ATOM 0 H ASN A 522 4.423 -9.908 -2.567 1.00 0.00 H new ATOM 0 HA ASN A 522 2.193 -11.635 -2.719 1.00 0.00 H new ATOM 0 HB2 ASN A 522 4.115 -11.834 -4.209 1.00 0.00 H new ATOM 0 HB3 ASN A 522 5.198 -12.099 -2.858 1.00 0.00 H new ATOM 0 HD21 ASN A 522 2.898 -15.164 -4.374 1.00 0.00 H new ATOM 0 HD22 ASN A 522 2.664 -13.487 -4.878 1.00 0.00 H new ATOM 1207 N ALA A 523 4.216 -12.086 -0.143 1.00 0.00 N ATOM 1208 CA ALA A 523 4.313 -12.702 1.175 1.00 0.00 C ATOM 1209 C ALA A 523 3.024 -12.509 1.967 1.00 0.00 C ATOM 1210 O ALA A 523 2.405 -13.476 2.411 1.00 0.00 O ATOM 1211 CB ALA A 523 5.496 -12.128 1.940 1.00 0.00 C ATOM 0 H ALA A 523 5.013 -11.501 -0.395 1.00 0.00 H new ATOM 0 HA ALA A 523 4.468 -13.772 1.038 1.00 0.00 H new ATOM 0 HB1 ALA A 523 5.556 -12.597 2.922 1.00 0.00 H new ATOM 0 HB2 ALA A 523 6.415 -12.323 1.388 1.00 0.00 H new ATOM 0 HB3 ALA A 523 5.365 -11.052 2.059 1.00 0.00 H new ATOM 1217 N LEU A 524 2.626 -11.254 2.142 1.00 0.00 N ATOM 1218 CA LEU A 524 1.410 -10.933 2.882 1.00 0.00 C ATOM 1219 C LEU A 524 0.169 -11.301 2.076 1.00 0.00 C ATOM 1220 O LEU A 524 -0.676 -12.071 2.535 1.00 0.00 O ATOM 1221 CB LEU A 524 1.381 -9.445 3.234 1.00 0.00 C ATOM 1222 CG LEU A 524 2.512 -8.946 4.135 1.00 0.00 C ATOM 1223 CD1 LEU A 524 2.373 -7.453 4.388 1.00 0.00 C ATOM 1224 CD2 LEU A 524 2.524 -9.712 5.449 1.00 0.00 C ATOM 0 H LEU A 524 3.127 -10.442 1.782 1.00 0.00 H new ATOM 0 HA LEU A 524 1.409 -11.517 3.802 1.00 0.00 H new ATOM 0 HB2 LEU A 524 1.403 -8.872 2.307 1.00 0.00 H new ATOM 0 HB3 LEU A 524 0.431 -9.226 3.722 1.00 0.00 H new ATOM 0 HG LEU A 524 3.460 -9.121 3.627 1.00 0.00 H new ATOM 0 HD11 LEU A 524 3.186 -7.116 5.031 1.00 0.00 H new ATOM 0 HD12 LEU A 524 2.414 -6.918 3.439 1.00 0.00 H new ATOM 0 HD13 LEU A 524 1.419 -7.254 4.876 1.00 0.00 H new ATOM 0 HD21 LEU A 524 3.335 -9.344 6.077 1.00 0.00 H new ATOM 0 HD22 LEU A 524 1.573 -9.569 5.962 1.00 0.00 H new ATOM 0 HD23 LEU A 524 2.672 -10.773 5.250 1.00 0.00 H new ATOM 1236 N CYS A 525 0.066 -10.748 0.872 1.00 0.00 N ATOM 1237 CA CYS A 525 -1.072 -11.019 0.001 1.00 0.00 C ATOM 1238 C CYS A 525 -1.562 -12.452 0.176 1.00 0.00 C ATOM 1239 O CYS A 525 -2.743 -12.689 0.432 1.00 0.00 O ATOM 1240 CB CYS A 525 -0.692 -10.772 -1.460 1.00 0.00 C ATOM 1241 SG CYS A 525 -1.954 -11.286 -2.648 1.00 0.00 S ATOM 0 H CYS A 525 0.757 -10.110 0.477 1.00 0.00 H new ATOM 0 HA CYS A 525 -1.880 -10.342 0.279 1.00 0.00 H new ATOM 0 HB2 CYS A 525 -0.490 -9.710 -1.597 1.00 0.00 H new ATOM 0 HB3 CYS A 525 0.235 -11.303 -1.678 1.00 0.00 H new ATOM 0 HG CYS A 525 -1.542 -11.035 -3.855 1.00 0.00 H new ATOM 1247 N HIS A 526 -0.647 -13.406 0.035 1.00 0.00 N ATOM 1248 CA HIS A 526 -0.986 -14.818 0.177 1.00 0.00 C ATOM 1249 C HIS A 526 -2.010 -15.022 1.290 1.00 0.00 C ATOM 1250 O HIS A 526 -3.144 -15.426 1.036 1.00 0.00 O ATOM 1251 CB HIS A 526 0.271 -15.639 0.467 1.00 0.00 C ATOM 1252 CG HIS A 526 -0.004 -16.915 1.203 1.00 0.00 C ATOM 1253 ND1 HIS A 526 -0.668 -17.982 0.636 1.00 0.00 N ATOM 1254 CD2 HIS A 526 0.300 -17.291 2.467 1.00 0.00 C ATOM 1255 CE1 HIS A 526 -0.761 -18.959 1.520 1.00 0.00 C ATOM 1256 NE2 HIS A 526 -0.181 -18.565 2.640 1.00 0.00 N ATOM 0 H HIS A 526 0.335 -13.227 -0.177 1.00 0.00 H new ATOM 0 HA HIS A 526 -1.424 -15.157 -0.762 1.00 0.00 H new ATOM 0 HB2 HIS A 526 0.768 -15.872 -0.475 1.00 0.00 H new ATOM 0 HB3 HIS A 526 0.964 -15.034 1.052 1.00 0.00 H new ATOM 0 HD2 HIS A 526 0.824 -16.699 3.203 1.00 0.00 H new ATOM 0 HE1 HIS A 526 -1.231 -19.917 1.355 1.00 0.00 H new ATOM 0 HE2 HIS A 526 -0.103 -19.117 3.494 1.00 0.00 H new ATOM 1264 N SER A 527 -1.601 -14.739 2.522 1.00 0.00 N ATOM 1265 CA SER A 527 -2.481 -14.895 3.675 1.00 0.00 C ATOM 1266 C SER A 527 -2.086 -13.937 4.794 1.00 0.00 C ATOM 1267 O SER A 527 -1.048 -14.106 5.435 1.00 0.00 O ATOM 1268 CB SER A 527 -2.438 -16.338 4.183 1.00 0.00 C ATOM 1269 OG SER A 527 -3.016 -16.441 5.473 1.00 0.00 O ATOM 0 H SER A 527 -0.666 -14.400 2.748 1.00 0.00 H new ATOM 0 HA SER A 527 -3.497 -14.658 3.361 1.00 0.00 H new ATOM 0 HB2 SER A 527 -2.971 -16.987 3.489 1.00 0.00 H new ATOM 0 HB3 SER A 527 -1.405 -16.685 4.215 1.00 0.00 H new ATOM 0 HG SER A 527 -2.978 -17.373 5.775 1.00 0.00 H new ATOM 1275 N THR A 528 -2.922 -12.929 5.024 1.00 0.00 N ATOM 1276 CA THR A 528 -2.661 -11.942 6.064 1.00 0.00 C ATOM 1277 C THR A 528 -3.819 -11.867 7.053 1.00 0.00 C ATOM 1278 O THR A 528 -4.951 -11.565 6.676 1.00 0.00 O ATOM 1279 CB THR A 528 -2.421 -10.544 5.465 1.00 0.00 C ATOM 1280 OG1 THR A 528 -1.839 -10.663 4.162 1.00 0.00 O ATOM 1281 CG2 THR A 528 -1.508 -9.720 6.360 1.00 0.00 C ATOM 0 H THR A 528 -3.786 -12.775 4.504 1.00 0.00 H new ATOM 0 HA THR A 528 -1.760 -12.264 6.586 1.00 0.00 H new ATOM 0 HB THR A 528 -3.382 -10.036 5.389 1.00 0.00 H new ATOM 0 HG1 THR A 528 -1.275 -11.463 4.128 1.00 0.00 H new ATOM 0 HG21 THR A 528 -1.354 -8.737 5.916 1.00 0.00 H new ATOM 0 HG22 THR A 528 -1.967 -9.606 7.342 1.00 0.00 H new ATOM 0 HG23 THR A 528 -0.548 -10.226 6.465 1.00 0.00 H new ATOM 1289 N HIS A 529 -3.527 -12.143 8.320 1.00 0.00 N ATOM 1290 CA HIS A 529 -4.545 -12.104 9.364 1.00 0.00 C ATOM 1291 C HIS A 529 -4.214 -11.042 10.407 1.00 0.00 C ATOM 1292 O HIS A 529 -3.102 -11.001 10.936 1.00 0.00 O ATOM 1293 CB HIS A 529 -4.669 -13.473 10.035 1.00 0.00 C ATOM 1294 CG HIS A 529 -5.440 -14.469 9.225 1.00 0.00 C ATOM 1295 ND1 HIS A 529 -5.383 -14.526 7.849 1.00 0.00 N ATOM 1296 CD2 HIS A 529 -6.288 -15.453 9.606 1.00 0.00 C ATOM 1297 CE1 HIS A 529 -6.164 -15.500 7.417 1.00 0.00 C ATOM 1298 NE2 HIS A 529 -6.724 -16.079 8.464 1.00 0.00 N ATOM 0 H HIS A 529 -2.595 -12.396 8.648 1.00 0.00 H new ATOM 0 HA HIS A 529 -5.497 -11.847 8.899 1.00 0.00 H new ATOM 0 HB2 HIS A 529 -3.671 -13.867 10.226 1.00 0.00 H new ATOM 0 HB3 HIS A 529 -5.154 -13.351 11.004 1.00 0.00 H new ATOM 0 HD2 HIS A 529 -6.569 -15.700 10.619 1.00 0.00 H new ATOM 0 HE1 HIS A 529 -6.318 -15.776 6.384 1.00 0.00 H new ATOM 0 HE2 HIS A 529 -7.375 -16.864 8.430 1.00 0.00 H new ATOM 1306 N LEU A 530 -5.185 -10.183 10.699 1.00 0.00 N ATOM 1307 CA LEU A 530 -4.996 -9.119 11.678 1.00 0.00 C ATOM 1308 C LEU A 530 -6.269 -8.892 12.488 1.00 0.00 C ATOM 1309 O LEU A 530 -7.280 -8.431 11.959 1.00 0.00 O ATOM 1310 CB LEU A 530 -4.586 -7.821 10.979 1.00 0.00 C ATOM 1311 CG LEU A 530 -4.004 -6.729 11.877 1.00 0.00 C ATOM 1312 CD1 LEU A 530 -2.611 -7.113 12.350 1.00 0.00 C ATOM 1313 CD2 LEU A 530 -3.972 -5.396 11.144 1.00 0.00 C ATOM 0 H LEU A 530 -6.111 -10.203 10.272 1.00 0.00 H new ATOM 0 HA LEU A 530 -4.202 -9.424 12.360 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -3.851 -8.062 10.211 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -5.459 -7.416 10.468 1.00 0.00 H new ATOM 0 HG LEU A 530 -4.646 -6.624 12.752 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -2.213 -6.324 12.988 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -2.662 -8.044 12.914 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -1.958 -7.247 11.488 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -3.555 -4.631 11.799 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -3.353 -5.486 10.251 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -4.985 -5.115 10.856 1.00 0.00 H new ATOM 1325 N TYR A 531 -6.211 -9.218 13.775 1.00 0.00 N ATOM 1326 CA TYR A 531 -7.359 -9.051 14.658 1.00 0.00 C ATOM 1327 C TYR A 531 -8.521 -9.934 14.214 1.00 0.00 C ATOM 1328 O TYR A 531 -9.685 -9.551 14.326 1.00 0.00 O ATOM 1329 CB TYR A 531 -7.799 -7.586 14.685 1.00 0.00 C ATOM 1330 CG TYR A 531 -6.757 -6.652 15.257 1.00 0.00 C ATOM 1331 CD1 TYR A 531 -6.448 -6.668 16.611 1.00 0.00 C ATOM 1332 CD2 TYR A 531 -6.080 -5.752 14.442 1.00 0.00 C ATOM 1333 CE1 TYR A 531 -5.497 -5.816 17.138 1.00 0.00 C ATOM 1334 CE2 TYR A 531 -5.126 -4.897 14.959 1.00 0.00 C ATOM 1335 CZ TYR A 531 -4.839 -4.932 16.308 1.00 0.00 C ATOM 1336 OH TYR A 531 -3.890 -4.082 16.828 1.00 0.00 O ATOM 0 H TYR A 531 -5.381 -9.599 14.229 1.00 0.00 H new ATOM 0 HA TYR A 531 -7.060 -9.353 15.662 1.00 0.00 H new ATOM 0 HB2 TYR A 531 -8.041 -7.269 13.671 1.00 0.00 H new ATOM 0 HB3 TYR A 531 -8.713 -7.501 15.272 1.00 0.00 H new ATOM 0 HD1 TYR A 531 -6.961 -7.359 17.264 1.00 0.00 H new ATOM 0 HD2 TYR A 531 -6.304 -5.721 13.386 1.00 0.00 H new ATOM 0 HE1 TYR A 531 -5.270 -5.842 18.194 1.00 0.00 H new ATOM 0 HE2 TYR A 531 -4.608 -4.205 14.311 1.00 0.00 H new ATOM 0 HH TYR A 531 -3.462 -4.504 17.602 1.00 0.00 H new ATOM 1346 N GLY A 532 -8.195 -11.121 13.711 1.00 0.00 N ATOM 1347 CA GLY A 532 -9.222 -12.042 13.259 1.00 0.00 C ATOM 1348 C GLY A 532 -9.892 -11.580 11.980 1.00 0.00 C ATOM 1349 O GLY A 532 -11.066 -11.868 11.748 1.00 0.00 O ATOM 0 H GLY A 532 -7.239 -11.461 13.608 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -8.779 -13.025 13.099 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -9.974 -12.154 14.040 1.00 0.00 H new ATOM 1353 N ARG A 533 -9.144 -10.862 11.148 1.00 0.00 N ATOM 1354 CA ARG A 533 -9.674 -10.357 9.887 1.00 0.00 C ATOM 1355 C ARG A 533 -8.598 -10.359 8.805 1.00 0.00 C ATOM 1356 O ARG A 533 -7.440 -10.035 9.068 1.00 0.00 O ATOM 1357 CB ARG A 533 -10.224 -8.941 10.071 1.00 0.00 C ATOM 1358 CG ARG A 533 -11.247 -8.825 11.189 1.00 0.00 C ATOM 1359 CD ARG A 533 -12.211 -7.675 10.945 1.00 0.00 C ATOM 1360 NE ARG A 533 -13.520 -7.922 11.544 1.00 0.00 N ATOM 1361 CZ ARG A 533 -14.334 -8.898 11.155 1.00 0.00 C ATOM 1362 NH1 ARG A 533 -13.974 -9.713 10.173 1.00 0.00 N ATOM 1363 NH2 ARG A 533 -15.510 -9.059 11.748 1.00 0.00 N ATOM 0 H ARG A 533 -8.170 -10.617 11.324 1.00 0.00 H new ATOM 0 HA ARG A 533 -10.483 -11.016 9.572 1.00 0.00 H new ATOM 0 HB2 ARG A 533 -9.396 -8.263 10.276 1.00 0.00 H new ATOM 0 HB3 ARG A 533 -10.681 -8.614 9.137 1.00 0.00 H new ATOM 0 HG2 ARG A 533 -11.805 -9.758 11.271 1.00 0.00 H new ATOM 0 HG3 ARG A 533 -10.734 -8.676 12.139 1.00 0.00 H new ATOM 0 HD2 ARG A 533 -11.792 -6.757 11.356 1.00 0.00 H new ATOM 0 HD3 ARG A 533 -12.327 -7.520 9.872 1.00 0.00 H new ATOM 0 HE ARG A 533 -13.826 -7.312 12.302 1.00 0.00 H new ATOM 0 HH11 ARG A 533 -13.071 -9.592 9.715 1.00 0.00 H new ATOM 0 HH12 ARG A 533 -14.600 -10.461 9.876 1.00 0.00 H new ATOM 0 HH21 ARG A 533 -15.790 -8.433 12.503 1.00 0.00 H new ATOM 0 HH22 ARG A 533 -16.134 -9.808 11.449 1.00 0.00 H new ATOM 1377 N ARG A 534 -8.989 -10.728 7.590 1.00 0.00 N ATOM 1378 CA ARG A 534 -8.058 -10.774 6.469 1.00 0.00 C ATOM 1379 C ARG A 534 -7.945 -9.408 5.799 1.00 0.00 C ATOM 1380 O ARG A 534 -8.908 -8.641 5.762 1.00 0.00 O ATOM 1381 CB ARG A 534 -8.509 -11.820 5.447 1.00 0.00 C ATOM 1382 CG ARG A 534 -7.875 -13.186 5.654 1.00 0.00 C ATOM 1383 CD ARG A 534 -6.591 -13.332 4.852 1.00 0.00 C ATOM 1384 NE ARG A 534 -6.855 -13.569 3.435 1.00 0.00 N ATOM 1385 CZ ARG A 534 -7.247 -14.740 2.947 1.00 0.00 C ATOM 1386 NH1 ARG A 534 -7.421 -15.775 3.757 1.00 0.00 N ATOM 1387 NH2 ARG A 534 -7.467 -14.877 1.645 1.00 0.00 N ATOM 0 H ARG A 534 -9.944 -10.999 7.357 1.00 0.00 H new ATOM 0 HA ARG A 534 -7.077 -11.052 6.855 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -9.593 -11.921 5.497 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -8.268 -11.465 4.445 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -7.662 -13.333 6.713 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -8.580 -13.964 5.359 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -5.990 -12.430 4.963 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -6.004 -14.158 5.254 1.00 0.00 H new ATOM 0 HE ARG A 534 -6.731 -12.793 2.785 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -7.254 -15.673 4.758 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -7.722 -16.673 3.379 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -7.335 -14.083 1.019 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -7.768 -15.777 1.271 1.00 0.00 H new ATOM 1401 N LEU A 535 -6.764 -9.111 5.270 1.00 0.00 N ATOM 1402 CA LEU A 535 -6.524 -7.837 4.601 1.00 0.00 C ATOM 1403 C LEU A 535 -6.328 -8.037 3.102 1.00 0.00 C ATOM 1404 O LEU A 535 -5.572 -8.910 2.675 1.00 0.00 O ATOM 1405 CB LEU A 535 -5.297 -7.147 5.199 1.00 0.00 C ATOM 1406 CG LEU A 535 -5.347 -6.874 6.703 1.00 0.00 C ATOM 1407 CD1 LEU A 535 -3.947 -6.640 7.250 1.00 0.00 C ATOM 1408 CD2 LEU A 535 -6.244 -5.680 6.999 1.00 0.00 C ATOM 0 H LEU A 535 -5.957 -9.735 5.291 1.00 0.00 H new ATOM 0 HA LEU A 535 -7.399 -7.205 4.753 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -4.422 -7.762 4.991 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -5.151 -6.198 4.682 1.00 0.00 H new ATOM 0 HG LEU A 535 -5.767 -7.750 7.198 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -4.002 -6.447 8.321 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -3.334 -7.524 7.071 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -3.500 -5.781 6.750 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -6.268 -5.500 8.074 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -5.854 -4.797 6.492 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -7.253 -5.886 6.643 1.00 0.00 H new ATOM 1420 N VAL A 536 -7.013 -7.222 2.306 1.00 0.00 N ATOM 1421 CA VAL A 536 -6.912 -7.307 0.854 1.00 0.00 C ATOM 1422 C VAL A 536 -5.783 -6.428 0.329 1.00 0.00 C ATOM 1423 O VAL A 536 -5.858 -5.200 0.389 1.00 0.00 O ATOM 1424 CB VAL A 536 -8.230 -6.891 0.174 1.00 0.00 C ATOM 1425 CG1 VAL A 536 -8.116 -7.020 -1.337 1.00 0.00 C ATOM 1426 CG2 VAL A 536 -9.388 -7.725 0.702 1.00 0.00 C ATOM 0 H VAL A 536 -7.644 -6.495 2.643 1.00 0.00 H new ATOM 0 HA VAL A 536 -6.700 -8.349 0.612 1.00 0.00 H new ATOM 0 HB VAL A 536 -8.426 -5.845 0.411 1.00 0.00 H new ATOM 0 HG11 VAL A 536 -9.057 -6.722 -1.800 1.00 0.00 H new ATOM 0 HG12 VAL A 536 -7.314 -6.376 -1.698 1.00 0.00 H new ATOM 0 HG13 VAL A 536 -7.895 -8.055 -1.598 1.00 0.00 H new ATOM 0 HG21 VAL A 536 -10.311 -7.418 0.211 1.00 0.00 H new ATOM 0 HG22 VAL A 536 -9.201 -8.779 0.496 1.00 0.00 H new ATOM 0 HG23 VAL A 536 -9.483 -7.577 1.778 1.00 0.00 H new ATOM 1436 N LEU A 537 -4.736 -7.064 -0.186 1.00 0.00 N ATOM 1437 CA LEU A 537 -3.590 -6.340 -0.723 1.00 0.00 C ATOM 1438 C LEU A 537 -3.680 -6.225 -2.241 1.00 0.00 C ATOM 1439 O LEU A 537 -3.690 -7.231 -2.949 1.00 0.00 O ATOM 1440 CB LEU A 537 -2.289 -7.042 -0.330 1.00 0.00 C ATOM 1441 CG LEU A 537 -1.689 -6.639 1.017 1.00 0.00 C ATOM 1442 CD1 LEU A 537 -2.226 -7.527 2.128 1.00 0.00 C ATOM 1443 CD2 LEU A 537 -0.169 -6.706 0.966 1.00 0.00 C ATOM 0 H LEU A 537 -4.658 -8.079 -0.243 1.00 0.00 H new ATOM 0 HA LEU A 537 -3.596 -5.335 -0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -2.469 -8.117 -0.318 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -1.548 -6.852 -1.107 1.00 0.00 H new ATOM 0 HG LEU A 537 -1.981 -5.610 1.229 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -1.788 -7.225 3.079 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -3.310 -7.428 2.181 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -1.966 -8.565 1.922 1.00 0.00 H new ATOM 0 HD21 LEU A 537 0.241 -6.416 1.934 1.00 0.00 H new ATOM 0 HD22 LEU A 537 0.143 -7.724 0.730 1.00 0.00 H new ATOM 0 HD23 LEU A 537 0.200 -6.027 0.197 1.00 0.00 H new ATOM 1455 N GLU A 538 -3.745 -4.992 -2.734 1.00 0.00 N ATOM 1456 CA GLU A 538 -3.833 -4.747 -4.168 1.00 0.00 C ATOM 1457 C GLU A 538 -2.946 -3.574 -4.576 1.00 0.00 C ATOM 1458 O GLU A 538 -2.774 -2.619 -3.818 1.00 0.00 O ATOM 1459 CB GLU A 538 -5.283 -4.468 -4.572 1.00 0.00 C ATOM 1460 CG GLU A 538 -6.077 -5.723 -4.893 1.00 0.00 C ATOM 1461 CD GLU A 538 -5.379 -6.613 -5.903 1.00 0.00 C ATOM 1462 OE1 GLU A 538 -4.581 -7.476 -5.482 1.00 0.00 O ATOM 1463 OE2 GLU A 538 -5.631 -6.446 -7.115 1.00 0.00 O ATOM 0 H GLU A 538 -3.738 -4.148 -2.161 1.00 0.00 H new ATOM 0 HA GLU A 538 -3.484 -5.641 -4.685 1.00 0.00 H new ATOM 0 HB2 GLU A 538 -5.780 -3.931 -3.764 1.00 0.00 H new ATOM 0 HB3 GLU A 538 -5.289 -3.812 -5.442 1.00 0.00 H new ATOM 0 HG2 GLU A 538 -6.247 -6.286 -3.975 1.00 0.00 H new ATOM 0 HG3 GLU A 538 -7.056 -5.440 -5.279 1.00 0.00 H new ATOM 1470 N TRP A 539 -2.384 -3.654 -5.776 1.00 0.00 N ATOM 1471 CA TRP A 539 -1.514 -2.600 -6.285 1.00 0.00 C ATOM 1472 C TRP A 539 -2.319 -1.359 -6.653 1.00 0.00 C ATOM 1473 O TRP A 539 -2.974 -1.319 -7.694 1.00 0.00 O ATOM 1474 CB TRP A 539 -0.735 -3.097 -7.503 1.00 0.00 C ATOM 1475 CG TRP A 539 0.144 -4.275 -7.207 1.00 0.00 C ATOM 1476 CD1 TRP A 539 -0.159 -5.592 -7.399 1.00 0.00 C ATOM 1477 CD2 TRP A 539 1.468 -4.240 -6.663 1.00 0.00 C ATOM 1478 NE1 TRP A 539 0.898 -6.379 -7.008 1.00 0.00 N ATOM 1479 CE2 TRP A 539 1.908 -5.574 -6.553 1.00 0.00 C ATOM 1480 CE3 TRP A 539 2.325 -3.213 -6.260 1.00 0.00 C ATOM 1481 CZ2 TRP A 539 3.166 -5.904 -6.056 1.00 0.00 C ATOM 1482 CZ3 TRP A 539 3.574 -3.542 -5.767 1.00 0.00 C ATOM 1483 CH2 TRP A 539 3.985 -4.878 -5.669 1.00 0.00 C ATOM 0 H TRP A 539 -2.515 -4.438 -6.415 1.00 0.00 H new ATOM 0 HA TRP A 539 -0.810 -2.333 -5.497 1.00 0.00 H new ATOM 0 HB2 TRP A 539 -1.439 -3.367 -8.290 1.00 0.00 H new ATOM 0 HB3 TRP A 539 -0.122 -2.283 -7.890 1.00 0.00 H new ATOM 0 HD1 TRP A 539 -1.092 -5.961 -7.799 1.00 0.00 H new ATOM 0 HE1 TRP A 539 0.926 -7.398 -7.050 1.00 0.00 H new ATOM 0 HE3 TRP A 539 2.017 -2.180 -6.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 539 3.484 -6.933 -5.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 539 4.244 -2.756 -5.452 1.00 0.00 H new ATOM 0 HH2 TRP A 539 4.967 -5.103 -5.280 1.00 0.00 H new ATOM 1494 N ALA A 540 -2.266 -0.348 -5.792 1.00 0.00 N ATOM 1495 CA ALA A 540 -2.989 0.896 -6.029 1.00 0.00 C ATOM 1496 C ALA A 540 -2.897 1.315 -7.492 1.00 0.00 C ATOM 1497 O ALA A 540 -1.894 1.060 -8.158 1.00 0.00 O ATOM 1498 CB ALA A 540 -2.453 1.998 -5.127 1.00 0.00 C ATOM 0 H ALA A 540 -1.730 -0.366 -4.924 1.00 0.00 H new ATOM 0 HA ALA A 540 -4.040 0.727 -5.793 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -3.002 2.921 -5.315 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -2.578 1.707 -4.084 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -1.395 2.156 -5.335 1.00 0.00 H new ATOM 1504 N ASP A 541 -3.950 1.957 -7.986 1.00 0.00 N ATOM 1505 CA ASP A 541 -3.987 2.412 -9.371 1.00 0.00 C ATOM 1506 C ASP A 541 -2.846 3.384 -9.655 1.00 0.00 C ATOM 1507 O ASP A 541 -2.620 4.328 -8.898 1.00 0.00 O ATOM 1508 CB ASP A 541 -5.330 3.078 -9.676 1.00 0.00 C ATOM 1509 CG ASP A 541 -5.630 4.231 -8.738 1.00 0.00 C ATOM 1510 OD1 ASP A 541 -5.624 4.012 -7.509 1.00 0.00 O ATOM 1511 OD2 ASP A 541 -5.870 5.352 -9.234 1.00 0.00 O ATOM 0 H ASP A 541 -4.789 2.174 -7.448 1.00 0.00 H new ATOM 0 HA ASP A 541 -3.867 1.542 -10.017 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -5.327 3.441 -10.704 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -6.125 2.336 -9.602 1.00 0.00 H new ATOM 1516 N SER A 542 -2.131 3.146 -10.749 1.00 0.00 N ATOM 1517 CA SER A 542 -1.010 3.998 -11.130 1.00 0.00 C ATOM 1518 C SER A 542 -1.503 5.353 -11.628 1.00 0.00 C ATOM 1519 O SER A 542 -2.227 5.436 -12.620 1.00 0.00 O ATOM 1520 CB SER A 542 -0.171 3.318 -12.214 1.00 0.00 C ATOM 1521 OG SER A 542 0.352 2.084 -11.755 1.00 0.00 O ATOM 0 H SER A 542 -2.307 2.370 -11.388 1.00 0.00 H new ATOM 0 HA SER A 542 -0.390 4.158 -10.248 1.00 0.00 H new ATOM 0 HB2 SER A 542 -0.783 3.150 -13.100 1.00 0.00 H new ATOM 0 HB3 SER A 542 0.646 3.975 -12.511 1.00 0.00 H new ATOM 0 HG SER A 542 0.883 1.669 -12.467 1.00 0.00 H new ATOM 1527 N GLU A 543 -1.105 6.413 -10.931 1.00 0.00 N ATOM 1528 CA GLU A 543 -1.506 7.765 -11.302 1.00 0.00 C ATOM 1529 C GLU A 543 -0.383 8.482 -12.045 1.00 0.00 C ATOM 1530 O GLU A 543 0.774 8.448 -11.626 1.00 0.00 O ATOM 1531 CB GLU A 543 -1.900 8.563 -10.057 1.00 0.00 C ATOM 1532 CG GLU A 543 -3.220 8.126 -9.446 1.00 0.00 C ATOM 1533 CD GLU A 543 -3.853 9.206 -8.590 1.00 0.00 C ATOM 1534 OE1 GLU A 543 -4.053 10.328 -9.101 1.00 0.00 O ATOM 1535 OE2 GLU A 543 -4.149 8.928 -7.409 1.00 0.00 O ATOM 0 H GLU A 543 -0.506 6.362 -10.107 1.00 0.00 H new ATOM 0 HA GLU A 543 -2.367 7.692 -11.966 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -1.113 8.465 -9.309 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -1.962 9.620 -10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -3.910 7.848 -10.242 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -3.058 7.235 -8.839 1.00 0.00 H new ATOM 1542 N VAL A 544 -0.733 9.130 -13.152 1.00 0.00 N ATOM 1543 CA VAL A 544 0.245 9.856 -13.954 1.00 0.00 C ATOM 1544 C VAL A 544 0.101 11.362 -13.766 1.00 0.00 C ATOM 1545 O VAL A 544 -0.987 11.918 -13.921 1.00 0.00 O ATOM 1546 CB VAL A 544 0.102 9.521 -15.451 1.00 0.00 C ATOM 1547 CG1 VAL A 544 -1.256 9.967 -15.971 1.00 0.00 C ATOM 1548 CG2 VAL A 544 1.226 10.163 -16.250 1.00 0.00 C ATOM 0 H VAL A 544 -1.686 9.167 -13.514 1.00 0.00 H new ATOM 0 HA VAL A 544 1.231 9.543 -13.611 1.00 0.00 H new ATOM 0 HB VAL A 544 0.173 8.440 -15.572 1.00 0.00 H new ATOM 0 HG11 VAL A 544 -1.338 9.722 -17.030 1.00 0.00 H new ATOM 0 HG12 VAL A 544 -2.043 9.455 -15.418 1.00 0.00 H new ATOM 0 HG13 VAL A 544 -1.361 11.044 -15.839 1.00 0.00 H new ATOM 0 HG21 VAL A 544 1.109 9.916 -17.305 1.00 0.00 H new ATOM 0 HG22 VAL A 544 1.190 11.245 -16.124 1.00 0.00 H new ATOM 0 HG23 VAL A 544 2.186 9.789 -15.894 1.00 0.00 H new ATOM 1558 N THR A 545 1.207 12.019 -13.430 1.00 0.00 N ATOM 1559 CA THR A 545 1.204 13.461 -13.220 1.00 0.00 C ATOM 1560 C THR A 545 2.440 14.108 -13.835 1.00 0.00 C ATOM 1561 O THR A 545 3.555 13.935 -13.342 1.00 0.00 O ATOM 1562 CB THR A 545 1.149 13.810 -11.720 1.00 0.00 C ATOM 1563 OG1 THR A 545 1.356 15.215 -11.536 1.00 0.00 O ATOM 1564 CG2 THR A 545 2.201 13.031 -10.944 1.00 0.00 C ATOM 0 H THR A 545 2.116 11.575 -13.298 1.00 0.00 H new ATOM 0 HA THR A 545 0.311 13.850 -13.709 1.00 0.00 H new ATOM 0 HB THR A 545 0.164 13.536 -11.342 1.00 0.00 H new ATOM 0 HG1 THR A 545 1.318 15.429 -10.580 1.00 0.00 H new ATOM 0 HG21 THR A 545 2.143 13.294 -9.888 1.00 0.00 H new ATOM 0 HG22 THR A 545 2.023 11.962 -11.062 1.00 0.00 H new ATOM 0 HG23 THR A 545 3.192 13.278 -11.325 1.00 0.00 H new ATOM 1572 N VAL A 546 2.235 14.855 -14.915 1.00 0.00 N ATOM 1573 CA VAL A 546 3.333 15.531 -15.597 1.00 0.00 C ATOM 1574 C VAL A 546 4.601 14.685 -15.569 1.00 0.00 C ATOM 1575 O VAL A 546 5.701 15.205 -15.387 1.00 0.00 O ATOM 1576 CB VAL A 546 3.629 16.902 -14.962 1.00 0.00 C ATOM 1577 CG1 VAL A 546 2.413 17.811 -15.061 1.00 0.00 C ATOM 1578 CG2 VAL A 546 4.064 16.735 -13.514 1.00 0.00 C ATOM 0 H VAL A 546 1.319 15.008 -15.337 1.00 0.00 H new ATOM 0 HA VAL A 546 3.021 15.678 -16.631 1.00 0.00 H new ATOM 0 HB VAL A 546 4.446 17.369 -15.512 1.00 0.00 H new ATOM 0 HG11 VAL A 546 2.642 18.775 -14.607 1.00 0.00 H new ATOM 0 HG12 VAL A 546 2.152 17.956 -16.109 1.00 0.00 H new ATOM 0 HG13 VAL A 546 1.573 17.354 -14.538 1.00 0.00 H new ATOM 0 HG21 VAL A 546 4.269 17.714 -13.081 1.00 0.00 H new ATOM 0 HG22 VAL A 546 3.269 16.247 -12.949 1.00 0.00 H new ATOM 0 HG23 VAL A 546 4.966 16.124 -13.473 1.00 0.00 H new ATOM 1588 N GLN A 547 4.438 13.378 -15.750 1.00 0.00 N ATOM 1589 CA GLN A 547 5.571 12.460 -15.745 1.00 0.00 C ATOM 1590 C GLN A 547 5.960 12.067 -17.167 1.00 0.00 C ATOM 1591 O GLN A 547 5.232 11.338 -17.841 1.00 0.00 O ATOM 1592 CB GLN A 547 5.236 11.209 -14.931 1.00 0.00 C ATOM 1593 CG GLN A 547 5.492 11.366 -13.441 1.00 0.00 C ATOM 1594 CD GLN A 547 6.964 11.284 -13.090 1.00 0.00 C ATOM 1595 OE1 GLN A 547 7.816 11.136 -13.966 1.00 0.00 O ATOM 1596 NE2 GLN A 547 7.272 11.381 -11.801 1.00 0.00 N ATOM 0 H GLN A 547 3.533 12.932 -15.902 1.00 0.00 H new ATOM 0 HA GLN A 547 6.417 12.969 -15.284 1.00 0.00 H new ATOM 0 HB2 GLN A 547 4.188 10.955 -15.086 1.00 0.00 H new ATOM 0 HB3 GLN A 547 5.826 10.373 -15.306 1.00 0.00 H new ATOM 0 HG2 GLN A 547 5.096 12.325 -13.107 1.00 0.00 H new ATOM 0 HG3 GLN A 547 4.950 10.591 -12.899 1.00 0.00 H new ATOM 0 HE21 GLN A 547 6.534 11.503 -11.108 1.00 0.00 H new ATOM 0 HE22 GLN A 547 8.247 11.333 -11.505 1.00 0.00 H new ATOM 1605 N SER A 548 7.111 12.556 -17.617 1.00 0.00 N ATOM 1606 CA SER A 548 7.594 12.260 -18.960 1.00 0.00 C ATOM 1607 C SER A 548 9.058 11.829 -18.928 1.00 0.00 C ATOM 1608 O SER A 548 9.446 10.861 -19.580 1.00 0.00 O ATOM 1609 CB SER A 548 7.431 13.482 -19.865 1.00 0.00 C ATOM 1610 OG SER A 548 7.633 13.140 -21.225 1.00 0.00 O ATOM 0 H SER A 548 7.726 13.159 -17.071 1.00 0.00 H new ATOM 0 HA SER A 548 6.999 11.439 -19.360 1.00 0.00 H new ATOM 0 HB2 SER A 548 6.434 13.903 -19.737 1.00 0.00 H new ATOM 0 HB3 SER A 548 8.143 14.254 -19.571 1.00 0.00 H new ATOM 0 HG SER A 548 7.522 13.938 -21.783 1.00 0.00 H new ATOM 1616 N GLY A 549 9.866 12.557 -18.163 1.00 0.00 N ATOM 1617 CA GLY A 549 11.277 12.236 -18.059 1.00 0.00 C ATOM 1618 C GLY A 549 12.089 12.816 -19.200 1.00 0.00 C ATOM 1619 O GLY A 549 12.377 12.142 -20.190 1.00 0.00 O ATOM 0 H GLY A 549 9.568 13.363 -17.614 1.00 0.00 H new ATOM 0 HA2 GLY A 549 11.664 12.614 -17.113 1.00 0.00 H new ATOM 0 HA3 GLY A 549 11.400 11.153 -18.043 1.00 0.00 H new ATOM 1623 N PRO A 550 12.471 14.095 -19.070 1.00 0.00 N ATOM 1624 CA PRO A 550 13.259 14.793 -20.090 1.00 0.00 C ATOM 1625 C PRO A 550 14.689 14.273 -20.175 1.00 0.00 C ATOM 1626 O PRO A 550 15.285 13.900 -19.165 1.00 0.00 O ATOM 1627 CB PRO A 550 13.246 16.248 -19.614 1.00 0.00 C ATOM 1628 CG PRO A 550 13.035 16.162 -18.141 1.00 0.00 C ATOM 1629 CD PRO A 550 12.163 14.958 -17.917 1.00 0.00 C ATOM 0 HA PRO A 550 12.847 14.653 -21.089 1.00 0.00 H new ATOM 0 HB2 PRO A 550 14.184 16.751 -19.851 1.00 0.00 H new ATOM 0 HB3 PRO A 550 12.450 16.815 -20.096 1.00 0.00 H new ATOM 0 HG2 PRO A 550 13.985 16.059 -17.616 1.00 0.00 H new ATOM 0 HG3 PRO A 550 12.558 17.066 -17.762 1.00 0.00 H new ATOM 0 HD2 PRO A 550 12.394 14.465 -16.973 1.00 0.00 H new ATOM 0 HD3 PRO A 550 11.107 15.227 -17.887 1.00 0.00 H new ATOM 1637 N SER A 551 15.236 14.251 -21.387 1.00 0.00 N ATOM 1638 CA SER A 551 16.596 13.772 -21.603 1.00 0.00 C ATOM 1639 C SER A 551 17.577 14.939 -21.676 1.00 0.00 C ATOM 1640 O SER A 551 18.492 15.046 -20.860 1.00 0.00 O ATOM 1641 CB SER A 551 16.670 12.948 -22.890 1.00 0.00 C ATOM 1642 OG SER A 551 15.745 11.875 -22.862 1.00 0.00 O ATOM 0 H SER A 551 14.758 14.559 -22.234 1.00 0.00 H new ATOM 0 HA SER A 551 16.871 13.140 -20.759 1.00 0.00 H new ATOM 0 HB2 SER A 551 16.463 13.588 -23.748 1.00 0.00 H new ATOM 0 HB3 SER A 551 17.680 12.559 -23.019 1.00 0.00 H new ATOM 0 HG SER A 551 15.811 11.365 -23.696 1.00 0.00 H new ATOM 1648 N SER A 552 17.379 15.810 -22.660 1.00 0.00 N ATOM 1649 CA SER A 552 18.247 16.967 -22.843 1.00 0.00 C ATOM 1650 C SER A 552 18.076 17.961 -21.699 1.00 0.00 C ATOM 1651 O SER A 552 17.195 17.807 -20.854 1.00 0.00 O ATOM 1652 CB SER A 552 17.946 17.651 -24.178 1.00 0.00 C ATOM 1653 OG SER A 552 16.602 18.100 -24.229 1.00 0.00 O ATOM 0 H SER A 552 16.625 15.736 -23.343 1.00 0.00 H new ATOM 0 HA SER A 552 19.280 16.618 -22.846 1.00 0.00 H new ATOM 0 HB2 SER A 552 18.621 18.496 -24.318 1.00 0.00 H new ATOM 0 HB3 SER A 552 18.132 16.956 -24.997 1.00 0.00 H new ATOM 0 HG SER A 552 16.435 18.535 -25.091 1.00 0.00 H new ATOM 1659 N GLY A 553 18.926 18.983 -21.679 1.00 0.00 N ATOM 1660 CA GLY A 553 18.854 19.988 -20.634 1.00 0.00 C ATOM 1661 C GLY A 553 19.566 21.271 -21.014 1.00 0.00 C ATOM 1662 O GLY A 553 20.709 21.242 -21.470 1.00 0.00 O ATOM 0 H GLY A 553 19.663 19.133 -22.368 1.00 0.00 H new ATOM 0 HA2 GLY A 553 17.809 20.207 -20.416 1.00 0.00 H new ATOM 0 HA3 GLY A 553 19.293 19.589 -19.720 1.00 0.00 H new TER 1666 GLY A 553