USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=25 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=-0.00778 USER MOD Single : A 449 SER OG : rot 180:sc= 0 USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 452 SER OG : rot 14:sc= 0.362 USER MOD Single : A 454 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 457 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 LYS NZ :NH3+ 172:sc=-0.00574 (180deg=-0.0907) USER MOD Single : A 459 GLN : amide:sc= 0 X(o=0,f=-0.0027) USER MOD Single : A 460 THR OG1 : rot 180:sc= 0.00627 USER MOD Single : A 461 THR OG1 : rot 180:sc= -0.439 USER MOD Single : A 462 SER OG : rot 52:sc= 0.158 USER MOD Single : A 463 LYS NZ :NH3+ -107:sc= -0.848 (180deg=-2.81!) USER MOD Single : A 468 ASN : amide:sc= 0.852 K(o=0.85,f=-0.11) USER MOD Single : A 472 GLN : amide:sc= -0.771 X(o=-0.77,f=-0.5) USER MOD Single : A 474 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 475 GLN : amide:sc= -0.0323 K(o=-0.032,f=-1.5) USER MOD Single : A 483 SER OG : rot 106:sc= -0.0425 USER MOD Single : A 484 THR OG1 : rot 180:sc= 0 USER MOD Single : A 489 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 60:sc= 0.647 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 503 HIS : no HD1:sc= -2.73! K(o=-2.7!,f=-3.4) USER MOD Single : A 513 THR OG1 : rot -54:sc= 0.43 USER MOD Single : A 514 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 515 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 518 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.323) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 522 ASN : amide:sc= -2.27! C(o=-2.3!,f=-5.8!) USER MOD Single : A 525 CYS SG : rot 180:sc= 0 USER MOD Single : A 526 HIS : no HD1:sc= -0.0911 X(o=-0.091,f=0) USER MOD Single : A 527 SER OG : rot 21:sc= 1.21 USER MOD Single : A 528 THR OG1 : rot 19:sc= -0.447 USER MOD Single : A 529 HIS : no HD1:sc= -1.35 K(o=-1.3,f=-5!) USER MOD Single : A 531 TYR OH : rot 126:sc= 0.0819 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= -0.066 X(o=-0.066,f=0) 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 -6.605 -33.410 -4.462 1.00 0.00 N ATOM 2 CA GLY A 447 -7.302 -32.280 -5.048 1.00 0.00 C ATOM 3 C GLY A 447 -6.494 -31.600 -6.135 1.00 0.00 C ATOM 4 O GLY A 447 -5.280 -31.786 -6.224 1.00 0.00 O ATOM 0 HA2 GLY A 447 -8.251 -32.618 -5.463 1.00 0.00 H new ATOM 0 HA3 GLY A 447 -7.536 -31.557 -4.267 1.00 0.00 H new ATOM 8 N SER A 448 -7.167 -30.812 -6.966 1.00 0.00 N ATOM 9 CA SER A 448 -6.505 -30.107 -8.057 1.00 0.00 C ATOM 10 C SER A 448 -7.262 -28.833 -8.420 1.00 0.00 C ATOM 11 O SER A 448 -8.489 -28.782 -8.336 1.00 0.00 O ATOM 12 CB SER A 448 -6.391 -31.013 -9.284 1.00 0.00 C ATOM 13 OG SER A 448 -5.565 -32.134 -9.015 1.00 0.00 O ATOM 0 H SER A 448 -8.171 -30.645 -6.905 1.00 0.00 H new ATOM 0 HA SER A 448 -5.504 -29.832 -7.724 1.00 0.00 H new ATOM 0 HB2 SER A 448 -7.383 -31.352 -9.584 1.00 0.00 H new ATOM 0 HB3 SER A 448 -5.981 -30.448 -10.121 1.00 0.00 H new ATOM 0 HG SER A 448 -5.509 -32.699 -9.814 1.00 0.00 H new ATOM 19 N SER A 449 -6.521 -27.807 -8.825 1.00 0.00 N ATOM 20 CA SER A 449 -7.121 -26.531 -9.198 1.00 0.00 C ATOM 21 C SER A 449 -6.255 -25.801 -10.219 1.00 0.00 C ATOM 22 O SER A 449 -5.182 -26.275 -10.592 1.00 0.00 O ATOM 23 CB SER A 449 -7.319 -25.654 -7.960 1.00 0.00 C ATOM 24 OG SER A 449 -6.073 -25.257 -7.413 1.00 0.00 O ATOM 0 H SER A 449 -5.504 -27.834 -8.903 1.00 0.00 H new ATOM 0 HA SER A 449 -8.092 -26.733 -9.650 1.00 0.00 H new ATOM 0 HB2 SER A 449 -7.901 -24.772 -8.225 1.00 0.00 H new ATOM 0 HB3 SER A 449 -7.891 -26.201 -7.211 1.00 0.00 H new ATOM 0 HG SER A 449 -6.226 -24.696 -6.624 1.00 0.00 H new ATOM 30 N GLY A 450 -6.728 -24.642 -10.668 1.00 0.00 N ATOM 31 CA GLY A 450 -5.985 -23.864 -11.642 1.00 0.00 C ATOM 32 C GLY A 450 -6.081 -22.373 -11.387 1.00 0.00 C ATOM 33 O GLY A 450 -6.568 -21.945 -10.341 1.00 0.00 O ATOM 0 H GLY A 450 -7.613 -24.228 -10.374 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -4.938 -24.166 -11.622 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -6.361 -24.084 -12.641 1.00 0.00 H new ATOM 37 N SER A 451 -5.614 -21.579 -12.346 1.00 0.00 N ATOM 38 CA SER A 451 -5.645 -20.127 -12.219 1.00 0.00 C ATOM 39 C SER A 451 -5.399 -19.458 -13.568 1.00 0.00 C ATOM 40 O SER A 451 -5.043 -20.117 -14.544 1.00 0.00 O ATOM 41 CB SER A 451 -4.596 -19.661 -11.207 1.00 0.00 C ATOM 42 OG SER A 451 -3.297 -20.080 -11.588 1.00 0.00 O ATOM 0 H SER A 451 -5.210 -21.917 -13.219 1.00 0.00 H new ATOM 0 HA SER A 451 -6.635 -19.838 -11.866 1.00 0.00 H new ATOM 0 HB2 SER A 451 -4.622 -18.574 -11.126 1.00 0.00 H new ATOM 0 HB3 SER A 451 -4.835 -20.060 -10.221 1.00 0.00 H new ATOM 0 HG SER A 451 -2.645 -19.768 -10.926 1.00 0.00 H new ATOM 48 N SER A 452 -5.593 -18.144 -13.613 1.00 0.00 N ATOM 49 CA SER A 452 -5.396 -17.384 -14.843 1.00 0.00 C ATOM 50 C SER A 452 -5.007 -15.942 -14.534 1.00 0.00 C ATOM 51 O SER A 452 -5.297 -15.426 -13.455 1.00 0.00 O ATOM 52 CB SER A 452 -6.669 -17.410 -15.692 1.00 0.00 C ATOM 53 OG SER A 452 -6.806 -18.649 -16.367 1.00 0.00 O ATOM 0 H SER A 452 -5.886 -17.583 -12.813 1.00 0.00 H new ATOM 0 HA SER A 452 -4.584 -17.849 -15.403 1.00 0.00 H new ATOM 0 HB2 SER A 452 -7.538 -17.241 -15.056 1.00 0.00 H new ATOM 0 HB3 SER A 452 -6.642 -16.598 -16.418 1.00 0.00 H new ATOM 0 HG SER A 452 -6.187 -19.303 -15.980 1.00 0.00 H new ATOM 59 N GLY A 453 -4.346 -15.296 -15.490 1.00 0.00 N ATOM 60 CA GLY A 453 -3.927 -13.919 -15.302 1.00 0.00 C ATOM 61 C GLY A 453 -3.501 -13.261 -16.599 1.00 0.00 C ATOM 62 O GLY A 453 -3.318 -13.935 -17.613 1.00 0.00 O ATOM 0 H GLY A 453 -4.093 -15.702 -16.391 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -4.746 -13.350 -14.861 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -3.099 -13.888 -14.593 1.00 0.00 H new ATOM 66 N GLN A 454 -3.343 -11.942 -16.568 1.00 0.00 N ATOM 67 CA GLN A 454 -2.937 -11.193 -17.751 1.00 0.00 C ATOM 68 C GLN A 454 -1.571 -10.547 -17.545 1.00 0.00 C ATOM 69 O GLN A 454 -1.147 -10.316 -16.413 1.00 0.00 O ATOM 70 CB GLN A 454 -3.977 -10.121 -18.083 1.00 0.00 C ATOM 71 CG GLN A 454 -5.308 -10.688 -18.551 1.00 0.00 C ATOM 72 CD GLN A 454 -6.308 -9.607 -18.912 1.00 0.00 C ATOM 73 OE1 GLN A 454 -6.179 -8.459 -18.486 1.00 0.00 O ATOM 74 NE2 GLN A 454 -7.312 -9.969 -19.701 1.00 0.00 N ATOM 0 H GLN A 454 -3.490 -11.370 -15.736 1.00 0.00 H new ATOM 0 HA GLN A 454 -2.866 -11.891 -18.585 1.00 0.00 H new ATOM 0 HB2 GLN A 454 -4.145 -9.504 -17.200 1.00 0.00 H new ATOM 0 HB3 GLN A 454 -3.578 -9.467 -18.858 1.00 0.00 H new ATOM 0 HG2 GLN A 454 -5.142 -11.328 -19.418 1.00 0.00 H new ATOM 0 HG3 GLN A 454 -5.727 -11.318 -17.766 1.00 0.00 H new ATOM 0 HE21 GLN A 454 -7.380 -10.932 -20.031 1.00 0.00 H new ATOM 0 HE22 GLN A 454 -8.016 -9.284 -19.978 1.00 0.00 H new ATOM 83 N VAL A 455 -0.887 -10.257 -18.647 1.00 0.00 N ATOM 84 CA VAL A 455 0.431 -9.637 -18.587 1.00 0.00 C ATOM 85 C VAL A 455 0.378 -8.187 -19.056 1.00 0.00 C ATOM 86 O VAL A 455 0.717 -7.864 -20.194 1.00 0.00 O ATOM 87 CB VAL A 455 1.453 -10.406 -19.447 1.00 0.00 C ATOM 88 CG1 VAL A 455 2.795 -9.691 -19.448 1.00 0.00 C ATOM 89 CG2 VAL A 455 1.601 -11.835 -18.947 1.00 0.00 C ATOM 0 H VAL A 455 -1.224 -10.441 -19.592 1.00 0.00 H new ATOM 0 HA VAL A 455 0.748 -9.668 -17.545 1.00 0.00 H new ATOM 0 HB VAL A 455 1.086 -10.440 -20.473 1.00 0.00 H new ATOM 0 HG11 VAL A 455 3.504 -10.249 -20.060 1.00 0.00 H new ATOM 0 HG12 VAL A 455 2.673 -8.688 -19.857 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.172 -9.623 -18.427 1.00 0.00 H new ATOM 0 HG21 VAL A 455 2.326 -12.364 -19.566 1.00 0.00 H new ATOM 0 HG22 VAL A 455 1.945 -11.825 -17.913 1.00 0.00 H new ATOM 0 HG23 VAL A 455 0.638 -12.342 -19.004 1.00 0.00 H new ATOM 99 N PRO A 456 -0.056 -7.291 -18.158 1.00 0.00 N ATOM 100 CA PRO A 456 -0.163 -5.860 -18.455 1.00 0.00 C ATOM 101 C PRO A 456 1.201 -5.195 -18.604 1.00 0.00 C ATOM 102 O PRO A 456 2.130 -5.483 -17.848 1.00 0.00 O ATOM 103 CB PRO A 456 -0.901 -5.298 -17.238 1.00 0.00 C ATOM 104 CG PRO A 456 -0.596 -6.253 -16.136 1.00 0.00 C ATOM 105 CD PRO A 456 -0.476 -7.606 -16.782 1.00 0.00 C ATOM 0 HA PRO A 456 -0.673 -5.678 -19.401 1.00 0.00 H new ATOM 0 HB2 PRO A 456 -0.558 -4.292 -16.997 1.00 0.00 H new ATOM 0 HB3 PRO A 456 -1.974 -5.233 -17.420 1.00 0.00 H new ATOM 0 HG2 PRO A 456 0.329 -5.980 -15.628 1.00 0.00 H new ATOM 0 HG3 PRO A 456 -1.386 -6.248 -15.385 1.00 0.00 H new ATOM 0 HD2 PRO A 456 0.256 -8.231 -16.272 1.00 0.00 H new ATOM 0 HD3 PRO A 456 -1.423 -8.145 -16.764 1.00 0.00 H new ATOM 113 N LYS A 457 1.317 -4.304 -19.583 1.00 0.00 N ATOM 114 CA LYS A 457 2.567 -3.596 -19.831 1.00 0.00 C ATOM 115 C LYS A 457 2.443 -2.124 -19.452 1.00 0.00 C ATOM 116 O LYS A 457 1.785 -1.347 -20.144 1.00 0.00 O ATOM 117 CB LYS A 457 2.966 -3.723 -21.303 1.00 0.00 C ATOM 118 CG LYS A 457 4.440 -3.463 -21.558 1.00 0.00 C ATOM 119 CD LYS A 457 4.677 -2.926 -22.960 1.00 0.00 C ATOM 120 CE LYS A 457 4.609 -1.407 -22.994 1.00 0.00 C ATOM 121 NZ LYS A 457 4.564 -0.884 -24.387 1.00 0.00 N ATOM 0 H LYS A 457 0.559 -4.055 -20.218 1.00 0.00 H new ATOM 0 HA LYS A 457 3.341 -4.049 -19.211 1.00 0.00 H new ATOM 0 HB2 LYS A 457 2.716 -4.725 -21.653 1.00 0.00 H new ATOM 0 HB3 LYS A 457 2.375 -3.023 -21.893 1.00 0.00 H new ATOM 0 HG2 LYS A 457 4.817 -2.749 -20.825 1.00 0.00 H new ATOM 0 HG3 LYS A 457 5.002 -4.387 -21.421 1.00 0.00 H new ATOM 0 HD2 LYS A 457 5.653 -3.256 -23.317 1.00 0.00 H new ATOM 0 HD3 LYS A 457 3.932 -3.340 -23.640 1.00 0.00 H new ATOM 0 HE2 LYS A 457 3.725 -1.071 -22.451 1.00 0.00 H new ATOM 0 HE3 LYS A 457 5.476 -0.993 -22.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 457 4.518 0.155 -24.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 457 5.419 -1.183 -24.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 457 3.723 -1.258 -24.871 1.00 0.00 H new ATOM 135 N LYS A 458 3.081 -1.746 -18.349 1.00 0.00 N ATOM 136 CA LYS A 458 3.045 -0.366 -17.879 1.00 0.00 C ATOM 137 C LYS A 458 4.051 -0.149 -16.753 1.00 0.00 C ATOM 138 O LYS A 458 4.570 -1.106 -16.180 1.00 0.00 O ATOM 139 CB LYS A 458 1.638 -0.007 -17.396 1.00 0.00 C ATOM 140 CG LYS A 458 1.296 -0.586 -16.034 1.00 0.00 C ATOM 141 CD LYS A 458 0.915 -2.054 -16.132 1.00 0.00 C ATOM 142 CE LYS A 458 0.745 -2.678 -14.755 1.00 0.00 C ATOM 143 NZ LYS A 458 -0.310 -1.991 -13.961 1.00 0.00 N ATOM 0 H LYS A 458 3.629 -2.376 -17.764 1.00 0.00 H new ATOM 0 HA LYS A 458 3.313 0.283 -18.713 1.00 0.00 H new ATOM 0 HB2 LYS A 458 1.543 1.078 -17.354 1.00 0.00 H new ATOM 0 HB3 LYS A 458 0.911 -0.363 -18.126 1.00 0.00 H new ATOM 0 HG2 LYS A 458 2.150 -0.475 -15.365 1.00 0.00 H new ATOM 0 HG3 LYS A 458 0.472 -0.024 -15.595 1.00 0.00 H new ATOM 0 HD2 LYS A 458 -0.013 -2.153 -16.695 1.00 0.00 H new ATOM 0 HD3 LYS A 458 1.683 -2.594 -16.685 1.00 0.00 H new ATOM 0 HE2 LYS A 458 0.489 -3.732 -14.863 1.00 0.00 H new ATOM 0 HE3 LYS A 458 1.692 -2.633 -14.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 458 -0.490 -2.525 -13.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 458 0.007 -1.030 -13.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 458 -1.185 -1.937 -14.520 1.00 0.00 H new ATOM 157 N GLN A 459 4.320 1.115 -16.442 1.00 0.00 N ATOM 158 CA GLN A 459 5.263 1.456 -15.384 1.00 0.00 C ATOM 159 C GLN A 459 5.014 0.612 -14.139 1.00 0.00 C ATOM 160 O GLN A 459 3.929 0.647 -13.558 1.00 0.00 O ATOM 161 CB GLN A 459 5.157 2.942 -15.036 1.00 0.00 C ATOM 162 CG GLN A 459 6.073 3.369 -13.901 1.00 0.00 C ATOM 163 CD GLN A 459 7.530 3.428 -14.317 1.00 0.00 C ATOM 164 OE1 GLN A 459 7.903 4.197 -15.204 1.00 0.00 O ATOM 165 NE2 GLN A 459 8.362 2.615 -13.678 1.00 0.00 N ATOM 0 H GLN A 459 3.899 1.919 -16.907 1.00 0.00 H new ATOM 0 HA GLN A 459 6.269 1.246 -15.748 1.00 0.00 H new ATOM 0 HB2 GLN A 459 5.392 3.532 -15.922 1.00 0.00 H new ATOM 0 HB3 GLN A 459 4.126 3.170 -14.765 1.00 0.00 H new ATOM 0 HG2 GLN A 459 5.763 4.349 -13.538 1.00 0.00 H new ATOM 0 HG3 GLN A 459 5.964 2.672 -13.070 1.00 0.00 H new ATOM 0 HE21 GLN A 459 8.009 1.994 -12.949 1.00 0.00 H new ATOM 0 HE22 GLN A 459 9.354 2.611 -13.915 1.00 0.00 H new ATOM 174 N THR A 460 6.027 -0.149 -13.733 1.00 0.00 N ATOM 175 CA THR A 460 5.917 -1.004 -12.558 1.00 0.00 C ATOM 176 C THR A 460 6.023 -0.190 -11.274 1.00 0.00 C ATOM 177 O THR A 460 7.077 -0.145 -10.639 1.00 0.00 O ATOM 178 CB THR A 460 7.006 -2.094 -12.553 1.00 0.00 C ATOM 179 OG1 THR A 460 7.334 -2.465 -13.896 1.00 0.00 O ATOM 180 CG2 THR A 460 6.541 -3.320 -11.782 1.00 0.00 C ATOM 0 H THR A 460 6.932 -0.190 -14.201 1.00 0.00 H new ATOM 0 HA THR A 460 4.937 -1.479 -12.603 1.00 0.00 H new ATOM 0 HB THR A 460 7.891 -1.690 -12.062 1.00 0.00 H new ATOM 0 HG1 THR A 460 8.028 -3.157 -13.884 1.00 0.00 H new ATOM 0 HG21 THR A 460 7.326 -4.076 -11.792 1.00 0.00 H new ATOM 0 HG22 THR A 460 6.320 -3.040 -10.752 1.00 0.00 H new ATOM 0 HG23 THR A 460 5.643 -3.724 -12.249 1.00 0.00 H new ATOM 188 N THR A 461 4.923 0.453 -10.894 1.00 0.00 N ATOM 189 CA THR A 461 4.892 1.266 -9.685 1.00 0.00 C ATOM 190 C THR A 461 5.102 0.410 -8.441 1.00 0.00 C ATOM 191 O THR A 461 5.024 -0.817 -8.500 1.00 0.00 O ATOM 192 CB THR A 461 3.559 2.026 -9.553 1.00 0.00 C ATOM 193 OG1 THR A 461 3.540 2.773 -8.332 1.00 0.00 O ATOM 194 CG2 THR A 461 2.382 1.063 -9.583 1.00 0.00 C ATOM 0 H THR A 461 4.042 0.426 -11.407 1.00 0.00 H new ATOM 0 HA THR A 461 5.706 1.987 -9.768 1.00 0.00 H new ATOM 0 HB THR A 461 3.470 2.709 -10.398 1.00 0.00 H new ATOM 0 HG1 THR A 461 2.690 3.255 -8.256 1.00 0.00 H new ATOM 0 HG21 THR A 461 1.451 1.623 -9.488 1.00 0.00 H new ATOM 0 HG22 THR A 461 2.383 0.517 -10.526 1.00 0.00 H new ATOM 0 HG23 THR A 461 2.467 0.358 -8.756 1.00 0.00 H new ATOM 202 N SER A 462 5.367 1.066 -7.315 1.00 0.00 N ATOM 203 CA SER A 462 5.591 0.364 -6.057 1.00 0.00 C ATOM 204 C SER A 462 4.746 0.969 -4.940 1.00 0.00 C ATOM 205 O SER A 462 5.202 1.845 -4.205 1.00 0.00 O ATOM 206 CB SER A 462 7.072 0.414 -5.677 1.00 0.00 C ATOM 207 OG SER A 462 7.586 1.729 -5.805 1.00 0.00 O ATOM 0 H SER A 462 5.432 2.082 -7.249 1.00 0.00 H new ATOM 0 HA SER A 462 5.293 -0.676 -6.191 1.00 0.00 H new ATOM 0 HB2 SER A 462 7.200 0.068 -4.651 1.00 0.00 H new ATOM 0 HB3 SER A 462 7.638 -0.265 -6.315 1.00 0.00 H new ATOM 0 HG SER A 462 7.007 2.355 -5.322 1.00 0.00 H new ATOM 213 N LYS A 463 3.511 0.494 -4.818 1.00 0.00 N ATOM 214 CA LYS A 463 2.600 0.985 -3.791 1.00 0.00 C ATOM 215 C LYS A 463 1.678 -0.128 -3.304 1.00 0.00 C ATOM 216 O LYS A 463 0.829 -0.615 -4.052 1.00 0.00 O ATOM 217 CB LYS A 463 1.769 2.151 -4.332 1.00 0.00 C ATOM 218 CG LYS A 463 0.548 2.471 -3.487 1.00 0.00 C ATOM 219 CD LYS A 463 -0.073 3.800 -3.885 1.00 0.00 C ATOM 220 CE LYS A 463 0.699 4.973 -3.302 1.00 0.00 C ATOM 221 NZ LYS A 463 1.840 5.373 -4.170 1.00 0.00 N ATOM 0 H LYS A 463 3.118 -0.231 -5.418 1.00 0.00 H new ATOM 0 HA LYS A 463 3.197 1.333 -2.948 1.00 0.00 H new ATOM 0 HB2 LYS A 463 2.400 3.038 -4.394 1.00 0.00 H new ATOM 0 HB3 LYS A 463 1.447 1.917 -5.347 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -0.190 1.676 -3.597 1.00 0.00 H new ATOM 0 HG3 LYS A 463 0.830 2.501 -2.435 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -0.095 3.882 -4.972 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -1.107 3.837 -3.542 1.00 0.00 H new ATOM 0 HE2 LYS A 463 0.027 5.821 -3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 463 1.071 4.707 -2.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 2.733 5.077 -3.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 1.746 4.916 -5.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 1.839 6.406 -4.291 1.00 0.00 H new ATOM 235 N ILE A 464 1.849 -0.524 -2.047 1.00 0.00 N ATOM 236 CA ILE A 464 1.029 -1.578 -1.461 1.00 0.00 C ATOM 237 C ILE A 464 -0.174 -0.995 -0.728 1.00 0.00 C ATOM 238 O ILE A 464 -0.037 -0.410 0.347 1.00 0.00 O ATOM 239 CB ILE A 464 1.843 -2.444 -0.481 1.00 0.00 C ATOM 240 CG1 ILE A 464 3.157 -2.886 -1.127 1.00 0.00 C ATOM 241 CG2 ILE A 464 1.029 -3.652 -0.041 1.00 0.00 C ATOM 242 CD1 ILE A 464 4.255 -3.175 -0.127 1.00 0.00 C ATOM 0 H ILE A 464 2.547 -0.132 -1.415 1.00 0.00 H new ATOM 0 HA ILE A 464 0.682 -2.203 -2.284 1.00 0.00 H new ATOM 0 HB ILE A 464 2.077 -1.847 0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 464 2.976 -3.780 -1.724 1.00 0.00 H new ATOM 0 HG13 ILE A 464 3.496 -2.108 -1.812 1.00 0.00 H new ATOM 0 HG21 ILE A 464 1.617 -4.255 0.651 1.00 0.00 H new ATOM 0 HG22 ILE A 464 0.118 -3.316 0.454 1.00 0.00 H new ATOM 0 HG23 ILE A 464 0.768 -4.252 -0.913 1.00 0.00 H new ATOM 0 HD11 ILE A 464 5.157 -3.483 -0.656 1.00 0.00 H new ATOM 0 HD12 ILE A 464 4.464 -2.277 0.454 1.00 0.00 H new ATOM 0 HD13 ILE A 464 3.936 -3.974 0.542 1.00 0.00 H new ATOM 254 N LEU A 465 -1.354 -1.159 -1.316 1.00 0.00 N ATOM 255 CA LEU A 465 -2.584 -0.650 -0.719 1.00 0.00 C ATOM 256 C LEU A 465 -3.378 -1.777 -0.066 1.00 0.00 C ATOM 257 O LEU A 465 -4.022 -2.574 -0.749 1.00 0.00 O ATOM 258 CB LEU A 465 -3.440 0.044 -1.779 1.00 0.00 C ATOM 259 CG LEU A 465 -4.923 0.205 -1.444 1.00 0.00 C ATOM 260 CD1 LEU A 465 -5.101 1.087 -0.218 1.00 0.00 C ATOM 261 CD2 LEU A 465 -5.679 0.782 -2.633 1.00 0.00 C ATOM 0 H LEU A 465 -1.485 -1.640 -2.206 1.00 0.00 H new ATOM 0 HA LEU A 465 -2.313 0.073 0.050 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -3.021 1.033 -1.966 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -3.357 -0.518 -2.709 1.00 0.00 H new ATOM 0 HG LEU A 465 -5.334 -0.779 -1.220 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -6.163 1.190 0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -4.594 0.633 0.633 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -4.674 2.071 -0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -6.733 0.890 -2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.266 1.758 -2.888 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -5.580 0.112 -3.487 1.00 0.00 H new ATOM 273 N VAL A 466 -3.330 -1.836 1.261 1.00 0.00 N ATOM 274 CA VAL A 466 -4.048 -2.863 2.007 1.00 0.00 C ATOM 275 C VAL A 466 -5.447 -2.391 2.385 1.00 0.00 C ATOM 276 O VAL A 466 -5.620 -1.301 2.931 1.00 0.00 O ATOM 277 CB VAL A 466 -3.289 -3.259 3.288 1.00 0.00 C ATOM 278 CG1 VAL A 466 -2.687 -2.032 3.954 1.00 0.00 C ATOM 279 CG2 VAL A 466 -4.212 -3.997 4.246 1.00 0.00 C ATOM 0 H VAL A 466 -2.802 -1.185 1.842 1.00 0.00 H new ATOM 0 HA VAL A 466 -4.125 -3.733 1.354 1.00 0.00 H new ATOM 0 HB VAL A 466 -2.474 -3.930 3.014 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.155 -2.332 4.857 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -1.992 -1.549 3.267 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.482 -1.334 4.216 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -3.660 -4.270 5.146 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -5.048 -3.352 4.515 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -4.590 -4.899 3.765 1.00 0.00 H new ATOM 289 N ARG A 467 -6.444 -3.219 2.090 1.00 0.00 N ATOM 290 CA ARG A 467 -7.830 -2.886 2.397 1.00 0.00 C ATOM 291 C ARG A 467 -8.402 -3.845 3.437 1.00 0.00 C ATOM 292 O ARG A 467 -7.741 -4.799 3.846 1.00 0.00 O ATOM 293 CB ARG A 467 -8.681 -2.928 1.127 1.00 0.00 C ATOM 294 CG ARG A 467 -8.743 -1.600 0.391 1.00 0.00 C ATOM 295 CD ARG A 467 -9.632 -1.685 -0.840 1.00 0.00 C ATOM 296 NE ARG A 467 -11.048 -1.582 -0.500 1.00 0.00 N ATOM 297 CZ ARG A 467 -12.004 -1.354 -1.394 1.00 0.00 C ATOM 298 NH1 ARG A 467 -11.697 -1.206 -2.675 1.00 0.00 N ATOM 299 NH2 ARG A 467 -13.271 -1.273 -1.007 1.00 0.00 N ATOM 0 H ARG A 467 -6.318 -4.125 1.639 1.00 0.00 H new ATOM 0 HA ARG A 467 -7.852 -1.876 2.807 1.00 0.00 H new ATOM 0 HB2 ARG A 467 -8.280 -3.687 0.456 1.00 0.00 H new ATOM 0 HB3 ARG A 467 -9.693 -3.237 1.388 1.00 0.00 H new ATOM 0 HG2 ARG A 467 -9.122 -0.829 1.062 1.00 0.00 H new ATOM 0 HG3 ARG A 467 -7.738 -1.300 0.095 1.00 0.00 H new ATOM 0 HD2 ARG A 467 -9.367 -0.888 -1.534 1.00 0.00 H new ATOM 0 HD3 ARG A 467 -9.450 -2.629 -1.354 1.00 0.00 H new ATOM 0 HE ARG A 467 -11.318 -1.691 0.477 1.00 0.00 H new ATOM 0 HH11 ARG A 467 -10.725 -1.267 -2.977 1.00 0.00 H new ATOM 0 HH12 ARG A 467 -12.433 -1.031 -3.359 1.00 0.00 H new ATOM 0 HH21 ARG A 467 -13.512 -1.386 -0.022 1.00 0.00 H new ATOM 0 HH22 ARG A 467 -14.004 -1.098 -1.694 1.00 0.00 H new ATOM 313 N ASN A 468 -9.634 -3.585 3.861 1.00 0.00 N ATOM 314 CA ASN A 468 -10.294 -4.424 4.854 1.00 0.00 C ATOM 315 C ASN A 468 -9.523 -4.419 6.170 1.00 0.00 C ATOM 316 O ASN A 468 -9.379 -5.454 6.821 1.00 0.00 O ATOM 317 CB ASN A 468 -10.428 -5.857 4.334 1.00 0.00 C ATOM 318 CG ASN A 468 -11.592 -6.595 4.965 1.00 0.00 C ATOM 319 OD1 ASN A 468 -12.744 -6.179 4.845 1.00 0.00 O ATOM 320 ND2 ASN A 468 -11.295 -7.698 5.644 1.00 0.00 N ATOM 0 H ASN A 468 -10.196 -2.800 3.532 1.00 0.00 H new ATOM 0 HA ASN A 468 -11.288 -4.016 5.035 1.00 0.00 H new ATOM 0 HB2 ASN A 468 -10.558 -5.837 3.252 1.00 0.00 H new ATOM 0 HB3 ASN A 468 -9.505 -6.401 4.534 1.00 0.00 H new ATOM 0 HD21 ASN A 468 -12.037 -8.237 6.092 1.00 0.00 H new ATOM 0 HD22 ASN A 468 -10.325 -8.006 5.718 1.00 0.00 H new ATOM 327 N ILE A 469 -9.029 -3.247 6.556 1.00 0.00 N ATOM 328 CA ILE A 469 -8.275 -3.107 7.795 1.00 0.00 C ATOM 329 C ILE A 469 -9.202 -2.848 8.977 1.00 0.00 C ATOM 330 O ILE A 469 -10.123 -2.034 8.909 1.00 0.00 O ATOM 331 CB ILE A 469 -7.248 -1.963 7.702 1.00 0.00 C ATOM 332 CG1 ILE A 469 -6.395 -2.114 6.441 1.00 0.00 C ATOM 333 CG2 ILE A 469 -6.368 -1.939 8.943 1.00 0.00 C ATOM 334 CD1 ILE A 469 -5.543 -0.902 6.138 1.00 0.00 C ATOM 0 H ILE A 469 -9.138 -2.381 6.028 1.00 0.00 H new ATOM 0 HA ILE A 469 -7.747 -4.048 7.951 1.00 0.00 H new ATOM 0 HB ILE A 469 -7.786 -1.017 7.643 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -5.748 -2.984 6.552 1.00 0.00 H new ATOM 0 HG13 ILE A 469 -7.049 -2.310 5.591 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -5.647 -1.125 8.862 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -6.989 -1.788 9.826 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -5.837 -2.887 9.031 1.00 0.00 H new ATOM 0 HD11 ILE A 469 -4.966 -1.081 5.231 1.00 0.00 H new ATOM 0 HD12 ILE A 469 -6.185 -0.033 5.994 1.00 0.00 H new ATOM 0 HD13 ILE A 469 -4.863 -0.718 6.970 1.00 0.00 H new ATOM 346 N PRO A 470 -8.954 -3.556 10.089 1.00 0.00 N ATOM 347 CA PRO A 470 -9.754 -3.419 11.310 1.00 0.00 C ATOM 348 C PRO A 470 -9.536 -2.076 11.998 1.00 0.00 C ATOM 349 O PRO A 470 -8.440 -1.518 11.958 1.00 0.00 O ATOM 350 CB PRO A 470 -9.250 -4.562 12.195 1.00 0.00 C ATOM 351 CG PRO A 470 -7.864 -4.827 11.718 1.00 0.00 C ATOM 352 CD PRO A 470 -7.873 -4.545 10.241 1.00 0.00 C ATOM 0 HA PRO A 470 -10.823 -3.462 11.103 1.00 0.00 H new ATOM 0 HB2 PRO A 470 -9.259 -4.281 13.248 1.00 0.00 H new ATOM 0 HB3 PRO A 470 -9.879 -5.447 12.096 1.00 0.00 H new ATOM 0 HG2 PRO A 470 -7.146 -4.189 12.233 1.00 0.00 H new ATOM 0 HG3 PRO A 470 -7.574 -5.859 11.917 1.00 0.00 H new ATOM 0 HD2 PRO A 470 -6.916 -4.149 9.902 1.00 0.00 H new ATOM 0 HD3 PRO A 470 -8.069 -5.447 9.661 1.00 0.00 H new ATOM 360 N PHE A 471 -10.586 -1.563 12.630 1.00 0.00 N ATOM 361 CA PHE A 471 -10.509 -0.284 13.327 1.00 0.00 C ATOM 362 C PHE A 471 -9.360 -0.280 14.330 1.00 0.00 C ATOM 363 O PHE A 471 -8.815 0.773 14.661 1.00 0.00 O ATOM 364 CB PHE A 471 -11.828 0.010 14.045 1.00 0.00 C ATOM 365 CG PHE A 471 -13.017 0.039 13.127 1.00 0.00 C ATOM 366 CD1 PHE A 471 -13.275 1.151 12.341 1.00 0.00 C ATOM 367 CD2 PHE A 471 -13.876 -1.045 13.050 1.00 0.00 C ATOM 368 CE1 PHE A 471 -14.367 1.181 11.495 1.00 0.00 C ATOM 369 CE2 PHE A 471 -14.970 -1.021 12.206 1.00 0.00 C ATOM 370 CZ PHE A 471 -15.216 0.094 11.428 1.00 0.00 C ATOM 0 H PHE A 471 -11.500 -2.013 12.674 1.00 0.00 H new ATOM 0 HA PHE A 471 -10.325 0.494 12.586 1.00 0.00 H new ATOM 0 HB2 PHE A 471 -11.991 -0.746 14.813 1.00 0.00 H new ATOM 0 HB3 PHE A 471 -11.749 0.970 14.554 1.00 0.00 H new ATOM 0 HD1 PHE A 471 -12.615 2.004 12.390 1.00 0.00 H new ATOM 0 HD2 PHE A 471 -13.689 -1.919 13.656 1.00 0.00 H new ATOM 0 HE1 PHE A 471 -14.556 2.053 10.887 1.00 0.00 H new ATOM 0 HE2 PHE A 471 -15.632 -1.873 12.155 1.00 0.00 H new ATOM 0 HZ PHE A 471 -16.071 0.115 10.768 1.00 0.00 H new ATOM 380 N GLN A 472 -8.997 -1.465 14.811 1.00 0.00 N ATOM 381 CA GLN A 472 -7.914 -1.599 15.777 1.00 0.00 C ATOM 382 C GLN A 472 -6.572 -1.244 15.143 1.00 0.00 C ATOM 383 O GLN A 472 -5.720 -0.624 15.777 1.00 0.00 O ATOM 384 CB GLN A 472 -7.868 -3.024 16.331 1.00 0.00 C ATOM 385 CG GLN A 472 -8.816 -3.253 17.497 1.00 0.00 C ATOM 386 CD GLN A 472 -8.627 -2.242 18.611 1.00 0.00 C ATOM 387 OE1 GLN A 472 -7.734 -2.383 19.448 1.00 0.00 O ATOM 388 NE2 GLN A 472 -9.467 -1.214 18.628 1.00 0.00 N ATOM 0 H GLN A 472 -9.438 -2.346 14.547 1.00 0.00 H new ATOM 0 HA GLN A 472 -8.104 -0.905 16.596 1.00 0.00 H new ATOM 0 HB2 GLN A 472 -8.112 -3.724 15.532 1.00 0.00 H new ATOM 0 HB3 GLN A 472 -6.850 -3.248 16.651 1.00 0.00 H new ATOM 0 HG2 GLN A 472 -9.844 -3.205 17.139 1.00 0.00 H new ATOM 0 HG3 GLN A 472 -8.663 -4.257 17.893 1.00 0.00 H new ATOM 0 HE21 GLN A 472 -10.192 -1.136 17.915 1.00 0.00 H new ATOM 0 HE22 GLN A 472 -9.387 -0.502 19.354 1.00 0.00 H new ATOM 397 N ALA A 473 -6.393 -1.644 13.888 1.00 0.00 N ATOM 398 CA ALA A 473 -5.156 -1.367 13.168 1.00 0.00 C ATOM 399 C ALA A 473 -4.836 0.124 13.180 1.00 0.00 C ATOM 400 O ALA A 473 -5.712 0.958 12.959 1.00 0.00 O ATOM 401 CB ALA A 473 -5.253 -1.876 11.738 1.00 0.00 C ATOM 0 H ALA A 473 -7.088 -2.160 13.349 1.00 0.00 H new ATOM 0 HA ALA A 473 -4.345 -1.890 13.674 1.00 0.00 H new ATOM 0 HB1 ALA A 473 -4.323 -1.663 11.212 1.00 0.00 H new ATOM 0 HB2 ALA A 473 -5.427 -2.952 11.746 1.00 0.00 H new ATOM 0 HB3 ALA A 473 -6.079 -1.379 11.230 1.00 0.00 H new ATOM 407 N ASN A 474 -3.574 0.452 13.440 1.00 0.00 N ATOM 408 CA ASN A 474 -3.139 1.843 13.482 1.00 0.00 C ATOM 409 C ASN A 474 -1.908 2.054 12.606 1.00 0.00 C ATOM 410 O ASN A 474 -1.167 1.113 12.322 1.00 0.00 O ATOM 411 CB ASN A 474 -2.831 2.260 14.922 1.00 0.00 C ATOM 412 CG ASN A 474 -4.038 2.133 15.831 1.00 0.00 C ATOM 413 OD1 ASN A 474 -5.152 2.503 15.458 1.00 0.00 O ATOM 414 ND2 ASN A 474 -3.822 1.607 17.031 1.00 0.00 N ATOM 0 H ASN A 474 -2.835 -0.227 13.625 1.00 0.00 H new ATOM 0 HA ASN A 474 -3.949 2.463 13.097 1.00 0.00 H new ATOM 0 HB2 ASN A 474 -2.020 1.643 15.311 1.00 0.00 H new ATOM 0 HB3 ASN A 474 -2.479 3.292 14.931 1.00 0.00 H new ATOM 0 HD21 ASN A 474 -4.596 1.496 17.686 1.00 0.00 H new ATOM 0 HD22 ASN A 474 -2.882 1.314 17.298 1.00 0.00 H new ATOM 421 N GLN A 475 -1.697 3.296 12.181 1.00 0.00 N ATOM 422 CA GLN A 475 -0.556 3.631 11.337 1.00 0.00 C ATOM 423 C GLN A 475 0.690 2.869 11.778 1.00 0.00 C ATOM 424 O GLN A 475 1.463 2.391 10.949 1.00 0.00 O ATOM 425 CB GLN A 475 -0.289 5.136 11.378 1.00 0.00 C ATOM 426 CG GLN A 475 0.888 5.569 10.518 1.00 0.00 C ATOM 427 CD GLN A 475 1.403 6.947 10.884 1.00 0.00 C ATOM 428 OE1 GLN A 475 0.877 7.599 11.786 1.00 0.00 O ATOM 429 NE2 GLN A 475 2.437 7.398 10.184 1.00 0.00 N ATOM 0 H GLN A 475 -2.301 4.086 12.407 1.00 0.00 H new ATOM 0 HA GLN A 475 -0.795 3.339 10.314 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -1.183 5.664 11.048 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -0.104 5.436 12.410 1.00 0.00 H new ATOM 0 HG2 GLN A 475 1.695 4.844 10.622 1.00 0.00 H new ATOM 0 HG3 GLN A 475 0.589 5.564 9.470 1.00 0.00 H new ATOM 0 HE21 GLN A 475 2.842 6.824 9.445 1.00 0.00 H new ATOM 0 HE22 GLN A 475 2.827 8.319 10.385 1.00 0.00 H new ATOM 438 N ARG A 476 0.877 2.761 13.090 1.00 0.00 N ATOM 439 CA ARG A 476 2.030 2.059 13.641 1.00 0.00 C ATOM 440 C ARG A 476 1.952 0.565 13.339 1.00 0.00 C ATOM 441 O ARG A 476 2.934 -0.043 12.914 1.00 0.00 O ATOM 442 CB ARG A 476 2.114 2.281 15.152 1.00 0.00 C ATOM 443 CG ARG A 476 3.528 2.194 15.703 1.00 0.00 C ATOM 444 CD ARG A 476 3.960 0.750 15.905 1.00 0.00 C ATOM 445 NE ARG A 476 4.962 0.621 16.960 1.00 0.00 N ATOM 446 CZ ARG A 476 6.204 1.081 16.854 1.00 0.00 C ATOM 447 NH1 ARG A 476 6.594 1.697 15.747 1.00 0.00 N ATOM 448 NH2 ARG A 476 7.058 0.925 17.858 1.00 0.00 N ATOM 0 H ARG A 476 0.246 3.150 13.790 1.00 0.00 H new ATOM 0 HA ARG A 476 2.928 2.461 13.171 1.00 0.00 H new ATOM 0 HB2 ARG A 476 1.700 3.261 15.390 1.00 0.00 H new ATOM 0 HB3 ARG A 476 1.491 1.541 15.655 1.00 0.00 H new ATOM 0 HG2 ARG A 476 4.217 2.689 15.019 1.00 0.00 H new ATOM 0 HG3 ARG A 476 3.583 2.727 16.652 1.00 0.00 H new ATOM 0 HD2 ARG A 476 3.090 0.143 16.155 1.00 0.00 H new ATOM 0 HD3 ARG A 476 4.364 0.358 14.971 1.00 0.00 H new ATOM 0 HE ARG A 476 4.694 0.152 17.825 1.00 0.00 H new ATOM 0 HH11 ARG A 476 5.940 1.819 14.974 1.00 0.00 H new ATOM 0 HH12 ARG A 476 7.548 2.049 15.668 1.00 0.00 H new ATOM 0 HH21 ARG A 476 6.761 0.452 18.711 1.00 0.00 H new ATOM 0 HH22 ARG A 476 8.011 1.278 17.776 1.00 0.00 H new ATOM 462 N GLU A 477 0.779 -0.018 13.562 1.00 0.00 N ATOM 463 CA GLU A 477 0.575 -1.441 13.315 1.00 0.00 C ATOM 464 C GLU A 477 0.976 -1.808 11.889 1.00 0.00 C ATOM 465 O GLU A 477 1.742 -2.748 11.671 1.00 0.00 O ATOM 466 CB GLU A 477 -0.888 -1.819 13.558 1.00 0.00 C ATOM 467 CG GLU A 477 -1.117 -3.315 13.688 1.00 0.00 C ATOM 468 CD GLU A 477 -0.360 -3.921 14.855 1.00 0.00 C ATOM 469 OE1 GLU A 477 -0.864 -3.839 15.994 1.00 0.00 O ATOM 470 OE2 GLU A 477 0.735 -4.477 14.628 1.00 0.00 O ATOM 0 H GLU A 477 -0.044 0.472 13.913 1.00 0.00 H new ATOM 0 HA GLU A 477 1.207 -1.998 14.007 1.00 0.00 H new ATOM 0 HB2 GLU A 477 -1.236 -1.327 14.466 1.00 0.00 H new ATOM 0 HB3 GLU A 477 -1.494 -1.437 12.737 1.00 0.00 H new ATOM 0 HG2 GLU A 477 -2.183 -3.506 13.812 1.00 0.00 H new ATOM 0 HG3 GLU A 477 -0.810 -3.808 12.765 1.00 0.00 H new ATOM 477 N ILE A 478 0.454 -1.062 10.922 1.00 0.00 N ATOM 478 CA ILE A 478 0.757 -1.308 9.518 1.00 0.00 C ATOM 479 C ILE A 478 2.239 -1.092 9.230 1.00 0.00 C ATOM 480 O ILE A 478 2.890 -1.930 8.606 1.00 0.00 O ATOM 481 CB ILE A 478 -0.072 -0.397 8.594 1.00 0.00 C ATOM 482 CG1 ILE A 478 -1.566 -0.673 8.777 1.00 0.00 C ATOM 483 CG2 ILE A 478 0.336 -0.601 7.143 1.00 0.00 C ATOM 484 CD1 ILE A 478 -2.006 -2.009 8.221 1.00 0.00 C ATOM 0 H ILE A 478 -0.182 -0.281 11.085 1.00 0.00 H new ATOM 0 HA ILE A 478 0.497 -2.347 9.317 1.00 0.00 H new ATOM 0 HB ILE A 478 0.122 0.641 8.862 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -1.807 -0.633 9.839 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -2.136 0.119 8.291 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.259 0.050 6.503 1.00 0.00 H new ATOM 0 HG22 ILE A 478 1.392 -0.359 7.025 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.168 -1.640 6.860 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.076 -2.137 8.386 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -1.797 -2.045 7.152 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -1.463 -2.809 8.724 1.00 0.00 H new ATOM 496 N ARG A 479 2.767 0.038 9.691 1.00 0.00 N ATOM 497 CA ARG A 479 4.173 0.365 9.483 1.00 0.00 C ATOM 498 C ARG A 479 5.064 -0.823 9.835 1.00 0.00 C ATOM 499 O ARG A 479 5.931 -1.212 9.054 1.00 0.00 O ATOM 500 CB ARG A 479 4.566 1.579 10.327 1.00 0.00 C ATOM 501 CG ARG A 479 5.734 2.366 9.754 1.00 0.00 C ATOM 502 CD ARG A 479 5.855 3.735 10.404 1.00 0.00 C ATOM 503 NE ARG A 479 7.233 4.219 10.409 1.00 0.00 N ATOM 504 CZ ARG A 479 7.575 5.460 10.737 1.00 0.00 C ATOM 505 NH1 ARG A 479 6.644 6.337 11.086 1.00 0.00 N ATOM 506 NH2 ARG A 479 8.850 5.825 10.717 1.00 0.00 N ATOM 0 H ARG A 479 2.243 0.742 10.211 1.00 0.00 H new ATOM 0 HA ARG A 479 4.314 0.603 8.429 1.00 0.00 H new ATOM 0 HB2 ARG A 479 3.704 2.240 10.421 1.00 0.00 H new ATOM 0 HB3 ARG A 479 4.822 1.245 11.332 1.00 0.00 H new ATOM 0 HG2 ARG A 479 6.658 1.808 9.903 1.00 0.00 H new ATOM 0 HG3 ARG A 479 5.603 2.483 8.678 1.00 0.00 H new ATOM 0 HD2 ARG A 479 5.223 4.446 9.872 1.00 0.00 H new ATOM 0 HD3 ARG A 479 5.485 3.684 11.428 1.00 0.00 H new ATOM 0 HE ARG A 479 7.973 3.568 10.146 1.00 0.00 H new ATOM 0 HH11 ARG A 479 5.663 6.059 11.103 1.00 0.00 H new ATOM 0 HH12 ARG A 479 6.909 7.289 11.337 1.00 0.00 H new ATOM 0 HH21 ARG A 479 9.569 5.153 10.450 1.00 0.00 H new ATOM 0 HH22 ARG A 479 9.112 6.778 10.969 1.00 0.00 H new ATOM 520 N GLU A 480 4.845 -1.392 11.016 1.00 0.00 N ATOM 521 CA GLU A 480 5.630 -2.533 11.471 1.00 0.00 C ATOM 522 C GLU A 480 5.231 -3.801 10.722 1.00 0.00 C ATOM 523 O GLU A 480 6.055 -4.690 10.499 1.00 0.00 O ATOM 524 CB GLU A 480 5.447 -2.739 12.977 1.00 0.00 C ATOM 525 CG GLU A 480 6.324 -1.833 13.825 1.00 0.00 C ATOM 526 CD GLU A 480 7.707 -2.411 14.058 1.00 0.00 C ATOM 527 OE1 GLU A 480 7.863 -3.210 15.005 1.00 0.00 O ATOM 528 OE2 GLU A 480 8.632 -2.065 13.294 1.00 0.00 O ATOM 0 H GLU A 480 4.131 -1.082 11.675 1.00 0.00 H new ATOM 0 HA GLU A 480 6.680 -2.324 11.265 1.00 0.00 H new ATOM 0 HB2 GLU A 480 4.402 -2.565 13.235 1.00 0.00 H new ATOM 0 HB3 GLU A 480 5.667 -3.778 13.223 1.00 0.00 H new ATOM 0 HG2 GLU A 480 6.417 -0.863 13.337 1.00 0.00 H new ATOM 0 HG3 GLU A 480 5.840 -1.661 14.786 1.00 0.00 H new ATOM 535 N LEU A 481 3.962 -3.878 10.336 1.00 0.00 N ATOM 536 CA LEU A 481 3.452 -5.037 9.611 1.00 0.00 C ATOM 537 C LEU A 481 4.237 -5.263 8.323 1.00 0.00 C ATOM 538 O LEU A 481 4.535 -6.401 7.957 1.00 0.00 O ATOM 539 CB LEU A 481 1.968 -4.851 9.291 1.00 0.00 C ATOM 540 CG LEU A 481 1.274 -6.033 8.614 1.00 0.00 C ATOM 541 CD1 LEU A 481 0.973 -7.127 9.627 1.00 0.00 C ATOM 542 CD2 LEU A 481 -0.003 -5.577 7.923 1.00 0.00 C ATOM 0 H LEU A 481 3.268 -3.152 10.513 1.00 0.00 H new ATOM 0 HA LEU A 481 3.573 -5.914 10.247 1.00 0.00 H new ATOM 0 HB2 LEU A 481 1.442 -4.630 10.220 1.00 0.00 H new ATOM 0 HB3 LEU A 481 1.862 -3.977 8.649 1.00 0.00 H new ATOM 0 HG LEU A 481 1.946 -6.441 7.859 1.00 0.00 H new ATOM 0 HD11 LEU A 481 0.479 -7.960 9.127 1.00 0.00 H new ATOM 0 HD12 LEU A 481 1.904 -7.474 10.076 1.00 0.00 H new ATOM 0 HD13 LEU A 481 0.320 -6.732 10.405 1.00 0.00 H new ATOM 0 HD21 LEU A 481 -0.484 -6.431 7.446 1.00 0.00 H new ATOM 0 HD22 LEU A 481 -0.680 -5.143 8.659 1.00 0.00 H new ATOM 0 HD23 LEU A 481 0.239 -4.829 7.168 1.00 0.00 H new ATOM 554 N PHE A 482 4.572 -4.173 7.641 1.00 0.00 N ATOM 555 CA PHE A 482 5.324 -4.252 6.395 1.00 0.00 C ATOM 556 C PHE A 482 6.814 -4.031 6.643 1.00 0.00 C ATOM 557 O PHE A 482 7.655 -4.781 6.148 1.00 0.00 O ATOM 558 CB PHE A 482 4.803 -3.218 5.394 1.00 0.00 C ATOM 559 CG PHE A 482 3.530 -3.631 4.713 1.00 0.00 C ATOM 560 CD1 PHE A 482 2.300 -3.326 5.273 1.00 0.00 C ATOM 561 CD2 PHE A 482 3.563 -4.326 3.515 1.00 0.00 C ATOM 562 CE1 PHE A 482 1.125 -3.704 4.649 1.00 0.00 C ATOM 563 CE2 PHE A 482 2.392 -4.706 2.887 1.00 0.00 C ATOM 564 CZ PHE A 482 1.172 -4.396 3.455 1.00 0.00 C ATOM 0 H PHE A 482 4.334 -3.224 7.931 1.00 0.00 H new ATOM 0 HA PHE A 482 5.187 -5.251 5.980 1.00 0.00 H new ATOM 0 HB2 PHE A 482 4.638 -2.273 5.912 1.00 0.00 H new ATOM 0 HB3 PHE A 482 5.568 -3.038 4.639 1.00 0.00 H new ATOM 0 HD1 PHE A 482 2.258 -2.787 6.208 1.00 0.00 H new ATOM 0 HD2 PHE A 482 4.514 -4.574 3.067 1.00 0.00 H new ATOM 0 HE1 PHE A 482 0.172 -3.458 5.095 1.00 0.00 H new ATOM 0 HE2 PHE A 482 2.431 -5.245 1.952 1.00 0.00 H new ATOM 0 HZ PHE A 482 0.256 -4.694 2.966 1.00 0.00 H new ATOM 574 N SER A 483 7.131 -2.995 7.413 1.00 0.00 N ATOM 575 CA SER A 483 8.519 -2.671 7.724 1.00 0.00 C ATOM 576 C SER A 483 9.308 -3.932 8.065 1.00 0.00 C ATOM 577 O SER A 483 10.440 -4.111 7.616 1.00 0.00 O ATOM 578 CB SER A 483 8.585 -1.683 8.890 1.00 0.00 C ATOM 579 OG SER A 483 8.234 -0.376 8.472 1.00 0.00 O ATOM 0 H SER A 483 6.446 -2.366 7.833 1.00 0.00 H new ATOM 0 HA SER A 483 8.966 -2.212 6.842 1.00 0.00 H new ATOM 0 HB2 SER A 483 7.912 -2.007 9.684 1.00 0.00 H new ATOM 0 HB3 SER A 483 9.591 -1.676 9.308 1.00 0.00 H new ATOM 0 HG SER A 483 7.341 -0.154 8.808 1.00 0.00 H new ATOM 585 N THR A 484 8.701 -4.804 8.864 1.00 0.00 N ATOM 586 CA THR A 484 9.345 -6.047 9.268 1.00 0.00 C ATOM 587 C THR A 484 10.041 -6.715 8.087 1.00 0.00 C ATOM 588 O THR A 484 11.119 -7.290 8.234 1.00 0.00 O ATOM 589 CB THR A 484 8.330 -7.034 9.876 1.00 0.00 C ATOM 590 OG1 THR A 484 9.015 -8.164 10.427 1.00 0.00 O ATOM 591 CG2 THR A 484 7.334 -7.502 8.825 1.00 0.00 C ATOM 0 H THR A 484 7.764 -4.672 9.244 1.00 0.00 H new ATOM 0 HA THR A 484 10.086 -5.788 10.024 1.00 0.00 H new ATOM 0 HB THR A 484 7.785 -6.519 10.667 1.00 0.00 H new ATOM 0 HG1 THR A 484 8.363 -8.786 10.813 1.00 0.00 H new ATOM 0 HG21 THR A 484 6.628 -8.198 9.278 1.00 0.00 H new ATOM 0 HG22 THR A 484 6.793 -6.643 8.428 1.00 0.00 H new ATOM 0 HG23 THR A 484 7.867 -8.001 8.016 1.00 0.00 H new ATOM 599 N PHE A 485 9.418 -6.633 6.916 1.00 0.00 N ATOM 600 CA PHE A 485 9.978 -7.230 5.709 1.00 0.00 C ATOM 601 C PHE A 485 11.173 -6.424 5.208 1.00 0.00 C ATOM 602 O PHE A 485 12.169 -6.986 4.755 1.00 0.00 O ATOM 603 CB PHE A 485 8.911 -7.316 4.615 1.00 0.00 C ATOM 604 CG PHE A 485 7.932 -8.436 4.820 1.00 0.00 C ATOM 605 CD1 PHE A 485 6.894 -8.308 5.729 1.00 0.00 C ATOM 606 CD2 PHE A 485 8.049 -9.616 4.104 1.00 0.00 C ATOM 607 CE1 PHE A 485 5.991 -9.338 5.920 1.00 0.00 C ATOM 608 CE2 PHE A 485 7.149 -10.649 4.290 1.00 0.00 C ATOM 609 CZ PHE A 485 6.118 -10.509 5.199 1.00 0.00 C ATOM 0 H PHE A 485 8.525 -6.159 6.777 1.00 0.00 H new ATOM 0 HA PHE A 485 10.318 -8.236 5.955 1.00 0.00 H new ATOM 0 HB2 PHE A 485 8.368 -6.372 4.574 1.00 0.00 H new ATOM 0 HB3 PHE A 485 9.401 -7.444 3.650 1.00 0.00 H new ATOM 0 HD1 PHE A 485 6.789 -7.394 6.295 1.00 0.00 H new ATOM 0 HD2 PHE A 485 8.853 -9.731 3.392 1.00 0.00 H new ATOM 0 HE1 PHE A 485 5.187 -9.227 6.633 1.00 0.00 H new ATOM 0 HE2 PHE A 485 7.252 -11.564 3.726 1.00 0.00 H new ATOM 0 HZ PHE A 485 5.413 -11.314 5.345 1.00 0.00 H new ATOM 619 N GLY A 486 11.064 -5.101 5.292 1.00 0.00 N ATOM 620 CA GLY A 486 12.141 -4.239 4.844 1.00 0.00 C ATOM 621 C GLY A 486 11.898 -2.782 5.185 1.00 0.00 C ATOM 622 O GLY A 486 10.910 -2.448 5.838 1.00 0.00 O ATOM 0 H GLY A 486 10.249 -4.612 5.662 1.00 0.00 H new ATOM 0 HA2 GLY A 486 13.076 -4.564 5.300 1.00 0.00 H new ATOM 0 HA3 GLY A 486 12.259 -4.342 3.765 1.00 0.00 H new ATOM 626 N GLU A 487 12.802 -1.913 4.743 1.00 0.00 N ATOM 627 CA GLU A 487 12.681 -0.484 5.008 1.00 0.00 C ATOM 628 C GLU A 487 11.526 0.121 4.214 1.00 0.00 C ATOM 629 O GLU A 487 11.362 -0.158 3.025 1.00 0.00 O ATOM 630 CB GLU A 487 13.986 0.234 4.660 1.00 0.00 C ATOM 631 CG GLU A 487 14.018 1.687 5.103 1.00 0.00 C ATOM 632 CD GLU A 487 15.386 2.318 4.935 1.00 0.00 C ATOM 633 OE1 GLU A 487 16.302 1.967 5.708 1.00 0.00 O ATOM 634 OE2 GLU A 487 15.541 3.164 4.029 1.00 0.00 O ATOM 0 H GLU A 487 13.625 -2.173 4.200 1.00 0.00 H new ATOM 0 HA GLU A 487 12.476 -0.354 6.071 1.00 0.00 H new ATOM 0 HB2 GLU A 487 14.818 -0.297 5.123 1.00 0.00 H new ATOM 0 HB3 GLU A 487 14.140 0.188 3.582 1.00 0.00 H new ATOM 0 HG2 GLU A 487 13.287 2.255 4.527 1.00 0.00 H new ATOM 0 HG3 GLU A 487 13.719 1.751 6.149 1.00 0.00 H new ATOM 641 N LEU A 488 10.729 0.949 4.879 1.00 0.00 N ATOM 642 CA LEU A 488 9.589 1.594 4.237 1.00 0.00 C ATOM 643 C LEU A 488 9.888 3.060 3.941 1.00 0.00 C ATOM 644 O LEU A 488 10.744 3.671 4.580 1.00 0.00 O ATOM 645 CB LEU A 488 8.348 1.484 5.125 1.00 0.00 C ATOM 646 CG LEU A 488 7.797 0.073 5.337 1.00 0.00 C ATOM 647 CD1 LEU A 488 6.508 0.119 6.143 1.00 0.00 C ATOM 648 CD2 LEU A 488 7.569 -0.617 4.000 1.00 0.00 C ATOM 0 H LEU A 488 10.851 1.190 5.863 1.00 0.00 H new ATOM 0 HA LEU A 488 9.399 1.083 3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 488 8.584 1.910 6.100 1.00 0.00 H new ATOM 0 HB3 LEU A 488 7.560 2.099 4.691 1.00 0.00 H new ATOM 0 HG LEU A 488 8.532 -0.503 5.899 1.00 0.00 H new ATOM 0 HD11 LEU A 488 6.131 -0.894 6.284 1.00 0.00 H new ATOM 0 HD12 LEU A 488 6.703 0.572 7.115 1.00 0.00 H new ATOM 0 HD13 LEU A 488 5.766 0.712 5.609 1.00 0.00 H new ATOM 0 HD21 LEU A 488 7.177 -1.620 4.170 1.00 0.00 H new ATOM 0 HD22 LEU A 488 6.854 -0.043 3.411 1.00 0.00 H new ATOM 0 HD23 LEU A 488 8.513 -0.684 3.459 1.00 0.00 H new ATOM 660 N LYS A 489 9.175 3.620 2.970 1.00 0.00 N ATOM 661 CA LYS A 489 9.360 5.015 2.591 1.00 0.00 C ATOM 662 C LYS A 489 8.431 5.924 3.389 1.00 0.00 C ATOM 663 O LYS A 489 8.861 6.933 3.948 1.00 0.00 O ATOM 664 CB LYS A 489 9.105 5.196 1.093 1.00 0.00 C ATOM 665 CG LYS A 489 10.286 4.803 0.223 1.00 0.00 C ATOM 666 CD LYS A 489 10.260 5.526 -1.113 1.00 0.00 C ATOM 667 CE LYS A 489 10.897 6.904 -1.014 1.00 0.00 C ATOM 668 NZ LYS A 489 10.683 7.704 -2.251 1.00 0.00 N ATOM 0 H LYS A 489 8.463 3.128 2.431 1.00 0.00 H new ATOM 0 HA LYS A 489 10.390 5.292 2.814 1.00 0.00 H new ATOM 0 HB2 LYS A 489 8.239 4.600 0.806 1.00 0.00 H new ATOM 0 HB3 LYS A 489 8.853 6.239 0.899 1.00 0.00 H new ATOM 0 HG2 LYS A 489 11.215 5.033 0.744 1.00 0.00 H new ATOM 0 HG3 LYS A 489 10.273 3.726 0.055 1.00 0.00 H new ATOM 0 HD2 LYS A 489 10.788 4.933 -1.859 1.00 0.00 H new ATOM 0 HD3 LYS A 489 9.230 5.624 -1.455 1.00 0.00 H new ATOM 0 HE2 LYS A 489 10.479 7.437 -0.160 1.00 0.00 H new ATOM 0 HE3 LYS A 489 11.966 6.798 -0.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 489 11.132 8.636 -2.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 489 11.104 7.208 -3.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 489 9.663 7.828 -2.412 1.00 0.00 H new ATOM 682 N THR A 490 7.153 5.559 3.439 1.00 0.00 N ATOM 683 CA THR A 490 6.163 6.341 4.169 1.00 0.00 C ATOM 684 C THR A 490 4.819 5.623 4.214 1.00 0.00 C ATOM 685 O THR A 490 4.318 5.158 3.191 1.00 0.00 O ATOM 686 CB THR A 490 5.968 7.732 3.537 1.00 0.00 C ATOM 687 OG1 THR A 490 5.060 8.507 4.327 1.00 0.00 O ATOM 688 CG2 THR A 490 5.436 7.611 2.117 1.00 0.00 C ATOM 0 H THR A 490 6.780 4.727 2.982 1.00 0.00 H new ATOM 0 HA THR A 490 6.542 6.461 5.184 1.00 0.00 H new ATOM 0 HB THR A 490 6.937 8.231 3.505 1.00 0.00 H new ATOM 0 HG1 THR A 490 4.943 9.390 3.919 1.00 0.00 H new ATOM 0 HG21 THR A 490 5.306 8.606 1.691 1.00 0.00 H new ATOM 0 HG22 THR A 490 6.144 7.046 1.510 1.00 0.00 H new ATOM 0 HG23 THR A 490 4.476 7.094 2.131 1.00 0.00 H new ATOM 696 N VAL A 491 4.240 5.535 5.408 1.00 0.00 N ATOM 697 CA VAL A 491 2.952 4.875 5.586 1.00 0.00 C ATOM 698 C VAL A 491 1.820 5.892 5.673 1.00 0.00 C ATOM 699 O VAL A 491 1.872 6.826 6.474 1.00 0.00 O ATOM 700 CB VAL A 491 2.941 4.000 6.853 1.00 0.00 C ATOM 701 CG1 VAL A 491 1.515 3.637 7.238 1.00 0.00 C ATOM 702 CG2 VAL A 491 3.781 2.749 6.645 1.00 0.00 C ATOM 0 H VAL A 491 4.643 5.912 6.266 1.00 0.00 H new ATOM 0 HA VAL A 491 2.798 4.240 4.714 1.00 0.00 H new ATOM 0 HB VAL A 491 3.379 4.571 7.672 1.00 0.00 H new ATOM 0 HG11 VAL A 491 1.527 3.019 8.135 1.00 0.00 H new ATOM 0 HG12 VAL A 491 0.948 4.547 7.432 1.00 0.00 H new ATOM 0 HG13 VAL A 491 1.047 3.085 6.423 1.00 0.00 H new ATOM 0 HG21 VAL A 491 3.762 2.143 7.551 1.00 0.00 H new ATOM 0 HG22 VAL A 491 3.375 2.172 5.814 1.00 0.00 H new ATOM 0 HG23 VAL A 491 4.809 3.034 6.421 1.00 0.00 H new ATOM 712 N ARG A 492 0.798 5.705 4.844 1.00 0.00 N ATOM 713 CA ARG A 492 -0.347 6.607 4.827 1.00 0.00 C ATOM 714 C ARG A 492 -1.628 5.865 5.197 1.00 0.00 C ATOM 715 O ARG A 492 -1.934 4.813 4.634 1.00 0.00 O ATOM 716 CB ARG A 492 -0.497 7.249 3.447 1.00 0.00 C ATOM 717 CG ARG A 492 0.748 7.987 2.980 1.00 0.00 C ATOM 718 CD ARG A 492 1.013 9.222 3.826 1.00 0.00 C ATOM 719 NE ARG A 492 0.290 10.390 3.332 1.00 0.00 N ATOM 720 CZ ARG A 492 -0.945 10.704 3.709 1.00 0.00 C ATOM 721 NH1 ARG A 492 -1.590 9.940 4.580 1.00 0.00 N ATOM 722 NH2 ARG A 492 -1.537 11.784 3.214 1.00 0.00 N ATOM 0 H ARG A 492 0.740 4.937 4.175 1.00 0.00 H new ATOM 0 HA ARG A 492 -0.173 7.389 5.566 1.00 0.00 H new ATOM 0 HB2 ARG A 492 -0.744 6.475 2.720 1.00 0.00 H new ATOM 0 HB3 ARG A 492 -1.335 7.945 3.469 1.00 0.00 H new ATOM 0 HG2 ARG A 492 1.608 7.319 3.029 1.00 0.00 H new ATOM 0 HG3 ARG A 492 0.630 8.278 1.936 1.00 0.00 H new ATOM 0 HD2 ARG A 492 0.721 9.024 4.857 1.00 0.00 H new ATOM 0 HD3 ARG A 492 2.082 9.434 3.833 1.00 0.00 H new ATOM 0 HE ARG A 492 0.758 10.998 2.661 1.00 0.00 H new ATOM 0 HH11 ARG A 492 -1.138 9.109 4.962 1.00 0.00 H new ATOM 0 HH12 ARG A 492 -2.538 10.183 4.868 1.00 0.00 H new ATOM 0 HH21 ARG A 492 -1.044 12.374 2.544 1.00 0.00 H new ATOM 0 HH22 ARG A 492 -2.485 12.024 3.504 1.00 0.00 H new ATOM 736 N LEU A 493 -2.374 6.420 6.146 1.00 0.00 N ATOM 737 CA LEU A 493 -3.623 5.812 6.592 1.00 0.00 C ATOM 738 C LEU A 493 -4.696 6.873 6.814 1.00 0.00 C ATOM 739 O LEU A 493 -4.430 7.965 7.316 1.00 0.00 O ATOM 740 CB LEU A 493 -3.396 5.021 7.881 1.00 0.00 C ATOM 741 CG LEU A 493 -2.999 3.555 7.709 1.00 0.00 C ATOM 742 CD1 LEU A 493 -1.490 3.422 7.576 1.00 0.00 C ATOM 743 CD2 LEU A 493 -3.509 2.723 8.877 1.00 0.00 C ATOM 0 H LEU A 493 -2.136 7.290 6.622 1.00 0.00 H new ATOM 0 HA LEU A 493 -3.967 5.132 5.812 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -2.619 5.522 8.458 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -4.310 5.062 8.474 1.00 0.00 H new ATOM 0 HG LEU A 493 -3.458 3.180 6.794 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -1.227 2.371 7.454 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -1.150 3.984 6.706 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -1.010 3.815 8.472 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -3.217 1.682 8.737 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -3.080 3.099 9.806 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.596 2.791 8.925 1.00 0.00 H new ATOM 755 N PRO A 494 -5.940 6.545 6.434 1.00 0.00 N ATOM 756 CA PRO A 494 -7.079 7.455 6.585 1.00 0.00 C ATOM 757 C PRO A 494 -7.472 7.655 8.045 1.00 0.00 C ATOM 758 O PRO A 494 -7.890 6.714 8.721 1.00 0.00 O ATOM 759 CB PRO A 494 -8.202 6.747 5.821 1.00 0.00 C ATOM 760 CG PRO A 494 -7.833 5.304 5.857 1.00 0.00 C ATOM 761 CD PRO A 494 -6.330 5.260 5.829 1.00 0.00 C ATOM 0 HA PRO A 494 -6.855 8.454 6.212 1.00 0.00 H new ATOM 0 HB2 PRO A 494 -9.170 6.920 6.290 1.00 0.00 H new ATOM 0 HB3 PRO A 494 -8.275 7.112 4.796 1.00 0.00 H new ATOM 0 HG2 PRO A 494 -8.221 4.824 6.756 1.00 0.00 H new ATOM 0 HG3 PRO A 494 -8.255 4.772 5.004 1.00 0.00 H new ATOM 0 HD2 PRO A 494 -5.942 4.414 6.397 1.00 0.00 H new ATOM 0 HD3 PRO A 494 -5.950 5.163 4.812 1.00 0.00 H new ATOM 769 N LYS A 495 -7.337 8.886 8.526 1.00 0.00 N ATOM 770 CA LYS A 495 -7.680 9.211 9.905 1.00 0.00 C ATOM 771 C LYS A 495 -8.683 10.358 9.961 1.00 0.00 C ATOM 772 O LYS A 495 -8.352 11.503 9.653 1.00 0.00 O ATOM 773 CB LYS A 495 -6.420 9.583 10.691 1.00 0.00 C ATOM 774 CG LYS A 495 -5.339 10.224 9.839 1.00 0.00 C ATOM 775 CD LYS A 495 -4.267 10.876 10.696 1.00 0.00 C ATOM 776 CE LYS A 495 -4.708 12.244 11.194 1.00 0.00 C ATOM 777 NZ LYS A 495 -3.696 12.858 12.097 1.00 0.00 N ATOM 0 H LYS A 495 -6.992 9.676 7.980 1.00 0.00 H new ATOM 0 HA LYS A 495 -8.137 8.330 10.356 1.00 0.00 H new ATOM 0 HB2 LYS A 495 -6.692 10.268 11.494 1.00 0.00 H new ATOM 0 HB3 LYS A 495 -6.017 8.686 11.160 1.00 0.00 H new ATOM 0 HG2 LYS A 495 -4.884 9.469 9.198 1.00 0.00 H new ATOM 0 HG3 LYS A 495 -5.786 10.971 9.183 1.00 0.00 H new ATOM 0 HD2 LYS A 495 -4.039 10.234 11.547 1.00 0.00 H new ATOM 0 HD3 LYS A 495 -3.349 10.977 10.118 1.00 0.00 H new ATOM 0 HE2 LYS A 495 -4.882 12.902 10.342 1.00 0.00 H new ATOM 0 HE3 LYS A 495 -5.657 12.150 11.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 495 -4.034 13.789 12.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 495 -3.549 12.243 12.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 495 -2.798 12.972 11.585 1.00 0.00 H new ATOM 791 N LYS A 496 -9.912 10.044 10.357 1.00 0.00 N ATOM 792 CA LYS A 496 -10.965 11.048 10.456 1.00 0.00 C ATOM 793 C LYS A 496 -11.074 11.583 11.881 1.00 0.00 C ATOM 794 O LYS A 496 -11.538 10.885 12.782 1.00 0.00 O ATOM 795 CB LYS A 496 -12.306 10.456 10.019 1.00 0.00 C ATOM 796 CG LYS A 496 -12.575 10.593 8.530 1.00 0.00 C ATOM 797 CD LYS A 496 -13.986 10.155 8.176 1.00 0.00 C ATOM 798 CE LYS A 496 -14.061 8.655 7.939 1.00 0.00 C ATOM 799 NZ LYS A 496 -15.467 8.164 7.934 1.00 0.00 N ATOM 0 H LYS A 496 -10.204 9.101 10.615 1.00 0.00 H new ATOM 0 HA LYS A 496 -10.707 11.875 9.794 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -12.333 9.400 10.289 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -13.108 10.947 10.571 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.428 11.630 8.227 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -11.856 9.993 7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.667 10.432 8.981 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -14.318 10.683 7.282 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -13.589 8.414 6.987 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -13.498 8.136 8.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -15.476 7.137 7.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -15.910 8.371 8.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -15.998 8.640 7.177 1.00 0.00 H new ATOM 813 N MET A 497 -10.645 12.826 12.076 1.00 0.00 N ATOM 814 CA MET A 497 -10.697 13.454 13.390 1.00 0.00 C ATOM 815 C MET A 497 -12.111 13.930 13.710 1.00 0.00 C ATOM 816 O MET A 497 -12.364 15.130 13.820 1.00 0.00 O ATOM 817 CB MET A 497 -9.723 14.632 13.455 1.00 0.00 C ATOM 818 CG MET A 497 -9.324 15.013 14.871 1.00 0.00 C ATOM 819 SD MET A 497 -8.048 16.287 14.914 1.00 0.00 S ATOM 820 CE MET A 497 -6.748 15.435 15.805 1.00 0.00 C ATOM 0 H MET A 497 -10.258 13.417 11.341 1.00 0.00 H new ATOM 0 HA MET A 497 -10.406 12.710 14.132 1.00 0.00 H new ATOM 0 HB2 MET A 497 -8.826 14.383 12.888 1.00 0.00 H new ATOM 0 HB3 MET A 497 -10.177 15.496 12.969 1.00 0.00 H new ATOM 0 HG2 MET A 497 -10.203 15.367 15.409 1.00 0.00 H new ATOM 0 HG3 MET A 497 -8.965 14.127 15.394 1.00 0.00 H new ATOM 0 HE1 MET A 497 -5.887 16.095 15.912 1.00 0.00 H new ATOM 0 HE2 MET A 497 -7.111 15.148 16.792 1.00 0.00 H new ATOM 0 HE3 MET A 497 -6.454 14.542 15.253 1.00 0.00 H new ATOM 830 N THR A 498 -13.031 12.981 13.857 1.00 0.00 N ATOM 831 CA THR A 498 -14.419 13.304 14.162 1.00 0.00 C ATOM 832 C THR A 498 -14.796 12.840 15.564 1.00 0.00 C ATOM 833 O THR A 498 -15.678 11.999 15.735 1.00 0.00 O ATOM 834 CB THR A 498 -15.381 12.661 13.145 1.00 0.00 C ATOM 835 OG1 THR A 498 -15.298 11.234 13.226 1.00 0.00 O ATOM 836 CG2 THR A 498 -15.054 13.113 11.730 1.00 0.00 C ATOM 0 H THR A 498 -12.839 11.983 13.770 1.00 0.00 H new ATOM 0 HA THR A 498 -14.512 14.389 14.104 1.00 0.00 H new ATOM 0 HB THR A 498 -16.395 12.980 13.386 1.00 0.00 H new ATOM 0 HG1 THR A 498 -15.542 10.943 14.129 1.00 0.00 H new ATOM 0 HG21 THR A 498 -15.746 12.646 11.030 1.00 0.00 H new ATOM 0 HG22 THR A 498 -15.147 14.197 11.664 1.00 0.00 H new ATOM 0 HG23 THR A 498 -14.034 12.820 11.481 1.00 0.00 H new ATOM 844 N GLY A 499 -14.122 13.394 16.567 1.00 0.00 N ATOM 845 CA GLY A 499 -14.401 13.025 17.943 1.00 0.00 C ATOM 846 C GLY A 499 -13.779 11.697 18.324 1.00 0.00 C ATOM 847 O GLY A 499 -12.581 11.620 18.599 1.00 0.00 O ATOM 0 H GLY A 499 -13.387 14.092 16.451 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -14.025 13.803 18.608 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -15.480 12.973 18.091 1.00 0.00 H new ATOM 851 N THR A 500 -14.594 10.647 18.344 1.00 0.00 N ATOM 852 CA THR A 500 -14.117 9.316 18.698 1.00 0.00 C ATOM 853 C THR A 500 -13.008 8.860 17.756 1.00 0.00 C ATOM 854 O THR A 500 -12.201 8.000 18.102 1.00 0.00 O ATOM 855 CB THR A 500 -15.259 8.283 18.665 1.00 0.00 C ATOM 856 OG1 THR A 500 -16.440 8.840 19.253 1.00 0.00 O ATOM 857 CG2 THR A 500 -14.865 7.016 19.410 1.00 0.00 C ATOM 0 H THR A 500 -15.588 10.693 18.119 1.00 0.00 H new ATOM 0 HA THR A 500 -13.724 9.381 19.713 1.00 0.00 H new ATOM 0 HB THR A 500 -15.457 8.027 17.624 1.00 0.00 H new ATOM 0 HG1 THR A 500 -17.162 8.178 19.227 1.00 0.00 H new ATOM 0 HG21 THR A 500 -15.687 6.302 19.373 1.00 0.00 H new ATOM 0 HG22 THR A 500 -13.983 6.578 18.943 1.00 0.00 H new ATOM 0 HG23 THR A 500 -14.642 7.259 20.449 1.00 0.00 H new ATOM 865 N GLY A 501 -12.975 9.445 16.562 1.00 0.00 N ATOM 866 CA GLY A 501 -11.960 9.086 15.588 1.00 0.00 C ATOM 867 C GLY A 501 -12.350 7.875 14.764 1.00 0.00 C ATOM 868 O GLY A 501 -12.400 6.758 15.277 1.00 0.00 O ATOM 0 H GLY A 501 -13.633 10.161 16.252 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -11.783 9.932 14.924 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -11.021 8.884 16.104 1.00 0.00 H new ATOM 872 N ALA A 502 -12.628 8.097 13.484 1.00 0.00 N ATOM 873 CA ALA A 502 -13.014 7.015 12.587 1.00 0.00 C ATOM 874 C ALA A 502 -11.889 6.679 11.615 1.00 0.00 C ATOM 875 O ALA A 502 -11.335 7.563 10.960 1.00 0.00 O ATOM 876 CB ALA A 502 -14.278 7.387 11.826 1.00 0.00 C ATOM 0 H ALA A 502 -12.593 9.017 13.045 1.00 0.00 H new ATOM 0 HA ALA A 502 -13.213 6.129 13.191 1.00 0.00 H new ATOM 0 HB1 ALA A 502 -14.555 6.570 11.160 1.00 0.00 H new ATOM 0 HB2 ALA A 502 -15.088 7.570 12.533 1.00 0.00 H new ATOM 0 HB3 ALA A 502 -14.098 8.288 11.240 1.00 0.00 H new ATOM 882 N HIS A 503 -11.554 5.396 11.525 1.00 0.00 N ATOM 883 CA HIS A 503 -10.493 4.943 10.632 1.00 0.00 C ATOM 884 C HIS A 503 -11.055 4.050 9.530 1.00 0.00 C ATOM 885 O HIS A 503 -11.723 3.053 9.806 1.00 0.00 O ATOM 886 CB HIS A 503 -9.422 4.188 11.420 1.00 0.00 C ATOM 887 CG HIS A 503 -8.678 3.177 10.602 1.00 0.00 C ATOM 888 ND1 HIS A 503 -9.077 1.862 10.486 1.00 0.00 N ATOM 889 CD2 HIS A 503 -7.555 3.296 9.857 1.00 0.00 C ATOM 890 CE1 HIS A 503 -8.230 1.215 9.705 1.00 0.00 C ATOM 891 NE2 HIS A 503 -7.297 2.063 9.310 1.00 0.00 N ATOM 0 H HIS A 503 -12.002 4.651 12.059 1.00 0.00 H new ATOM 0 HA HIS A 503 -10.042 5.821 10.169 1.00 0.00 H new ATOM 0 HB2 HIS A 503 -8.711 4.905 11.831 1.00 0.00 H new ATOM 0 HB3 HIS A 503 -9.891 3.685 12.265 1.00 0.00 H new ATOM 0 HD2 HIS A 503 -6.970 4.193 9.718 1.00 0.00 H new ATOM 0 HE1 HIS A 503 -8.290 0.171 9.435 1.00 0.00 H new ATOM 0 HE2 HIS A 503 -6.512 1.838 8.698 1.00 0.00 H new ATOM 899 N ARG A 504 -10.781 4.414 8.282 1.00 0.00 N ATOM 900 CA ARG A 504 -11.261 3.648 7.139 1.00 0.00 C ATOM 901 C ARG A 504 -10.518 2.320 7.025 1.00 0.00 C ATOM 902 O ARG A 504 -9.449 2.143 7.607 1.00 0.00 O ATOM 903 CB ARG A 504 -11.090 4.453 5.849 1.00 0.00 C ATOM 904 CG ARG A 504 -12.286 5.330 5.516 1.00 0.00 C ATOM 905 CD ARG A 504 -13.462 4.503 5.021 1.00 0.00 C ATOM 906 NE ARG A 504 -13.367 4.215 3.593 1.00 0.00 N ATOM 907 CZ ARG A 504 -14.412 3.898 2.836 1.00 0.00 C ATOM 908 NH1 ARG A 504 -15.624 3.828 3.368 1.00 0.00 N ATOM 909 NH2 ARG A 504 -14.245 3.649 1.543 1.00 0.00 N ATOM 0 H ARG A 504 -10.228 5.236 8.037 1.00 0.00 H new ATOM 0 HA ARG A 504 -12.320 3.441 7.291 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -10.203 5.081 5.937 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -10.913 3.765 5.022 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -12.583 5.894 6.400 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -12.005 6.057 4.754 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -13.506 3.567 5.577 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -14.391 5.037 5.222 1.00 0.00 H new ATOM 0 HE ARG A 504 -12.448 4.260 3.152 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -15.757 4.018 4.361 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -16.424 3.584 2.784 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -13.314 3.701 1.130 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -15.048 3.406 0.963 1.00 0.00 H new ATOM 923 N GLY A 505 -11.094 1.388 6.270 1.00 0.00 N ATOM 924 CA GLY A 505 -10.473 0.089 6.093 1.00 0.00 C ATOM 925 C GLY A 505 -9.559 0.042 4.885 1.00 0.00 C ATOM 926 O GLY A 505 -9.733 -0.793 3.997 1.00 0.00 O ATOM 0 H GLY A 505 -11.979 1.510 5.778 1.00 0.00 H new ATOM 0 HA2 GLY A 505 -9.902 -0.162 6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 505 -11.249 -0.669 5.987 1.00 0.00 H new ATOM 930 N PHE A 506 -8.582 0.942 4.849 1.00 0.00 N ATOM 931 CA PHE A 506 -7.638 1.002 3.738 1.00 0.00 C ATOM 932 C PHE A 506 -6.381 1.771 4.134 1.00 0.00 C ATOM 933 O PHE A 506 -6.449 2.761 4.861 1.00 0.00 O ATOM 934 CB PHE A 506 -8.291 1.661 2.522 1.00 0.00 C ATOM 935 CG PHE A 506 -8.217 3.162 2.541 1.00 0.00 C ATOM 936 CD1 PHE A 506 -6.999 3.810 2.418 1.00 0.00 C ATOM 937 CD2 PHE A 506 -9.366 3.923 2.681 1.00 0.00 C ATOM 938 CE1 PHE A 506 -6.928 5.190 2.436 1.00 0.00 C ATOM 939 CE2 PHE A 506 -9.302 5.304 2.700 1.00 0.00 C ATOM 940 CZ PHE A 506 -8.081 5.938 2.576 1.00 0.00 C ATOM 0 H PHE A 506 -8.423 1.640 5.576 1.00 0.00 H new ATOM 0 HA PHE A 506 -7.353 -0.018 3.480 1.00 0.00 H new ATOM 0 HB2 PHE A 506 -7.809 1.293 1.617 1.00 0.00 H new ATOM 0 HB3 PHE A 506 -9.337 1.357 2.472 1.00 0.00 H new ATOM 0 HD1 PHE A 506 -6.095 3.230 2.307 1.00 0.00 H new ATOM 0 HD2 PHE A 506 -10.323 3.432 2.776 1.00 0.00 H new ATOM 0 HE1 PHE A 506 -5.972 5.683 2.341 1.00 0.00 H new ATOM 0 HE2 PHE A 506 -10.205 5.886 2.812 1.00 0.00 H new ATOM 0 HZ PHE A 506 -8.028 7.017 2.588 1.00 0.00 H new ATOM 950 N GLY A 507 -5.233 1.307 3.650 1.00 0.00 N ATOM 951 CA GLY A 507 -3.977 1.961 3.964 1.00 0.00 C ATOM 952 C GLY A 507 -2.953 1.813 2.856 1.00 0.00 C ATOM 953 O GLY A 507 -2.897 0.781 2.186 1.00 0.00 O ATOM 0 H GLY A 507 -5.151 0.489 3.046 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -4.158 3.020 4.148 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -3.573 1.542 4.886 1.00 0.00 H new ATOM 957 N PHE A 508 -2.141 2.847 2.660 1.00 0.00 N ATOM 958 CA PHE A 508 -1.116 2.828 1.623 1.00 0.00 C ATOM 959 C PHE A 508 0.272 2.663 2.234 1.00 0.00 C ATOM 960 O PHE A 508 0.630 3.355 3.187 1.00 0.00 O ATOM 961 CB PHE A 508 -1.173 4.115 0.797 1.00 0.00 C ATOM 962 CG PHE A 508 -2.325 4.160 -0.165 1.00 0.00 C ATOM 963 CD1 PHE A 508 -2.235 3.545 -1.403 1.00 0.00 C ATOM 964 CD2 PHE A 508 -3.498 4.817 0.169 1.00 0.00 C ATOM 965 CE1 PHE A 508 -3.294 3.584 -2.291 1.00 0.00 C ATOM 966 CE2 PHE A 508 -4.560 4.860 -0.714 1.00 0.00 C ATOM 967 CZ PHE A 508 -4.458 4.243 -1.946 1.00 0.00 C ATOM 0 H PHE A 508 -2.173 3.708 3.206 1.00 0.00 H new ATOM 0 HA PHE A 508 -1.310 1.977 0.970 1.00 0.00 H new ATOM 0 HB2 PHE A 508 -1.241 4.968 1.472 1.00 0.00 H new ATOM 0 HB3 PHE A 508 -0.242 4.222 0.241 1.00 0.00 H new ATOM 0 HD1 PHE A 508 -1.327 3.029 -1.678 1.00 0.00 H new ATOM 0 HD2 PHE A 508 -3.583 5.301 1.131 1.00 0.00 H new ATOM 0 HE1 PHE A 508 -3.211 3.100 -3.253 1.00 0.00 H new ATOM 0 HE2 PHE A 508 -5.469 5.375 -0.441 1.00 0.00 H new ATOM 0 HZ PHE A 508 -5.287 4.276 -2.638 1.00 0.00 H new ATOM 977 N VAL A 509 1.051 1.740 1.677 1.00 0.00 N ATOM 978 CA VAL A 509 2.400 1.483 2.166 1.00 0.00 C ATOM 979 C VAL A 509 3.418 1.554 1.033 1.00 0.00 C ATOM 980 O VAL A 509 3.289 0.858 0.025 1.00 0.00 O ATOM 981 CB VAL A 509 2.498 0.103 2.844 1.00 0.00 C ATOM 982 CG1 VAL A 509 3.924 -0.168 3.299 1.00 0.00 C ATOM 983 CG2 VAL A 509 1.530 0.015 4.014 1.00 0.00 C ATOM 0 H VAL A 509 0.771 1.159 0.887 1.00 0.00 H new ATOM 0 HA VAL A 509 2.623 2.257 2.900 1.00 0.00 H new ATOM 0 HB VAL A 509 2.223 -0.661 2.117 1.00 0.00 H new ATOM 0 HG11 VAL A 509 3.974 -1.147 3.776 1.00 0.00 H new ATOM 0 HG12 VAL A 509 4.591 -0.150 2.437 1.00 0.00 H new ATOM 0 HG13 VAL A 509 4.231 0.598 4.011 1.00 0.00 H new ATOM 0 HG21 VAL A 509 1.612 -0.966 4.481 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.772 0.787 4.745 1.00 0.00 H new ATOM 0 HG23 VAL A 509 0.511 0.162 3.655 1.00 0.00 H new ATOM 993 N ASP A 510 4.429 2.398 1.205 1.00 0.00 N ATOM 994 CA ASP A 510 5.471 2.559 0.197 1.00 0.00 C ATOM 995 C ASP A 510 6.778 1.925 0.661 1.00 0.00 C ATOM 996 O ASP A 510 7.147 2.024 1.832 1.00 0.00 O ATOM 997 CB ASP A 510 5.689 4.041 -0.109 1.00 0.00 C ATOM 998 CG ASP A 510 6.573 4.258 -1.321 1.00 0.00 C ATOM 999 OD1 ASP A 510 7.633 3.603 -1.407 1.00 0.00 O ATOM 1000 OD2 ASP A 510 6.204 5.081 -2.184 1.00 0.00 O ATOM 0 H ASP A 510 4.549 2.981 2.033 1.00 0.00 H new ATOM 0 HA ASP A 510 5.145 2.053 -0.712 1.00 0.00 H new ATOM 0 HB2 ASP A 510 4.724 4.520 -0.276 1.00 0.00 H new ATOM 0 HB3 ASP A 510 6.140 4.525 0.757 1.00 0.00 H new ATOM 1005 N PHE A 511 7.474 1.272 -0.264 1.00 0.00 N ATOM 1006 CA PHE A 511 8.740 0.619 0.051 1.00 0.00 C ATOM 1007 C PHE A 511 9.902 1.325 -0.641 1.00 0.00 C ATOM 1008 O PHE A 511 9.766 1.814 -1.763 1.00 0.00 O ATOM 1009 CB PHE A 511 8.698 -0.851 -0.370 1.00 0.00 C ATOM 1010 CG PHE A 511 8.200 -1.770 0.709 1.00 0.00 C ATOM 1011 CD1 PHE A 511 6.859 -1.791 1.055 1.00 0.00 C ATOM 1012 CD2 PHE A 511 9.074 -2.612 1.378 1.00 0.00 C ATOM 1013 CE1 PHE A 511 6.398 -2.634 2.048 1.00 0.00 C ATOM 1014 CE2 PHE A 511 8.619 -3.458 2.372 1.00 0.00 C ATOM 1015 CZ PHE A 511 7.279 -3.470 2.707 1.00 0.00 C ATOM 0 H PHE A 511 7.183 1.181 -1.237 1.00 0.00 H new ATOM 0 HA PHE A 511 8.892 0.677 1.129 1.00 0.00 H new ATOM 0 HB2 PHE A 511 8.057 -0.952 -1.246 1.00 0.00 H new ATOM 0 HB3 PHE A 511 9.698 -1.164 -0.669 1.00 0.00 H new ATOM 0 HD1 PHE A 511 6.165 -1.141 0.543 1.00 0.00 H new ATOM 0 HD2 PHE A 511 10.123 -2.607 1.120 1.00 0.00 H new ATOM 0 HE1 PHE A 511 5.350 -2.639 2.309 1.00 0.00 H new ATOM 0 HE2 PHE A 511 9.311 -4.109 2.886 1.00 0.00 H new ATOM 0 HZ PHE A 511 6.921 -4.131 3.482 1.00 0.00 H new ATOM 1025 N ILE A 512 11.044 1.374 0.036 1.00 0.00 N ATOM 1026 CA ILE A 512 12.231 2.019 -0.513 1.00 0.00 C ATOM 1027 C ILE A 512 12.502 1.549 -1.938 1.00 0.00 C ATOM 1028 O ILE A 512 12.675 2.360 -2.849 1.00 0.00 O ATOM 1029 CB ILE A 512 13.474 1.742 0.353 1.00 0.00 C ATOM 1030 CG1 ILE A 512 13.222 2.175 1.799 1.00 0.00 C ATOM 1031 CG2 ILE A 512 14.687 2.461 -0.217 1.00 0.00 C ATOM 1032 CD1 ILE A 512 12.948 3.656 1.947 1.00 0.00 C ATOM 0 H ILE A 512 11.173 0.975 0.966 1.00 0.00 H new ATOM 0 HA ILE A 512 12.034 3.091 -0.518 1.00 0.00 H new ATOM 0 HB ILE A 512 13.674 0.670 0.344 1.00 0.00 H new ATOM 0 HG12 ILE A 512 12.374 1.616 2.195 1.00 0.00 H new ATOM 0 HG13 ILE A 512 14.089 1.912 2.405 1.00 0.00 H new ATOM 0 HG21 ILE A 512 15.558 2.256 0.406 1.00 0.00 H new ATOM 0 HG22 ILE A 512 14.875 2.109 -1.231 1.00 0.00 H new ATOM 0 HG23 ILE A 512 14.499 3.534 -0.235 1.00 0.00 H new ATOM 0 HD11 ILE A 512 12.779 3.891 2.998 1.00 0.00 H new ATOM 0 HD12 ILE A 512 13.804 4.223 1.582 1.00 0.00 H new ATOM 0 HD13 ILE A 512 12.063 3.922 1.368 1.00 0.00 H new ATOM 1044 N THR A 513 12.537 0.233 -2.125 1.00 0.00 N ATOM 1045 CA THR A 513 12.787 -0.346 -3.438 1.00 0.00 C ATOM 1046 C THR A 513 11.649 -1.270 -3.857 1.00 0.00 C ATOM 1047 O THR A 513 10.789 -1.619 -3.048 1.00 0.00 O ATOM 1048 CB THR A 513 14.109 -1.135 -3.463 1.00 0.00 C ATOM 1049 OG1 THR A 513 14.095 -2.146 -2.449 1.00 0.00 O ATOM 1050 CG2 THR A 513 15.296 -0.208 -3.244 1.00 0.00 C ATOM 0 H THR A 513 12.395 -0.452 -1.382 1.00 0.00 H new ATOM 0 HA THR A 513 12.855 0.484 -4.141 1.00 0.00 H new ATOM 0 HB THR A 513 14.209 -1.604 -4.442 1.00 0.00 H new ATOM 0 HG1 THR A 513 13.888 -1.738 -1.583 1.00 0.00 H new ATOM 0 HG21 THR A 513 16.219 -0.787 -3.266 1.00 0.00 H new ATOM 0 HG22 THR A 513 15.321 0.544 -4.033 1.00 0.00 H new ATOM 0 HG23 THR A 513 15.199 0.284 -2.276 1.00 0.00 H new ATOM 1058 N LYS A 514 11.650 -1.664 -5.126 1.00 0.00 N ATOM 1059 CA LYS A 514 10.619 -2.550 -5.653 1.00 0.00 C ATOM 1060 C LYS A 514 10.737 -3.944 -5.045 1.00 0.00 C ATOM 1061 O LYS A 514 9.799 -4.439 -4.420 1.00 0.00 O ATOM 1062 CB LYS A 514 10.722 -2.636 -7.178 1.00 0.00 C ATOM 1063 CG LYS A 514 10.419 -1.326 -7.883 1.00 0.00 C ATOM 1064 CD LYS A 514 10.493 -1.475 -9.393 1.00 0.00 C ATOM 1065 CE LYS A 514 10.067 -0.198 -10.101 1.00 0.00 C ATOM 1066 NZ LYS A 514 11.195 0.765 -10.236 1.00 0.00 N ATOM 0 H LYS A 514 12.354 -1.383 -5.809 1.00 0.00 H new ATOM 0 HA LYS A 514 9.647 -2.137 -5.384 1.00 0.00 H new ATOM 0 HB2 LYS A 514 11.727 -2.960 -7.448 1.00 0.00 H new ATOM 0 HB3 LYS A 514 10.033 -3.400 -7.538 1.00 0.00 H new ATOM 0 HG2 LYS A 514 9.425 -0.980 -7.599 1.00 0.00 H new ATOM 0 HG3 LYS A 514 11.127 -0.564 -7.557 1.00 0.00 H new ATOM 0 HD2 LYS A 514 11.511 -1.732 -9.685 1.00 0.00 H new ATOM 0 HD3 LYS A 514 9.853 -2.299 -9.710 1.00 0.00 H new ATOM 0 HE2 LYS A 514 9.679 -0.443 -11.090 1.00 0.00 H new ATOM 0 HE3 LYS A 514 9.254 0.271 -9.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 514 10.864 1.622 -10.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 514 11.549 1.019 -9.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 514 11.961 0.328 -10.787 1.00 0.00 H new ATOM 1080 N GLN A 515 11.894 -4.570 -5.233 1.00 0.00 N ATOM 1081 CA GLN A 515 12.133 -5.907 -4.702 1.00 0.00 C ATOM 1082 C GLN A 515 11.430 -6.094 -3.361 1.00 0.00 C ATOM 1083 O GLN A 515 10.600 -6.990 -3.204 1.00 0.00 O ATOM 1084 CB GLN A 515 13.634 -6.154 -4.543 1.00 0.00 C ATOM 1085 CG GLN A 515 14.335 -6.504 -5.846 1.00 0.00 C ATOM 1086 CD GLN A 515 15.825 -6.717 -5.669 1.00 0.00 C ATOM 1087 OE1 GLN A 515 16.314 -7.845 -5.725 1.00 0.00 O ATOM 1088 NE2 GLN A 515 16.557 -5.630 -5.453 1.00 0.00 N ATOM 0 H GLN A 515 12.680 -4.174 -5.748 1.00 0.00 H new ATOM 0 HA GLN A 515 11.726 -6.630 -5.409 1.00 0.00 H new ATOM 0 HB2 GLN A 515 14.097 -5.263 -4.119 1.00 0.00 H new ATOM 0 HB3 GLN A 515 13.787 -6.963 -3.829 1.00 0.00 H new ATOM 0 HG2 GLN A 515 13.890 -7.408 -6.262 1.00 0.00 H new ATOM 0 HG3 GLN A 515 14.170 -5.705 -6.569 1.00 0.00 H new ATOM 0 HE21 GLN A 515 16.110 -4.714 -5.414 1.00 0.00 H new ATOM 0 HE22 GLN A 515 17.566 -5.711 -5.326 1.00 0.00 H new ATOM 1097 N ASP A 516 11.768 -5.244 -2.398 1.00 0.00 N ATOM 1098 CA ASP A 516 11.169 -5.315 -1.071 1.00 0.00 C ATOM 1099 C ASP A 516 9.646 -5.333 -1.162 1.00 0.00 C ATOM 1100 O ASP A 516 8.986 -6.149 -0.520 1.00 0.00 O ATOM 1101 CB ASP A 516 11.627 -4.131 -0.217 1.00 0.00 C ATOM 1102 CG ASP A 516 13.127 -3.919 -0.279 1.00 0.00 C ATOM 1103 OD1 ASP A 516 13.853 -4.896 -0.555 1.00 0.00 O ATOM 1104 OD2 ASP A 516 13.574 -2.775 -0.050 1.00 0.00 O ATOM 0 H ASP A 516 12.454 -4.498 -2.512 1.00 0.00 H new ATOM 0 HA ASP A 516 11.498 -6.241 -0.600 1.00 0.00 H new ATOM 0 HB2 ASP A 516 11.121 -3.226 -0.554 1.00 0.00 H new ATOM 0 HB3 ASP A 516 11.329 -4.296 0.818 1.00 0.00 H new ATOM 1109 N ALA A 517 9.096 -4.428 -1.964 1.00 0.00 N ATOM 1110 CA ALA A 517 7.652 -4.340 -2.140 1.00 0.00 C ATOM 1111 C ALA A 517 7.073 -5.674 -2.602 1.00 0.00 C ATOM 1112 O ALA A 517 6.238 -6.269 -1.921 1.00 0.00 O ATOM 1113 CB ALA A 517 7.306 -3.241 -3.133 1.00 0.00 C ATOM 0 H ALA A 517 9.629 -3.745 -2.502 1.00 0.00 H new ATOM 0 HA ALA A 517 7.208 -4.095 -1.175 1.00 0.00 H new ATOM 0 HB1 ALA A 517 6.224 -3.187 -3.254 1.00 0.00 H new ATOM 0 HB2 ALA A 517 7.677 -2.286 -2.762 1.00 0.00 H new ATOM 0 HB3 ALA A 517 7.768 -3.461 -4.095 1.00 0.00 H new ATOM 1119 N LYS A 518 7.523 -6.137 -3.763 1.00 0.00 N ATOM 1120 CA LYS A 518 7.051 -7.401 -4.317 1.00 0.00 C ATOM 1121 C LYS A 518 7.181 -8.526 -3.294 1.00 0.00 C ATOM 1122 O LYS A 518 6.254 -9.312 -3.100 1.00 0.00 O ATOM 1123 CB LYS A 518 7.838 -7.753 -5.581 1.00 0.00 C ATOM 1124 CG LYS A 518 7.670 -6.744 -6.703 1.00 0.00 C ATOM 1125 CD LYS A 518 7.961 -7.364 -8.059 1.00 0.00 C ATOM 1126 CE LYS A 518 7.558 -6.436 -9.195 1.00 0.00 C ATOM 1127 NZ LYS A 518 8.564 -5.361 -9.418 1.00 0.00 N ATOM 0 H LYS A 518 8.214 -5.656 -4.339 1.00 0.00 H new ATOM 0 HA LYS A 518 5.998 -7.286 -4.573 1.00 0.00 H new ATOM 0 HB2 LYS A 518 8.896 -7.832 -5.330 1.00 0.00 H new ATOM 0 HB3 LYS A 518 7.520 -8.734 -5.935 1.00 0.00 H new ATOM 0 HG2 LYS A 518 6.653 -6.352 -6.692 1.00 0.00 H new ATOM 0 HG3 LYS A 518 8.339 -5.899 -6.537 1.00 0.00 H new ATOM 0 HD2 LYS A 518 9.024 -7.593 -8.135 1.00 0.00 H new ATOM 0 HD3 LYS A 518 7.424 -8.308 -8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 518 7.436 -7.015 -10.111 1.00 0.00 H new ATOM 0 HE3 LYS A 518 6.590 -5.987 -8.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 518 8.094 -4.523 -9.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 518 9.011 -5.111 -8.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 518 9.290 -5.698 -10.082 1.00 0.00 H new ATOM 1141 N LYS A 519 8.336 -8.595 -2.642 1.00 0.00 N ATOM 1142 CA LYS A 519 8.587 -9.621 -1.637 1.00 0.00 C ATOM 1143 C LYS A 519 7.465 -9.658 -0.604 1.00 0.00 C ATOM 1144 O LYS A 519 6.814 -10.685 -0.418 1.00 0.00 O ATOM 1145 CB LYS A 519 9.927 -9.366 -0.941 1.00 0.00 C ATOM 1146 CG LYS A 519 11.104 -10.041 -1.623 1.00 0.00 C ATOM 1147 CD LYS A 519 12.422 -9.393 -1.231 1.00 0.00 C ATOM 1148 CE LYS A 519 12.734 -9.612 0.241 1.00 0.00 C ATOM 1149 NZ LYS A 519 14.189 -9.475 0.526 1.00 0.00 N ATOM 0 H LYS A 519 9.114 -7.952 -2.792 1.00 0.00 H new ATOM 0 HA LYS A 519 8.624 -10.586 -2.142 1.00 0.00 H new ATOM 0 HB2 LYS A 519 10.108 -8.292 -0.901 1.00 0.00 H new ATOM 0 HB3 LYS A 519 9.865 -9.717 0.089 1.00 0.00 H new ATOM 0 HG2 LYS A 519 11.123 -11.098 -1.356 1.00 0.00 H new ATOM 0 HG3 LYS A 519 10.979 -9.988 -2.704 1.00 0.00 H new ATOM 0 HD2 LYS A 519 13.227 -9.805 -1.840 1.00 0.00 H new ATOM 0 HD3 LYS A 519 12.380 -8.324 -1.440 1.00 0.00 H new ATOM 0 HE2 LYS A 519 12.177 -8.892 0.841 1.00 0.00 H new ATOM 0 HE3 LYS A 519 12.397 -10.605 0.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 14.360 -9.631 1.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 14.719 -10.178 -0.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 14.505 -8.519 0.265 1.00 0.00 H new ATOM 1163 N ALA A 520 7.245 -8.530 0.063 1.00 0.00 N ATOM 1164 CA ALA A 520 6.199 -8.433 1.074 1.00 0.00 C ATOM 1165 C ALA A 520 4.815 -8.543 0.444 1.00 0.00 C ATOM 1166 O ALA A 520 4.057 -9.466 0.744 1.00 0.00 O ATOM 1167 CB ALA A 520 6.328 -7.126 1.843 1.00 0.00 C ATOM 0 H ALA A 520 7.777 -7.671 -0.078 1.00 0.00 H new ATOM 0 HA ALA A 520 6.321 -9.264 1.768 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.541 -7.067 2.595 1.00 0.00 H new ATOM 0 HB2 ALA A 520 7.301 -7.087 2.333 1.00 0.00 H new ATOM 0 HB3 ALA A 520 6.235 -6.287 1.153 1.00 0.00 H new ATOM 1173 N PHE A 521 4.490 -7.596 -0.430 1.00 0.00 N ATOM 1174 CA PHE A 521 3.195 -7.587 -1.101 1.00 0.00 C ATOM 1175 C PHE A 521 2.759 -9.004 -1.460 1.00 0.00 C ATOM 1176 O PHE A 521 1.588 -9.357 -1.324 1.00 0.00 O ATOM 1177 CB PHE A 521 3.258 -6.725 -2.364 1.00 0.00 C ATOM 1178 CG PHE A 521 1.998 -6.765 -3.180 1.00 0.00 C ATOM 1179 CD1 PHE A 521 1.644 -7.909 -3.877 1.00 0.00 C ATOM 1180 CD2 PHE A 521 1.167 -5.658 -3.251 1.00 0.00 C ATOM 1181 CE1 PHE A 521 0.485 -7.948 -4.629 1.00 0.00 C ATOM 1182 CE2 PHE A 521 0.007 -5.691 -4.002 1.00 0.00 C ATOM 1183 CZ PHE A 521 -0.335 -6.838 -4.691 1.00 0.00 C ATOM 0 H PHE A 521 5.105 -6.825 -0.690 1.00 0.00 H new ATOM 0 HA PHE A 521 2.461 -7.163 -0.416 1.00 0.00 H new ATOM 0 HB2 PHE A 521 3.465 -5.693 -2.080 1.00 0.00 H new ATOM 0 HB3 PHE A 521 4.092 -7.059 -2.981 1.00 0.00 H new ATOM 0 HD1 PHE A 521 2.281 -8.780 -3.832 1.00 0.00 H new ATOM 0 HD2 PHE A 521 1.429 -4.759 -2.713 1.00 0.00 H new ATOM 0 HE1 PHE A 521 0.221 -8.846 -5.168 1.00 0.00 H new ATOM 0 HE2 PHE A 521 -0.631 -4.821 -4.050 1.00 0.00 H new ATOM 0 HZ PHE A 521 -1.242 -6.867 -5.277 1.00 0.00 H new ATOM 1193 N ASN A 522 3.709 -9.811 -1.921 1.00 0.00 N ATOM 1194 CA ASN A 522 3.423 -11.190 -2.301 1.00 0.00 C ATOM 1195 C ASN A 522 3.218 -12.063 -1.067 1.00 0.00 C ATOM 1196 O ASN A 522 2.158 -12.663 -0.888 1.00 0.00 O ATOM 1197 CB ASN A 522 4.562 -11.752 -3.154 1.00 0.00 C ATOM 1198 CG ASN A 522 4.737 -10.995 -4.457 1.00 0.00 C ATOM 1199 OD1 ASN A 522 3.967 -10.087 -4.768 1.00 0.00 O ATOM 1200 ND2 ASN A 522 5.754 -11.368 -5.225 1.00 0.00 N ATOM 0 H ASN A 522 4.683 -9.534 -2.041 1.00 0.00 H new ATOM 0 HA ASN A 522 2.503 -11.197 -2.885 1.00 0.00 H new ATOM 0 HB2 ASN A 522 5.491 -11.712 -2.586 1.00 0.00 H new ATOM 0 HB3 ASN A 522 4.366 -12.802 -3.371 1.00 0.00 H new ATOM 0 HD21 ASN A 522 5.922 -10.896 -6.113 1.00 0.00 H new ATOM 0 HD22 ASN A 522 6.367 -12.127 -4.927 1.00 0.00 H new ATOM 1207 N ALA A 523 4.238 -12.128 -0.219 1.00 0.00 N ATOM 1208 CA ALA A 523 4.169 -12.926 1.000 1.00 0.00 C ATOM 1209 C ALA A 523 2.853 -12.693 1.734 1.00 0.00 C ATOM 1210 O ALA A 523 2.154 -13.641 2.093 1.00 0.00 O ATOM 1211 CB ALA A 523 5.347 -12.605 1.908 1.00 0.00 C ATOM 0 H ALA A 523 5.122 -11.638 -0.353 1.00 0.00 H new ATOM 0 HA ALA A 523 4.217 -13.978 0.720 1.00 0.00 H new ATOM 0 HB1 ALA A 523 5.283 -13.208 2.814 1.00 0.00 H new ATOM 0 HB2 ALA A 523 6.279 -12.829 1.388 1.00 0.00 H new ATOM 0 HB3 ALA A 523 5.325 -11.548 2.173 1.00 0.00 H new ATOM 1217 N LEU A 524 2.522 -11.426 1.956 1.00 0.00 N ATOM 1218 CA LEU A 524 1.289 -11.068 2.649 1.00 0.00 C ATOM 1219 C LEU A 524 0.068 -11.411 1.802 1.00 0.00 C ATOM 1220 O LEU A 524 -0.809 -12.159 2.234 1.00 0.00 O ATOM 1221 CB LEU A 524 1.286 -9.576 2.988 1.00 0.00 C ATOM 1222 CG LEU A 524 2.002 -9.179 4.280 1.00 0.00 C ATOM 1223 CD1 LEU A 524 3.506 -9.121 4.061 1.00 0.00 C ATOM 1224 CD2 LEU A 524 1.483 -7.842 4.788 1.00 0.00 C ATOM 0 H LEU A 524 3.090 -10.630 1.666 1.00 0.00 H new ATOM 0 HA LEU A 524 1.240 -11.645 3.573 1.00 0.00 H new ATOM 0 HB2 LEU A 524 1.746 -9.035 2.161 1.00 0.00 H new ATOM 0 HB3 LEU A 524 0.251 -9.241 3.052 1.00 0.00 H new ATOM 0 HG LEU A 524 1.795 -9.937 5.035 1.00 0.00 H new ATOM 0 HD11 LEU A 524 3.998 -8.837 4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 524 3.866 -10.100 3.744 1.00 0.00 H new ATOM 0 HD13 LEU A 524 3.733 -8.384 3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 524 2.004 -7.575 5.708 1.00 0.00 H new ATOM 0 HD22 LEU A 524 1.659 -7.074 4.035 1.00 0.00 H new ATOM 0 HD23 LEU A 524 0.414 -7.918 4.985 1.00 0.00 H new ATOM 1236 N CYS A 525 0.020 -10.861 0.594 1.00 0.00 N ATOM 1237 CA CYS A 525 -1.093 -11.110 -0.316 1.00 0.00 C ATOM 1238 C CYS A 525 -1.557 -12.560 -0.222 1.00 0.00 C ATOM 1239 O CYS A 525 -2.755 -12.842 -0.261 1.00 0.00 O ATOM 1240 CB CYS A 525 -0.686 -10.784 -1.754 1.00 0.00 C ATOM 1241 SG CYS A 525 -1.729 -11.560 -3.010 1.00 0.00 S ATOM 0 H CYS A 525 0.738 -10.240 0.222 1.00 0.00 H new ATOM 0 HA CYS A 525 -1.920 -10.463 -0.025 1.00 0.00 H new ATOM 0 HB2 CYS A 525 -0.713 -9.703 -1.892 1.00 0.00 H new ATOM 0 HB3 CYS A 525 0.346 -11.099 -1.909 1.00 0.00 H new ATOM 0 HG CYS A 525 -1.307 -11.223 -4.193 1.00 0.00 H new ATOM 1247 N HIS A 526 -0.602 -13.475 -0.100 1.00 0.00 N ATOM 1248 CA HIS A 526 -0.913 -14.897 -0.002 1.00 0.00 C ATOM 1249 C HIS A 526 -1.970 -15.149 1.069 1.00 0.00 C ATOM 1250 O HIS A 526 -2.990 -15.789 0.810 1.00 0.00 O ATOM 1251 CB HIS A 526 0.351 -15.697 0.314 1.00 0.00 C ATOM 1252 CG HIS A 526 0.096 -17.157 0.534 1.00 0.00 C ATOM 1253 ND1 HIS A 526 0.825 -17.922 1.420 1.00 0.00 N ATOM 1254 CD2 HIS A 526 -0.814 -17.990 -0.021 1.00 0.00 C ATOM 1255 CE1 HIS A 526 0.375 -19.164 1.398 1.00 0.00 C ATOM 1256 NE2 HIS A 526 -0.620 -19.232 0.532 1.00 0.00 N ATOM 0 H HIS A 526 0.394 -13.258 -0.067 1.00 0.00 H new ATOM 0 HA HIS A 526 -1.310 -15.224 -0.963 1.00 0.00 H new ATOM 0 HB2 HIS A 526 1.060 -15.580 -0.506 1.00 0.00 H new ATOM 0 HB3 HIS A 526 0.822 -15.280 1.204 1.00 0.00 H new ATOM 0 HD2 HIS A 526 -1.555 -17.727 -0.761 1.00 0.00 H new ATOM 0 HE1 HIS A 526 0.756 -19.984 1.988 1.00 0.00 H new ATOM 0 HE2 HIS A 526 -1.157 -20.070 0.310 1.00 0.00 H new ATOM 1264 N SER A 527 -1.720 -14.642 2.272 1.00 0.00 N ATOM 1265 CA SER A 527 -2.647 -14.816 3.383 1.00 0.00 C ATOM 1266 C SER A 527 -2.237 -13.955 4.574 1.00 0.00 C ATOM 1267 O SER A 527 -1.270 -14.260 5.273 1.00 0.00 O ATOM 1268 CB SER A 527 -2.707 -16.287 3.800 1.00 0.00 C ATOM 1269 OG SER A 527 -3.563 -17.025 2.945 1.00 0.00 O ATOM 0 H SER A 527 -0.882 -14.107 2.502 1.00 0.00 H new ATOM 0 HA SER A 527 -3.636 -14.499 3.051 1.00 0.00 H new ATOM 0 HB2 SER A 527 -1.705 -16.716 3.776 1.00 0.00 H new ATOM 0 HB3 SER A 527 -3.061 -16.363 4.828 1.00 0.00 H new ATOM 0 HG SER A 527 -3.671 -16.545 2.097 1.00 0.00 H new ATOM 1275 N THR A 528 -2.979 -12.875 4.799 1.00 0.00 N ATOM 1276 CA THR A 528 -2.693 -11.968 5.903 1.00 0.00 C ATOM 1277 C THR A 528 -3.904 -11.813 6.815 1.00 0.00 C ATOM 1278 O THR A 528 -5.009 -11.525 6.354 1.00 0.00 O ATOM 1279 CB THR A 528 -2.269 -10.578 5.392 1.00 0.00 C ATOM 1280 OG1 THR A 528 -1.491 -10.711 4.197 1.00 0.00 O ATOM 1281 CG2 THR A 528 -1.463 -9.836 6.448 1.00 0.00 C ATOM 0 H THR A 528 -3.783 -12.607 4.231 1.00 0.00 H new ATOM 0 HA THR A 528 -1.870 -12.407 6.467 1.00 0.00 H new ATOM 0 HB THR A 528 -3.170 -10.004 5.176 1.00 0.00 H new ATOM 0 HG1 THR A 528 -1.642 -11.597 3.805 1.00 0.00 H new ATOM 0 HG21 THR A 528 -1.175 -8.857 6.065 1.00 0.00 H new ATOM 0 HG22 THR A 528 -2.068 -9.710 7.346 1.00 0.00 H new ATOM 0 HG23 THR A 528 -0.568 -10.408 6.691 1.00 0.00 H new ATOM 1289 N HIS A 529 -3.690 -12.006 8.113 1.00 0.00 N ATOM 1290 CA HIS A 529 -4.765 -11.887 9.091 1.00 0.00 C ATOM 1291 C HIS A 529 -4.411 -10.863 10.166 1.00 0.00 C ATOM 1292 O HIS A 529 -3.276 -10.814 10.641 1.00 0.00 O ATOM 1293 CB HIS A 529 -5.049 -13.243 9.737 1.00 0.00 C ATOM 1294 CG HIS A 529 -5.392 -14.316 8.750 1.00 0.00 C ATOM 1295 ND1 HIS A 529 -5.684 -14.057 7.428 1.00 0.00 N ATOM 1296 CD2 HIS A 529 -5.486 -15.659 8.899 1.00 0.00 C ATOM 1297 CE1 HIS A 529 -5.945 -15.193 6.806 1.00 0.00 C ATOM 1298 NE2 HIS A 529 -5.832 -16.180 7.676 1.00 0.00 N ATOM 0 H HIS A 529 -2.782 -12.245 8.511 1.00 0.00 H new ATOM 0 HA HIS A 529 -5.660 -11.547 8.570 1.00 0.00 H new ATOM 0 HB2 HIS A 529 -4.175 -13.553 10.310 1.00 0.00 H new ATOM 0 HB3 HIS A 529 -5.872 -13.134 10.444 1.00 0.00 H new ATOM 0 HD2 HIS A 529 -5.320 -16.216 9.809 1.00 0.00 H new ATOM 0 HE1 HIS A 529 -6.206 -15.297 5.763 1.00 0.00 H new ATOM 0 HE2 HIS A 529 -5.978 -17.169 7.473 1.00 0.00 H new ATOM 1306 N LEU A 530 -5.389 -10.046 10.543 1.00 0.00 N ATOM 1307 CA LEU A 530 -5.180 -9.022 11.561 1.00 0.00 C ATOM 1308 C LEU A 530 -6.444 -8.812 12.388 1.00 0.00 C ATOM 1309 O LEU A 530 -7.475 -8.383 11.868 1.00 0.00 O ATOM 1310 CB LEU A 530 -4.759 -7.705 10.908 1.00 0.00 C ATOM 1311 CG LEU A 530 -4.111 -6.674 11.833 1.00 0.00 C ATOM 1312 CD1 LEU A 530 -2.651 -7.021 12.080 1.00 0.00 C ATOM 1313 CD2 LEU A 530 -4.237 -5.276 11.246 1.00 0.00 C ATOM 0 H LEU A 530 -6.334 -10.073 10.159 1.00 0.00 H new ATOM 0 HA LEU A 530 -4.385 -9.361 12.225 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -4.061 -7.929 10.101 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -5.639 -7.252 10.451 1.00 0.00 H new ATOM 0 HG LEU A 530 -4.634 -6.693 12.789 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -2.207 -6.276 12.740 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -2.584 -8.004 12.545 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -2.114 -7.031 11.132 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -3.770 -4.556 11.918 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -3.740 -5.242 10.276 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -5.291 -5.027 11.123 1.00 0.00 H new ATOM 1325 N TYR A 531 -6.358 -9.115 13.679 1.00 0.00 N ATOM 1326 CA TYR A 531 -7.494 -8.959 14.579 1.00 0.00 C ATOM 1327 C TYR A 531 -8.682 -9.792 14.106 1.00 0.00 C ATOM 1328 O TYR A 531 -9.836 -9.413 14.297 1.00 0.00 O ATOM 1329 CB TYR A 531 -7.897 -7.487 14.676 1.00 0.00 C ATOM 1330 CG TYR A 531 -6.821 -6.602 15.265 1.00 0.00 C ATOM 1331 CD1 TYR A 531 -6.543 -6.626 16.626 1.00 0.00 C ATOM 1332 CD2 TYR A 531 -6.082 -5.744 14.460 1.00 0.00 C ATOM 1333 CE1 TYR A 531 -5.562 -5.819 17.169 1.00 0.00 C ATOM 1334 CE2 TYR A 531 -5.098 -4.935 14.994 1.00 0.00 C ATOM 1335 CZ TYR A 531 -4.842 -4.976 16.349 1.00 0.00 C ATOM 1336 OH TYR A 531 -3.863 -4.172 16.886 1.00 0.00 O ATOM 0 H TYR A 531 -5.512 -9.470 14.125 1.00 0.00 H new ATOM 0 HA TYR A 531 -7.194 -9.313 15.565 1.00 0.00 H new ATOM 0 HB2 TYR A 531 -8.151 -7.122 13.681 1.00 0.00 H new ATOM 0 HB3 TYR A 531 -8.797 -7.405 15.285 1.00 0.00 H new ATOM 0 HD1 TYR A 531 -7.103 -7.287 17.271 1.00 0.00 H new ATOM 0 HD2 TYR A 531 -6.280 -5.709 13.399 1.00 0.00 H new ATOM 0 HE1 TYR A 531 -5.360 -5.848 18.230 1.00 0.00 H new ATOM 0 HE2 TYR A 531 -4.532 -4.274 14.354 1.00 0.00 H new ATOM 0 HH TYR A 531 -3.021 -4.317 16.406 1.00 0.00 H new ATOM 1346 N GLY A 532 -8.387 -10.932 13.487 1.00 0.00 N ATOM 1347 CA GLY A 532 -9.440 -11.803 12.996 1.00 0.00 C ATOM 1348 C GLY A 532 -10.067 -11.289 11.716 1.00 0.00 C ATOM 1349 O GLY A 532 -11.187 -11.667 11.370 1.00 0.00 O ATOM 0 H GLY A 532 -7.439 -11.267 13.317 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -9.032 -12.799 12.823 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -10.211 -11.903 13.760 1.00 0.00 H new ATOM 1353 N ARG A 533 -9.346 -10.423 11.011 1.00 0.00 N ATOM 1354 CA ARG A 533 -9.841 -9.854 9.763 1.00 0.00 C ATOM 1355 C ARG A 533 -8.866 -10.121 8.620 1.00 0.00 C ATOM 1356 O ARG A 533 -7.678 -9.811 8.719 1.00 0.00 O ATOM 1357 CB ARG A 533 -10.063 -8.349 9.917 1.00 0.00 C ATOM 1358 CG ARG A 533 -11.095 -7.991 10.974 1.00 0.00 C ATOM 1359 CD ARG A 533 -11.734 -6.639 10.694 1.00 0.00 C ATOM 1360 NE ARG A 533 -12.385 -6.085 11.878 1.00 0.00 N ATOM 1361 CZ ARG A 533 -13.064 -4.944 11.877 1.00 0.00 C ATOM 1362 NH1 ARG A 533 -13.181 -4.239 10.760 1.00 0.00 N ATOM 1363 NH2 ARG A 533 -13.629 -4.505 12.995 1.00 0.00 N ATOM 0 H ARG A 533 -8.417 -10.100 11.283 1.00 0.00 H new ATOM 0 HA ARG A 533 -10.792 -10.332 9.526 1.00 0.00 H new ATOM 0 HB2 ARG A 533 -9.115 -7.875 10.171 1.00 0.00 H new ATOM 0 HB3 ARG A 533 -10.379 -7.937 8.959 1.00 0.00 H new ATOM 0 HG2 ARG A 533 -11.867 -8.760 11.005 1.00 0.00 H new ATOM 0 HG3 ARG A 533 -10.621 -7.974 11.956 1.00 0.00 H new ATOM 0 HD2 ARG A 533 -10.972 -5.944 10.341 1.00 0.00 H new ATOM 0 HD3 ARG A 533 -12.466 -6.743 9.893 1.00 0.00 H new ATOM 0 HE ARG A 533 -12.314 -6.603 12.754 1.00 0.00 H new ATOM 0 HH11 ARG A 533 -12.749 -4.573 9.899 1.00 0.00 H new ATOM 0 HH12 ARG A 533 -13.703 -3.363 10.762 1.00 0.00 H new ATOM 0 HH21 ARG A 533 -13.542 -5.044 13.856 1.00 0.00 H new ATOM 0 HH22 ARG A 533 -14.150 -3.628 12.993 1.00 0.00 H new ATOM 1377 N ARG A 534 -9.375 -10.697 7.536 1.00 0.00 N ATOM 1378 CA ARG A 534 -8.550 -11.007 6.375 1.00 0.00 C ATOM 1379 C ARG A 534 -8.267 -9.750 5.558 1.00 0.00 C ATOM 1380 O ARG A 534 -9.153 -9.221 4.885 1.00 0.00 O ATOM 1381 CB ARG A 534 -9.238 -12.054 5.498 1.00 0.00 C ATOM 1382 CG ARG A 534 -8.269 -12.917 4.707 1.00 0.00 C ATOM 1383 CD ARG A 534 -7.548 -12.110 3.638 1.00 0.00 C ATOM 1384 NE ARG A 534 -8.444 -11.713 2.555 1.00 0.00 N ATOM 1385 CZ ARG A 534 -8.730 -12.490 1.517 1.00 0.00 C ATOM 1386 NH1 ARG A 534 -8.195 -13.699 1.421 1.00 0.00 N ATOM 1387 NH2 ARG A 534 -9.555 -12.057 0.571 1.00 0.00 N ATOM 0 H ARG A 534 -10.356 -10.959 7.438 1.00 0.00 H new ATOM 0 HA ARG A 534 -7.602 -11.409 6.732 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -9.852 -12.697 6.128 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -9.911 -11.550 4.805 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -7.539 -13.360 5.384 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -8.811 -13.739 4.240 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -7.109 -11.220 4.090 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -6.726 -12.700 3.231 1.00 0.00 H new ATOM 0 HE ARG A 534 -8.873 -10.789 2.598 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -7.561 -14.035 2.146 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -8.417 -14.293 0.622 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -9.969 -11.127 0.642 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -9.775 -12.654 -0.226 1.00 0.00 H new ATOM 1401 N LEU A 535 -7.028 -9.275 5.622 1.00 0.00 N ATOM 1402 CA LEU A 535 -6.628 -8.079 4.888 1.00 0.00 C ATOM 1403 C LEU A 535 -6.464 -8.381 3.402 1.00 0.00 C ATOM 1404 O LEU A 535 -6.029 -9.469 3.023 1.00 0.00 O ATOM 1405 CB LEU A 535 -5.320 -7.524 5.454 1.00 0.00 C ATOM 1406 CG LEU A 535 -5.336 -7.148 6.936 1.00 0.00 C ATOM 1407 CD1 LEU A 535 -3.920 -6.921 7.445 1.00 0.00 C ATOM 1408 CD2 LEU A 535 -6.191 -5.911 7.164 1.00 0.00 C ATOM 0 H LEU A 535 -6.283 -9.699 6.174 1.00 0.00 H new ATOM 0 HA LEU A 535 -7.413 -7.332 5.003 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -4.536 -8.265 5.296 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -5.044 -6.640 4.878 1.00 0.00 H new ATOM 0 HG LEU A 535 -5.773 -7.975 7.496 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -3.951 -6.654 8.501 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -3.337 -7.833 7.318 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -3.456 -6.112 6.880 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -6.190 -5.659 8.224 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -5.784 -5.077 6.592 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -7.212 -6.110 6.839 1.00 0.00 H new ATOM 1420 N VAL A 536 -6.814 -7.410 2.564 1.00 0.00 N ATOM 1421 CA VAL A 536 -6.703 -7.571 1.119 1.00 0.00 C ATOM 1422 C VAL A 536 -5.610 -6.675 0.549 1.00 0.00 C ATOM 1423 O VAL A 536 -5.690 -5.448 0.633 1.00 0.00 O ATOM 1424 CB VAL A 536 -8.035 -7.249 0.415 1.00 0.00 C ATOM 1425 CG1 VAL A 536 -7.882 -7.364 -1.094 1.00 0.00 C ATOM 1426 CG2 VAL A 536 -9.139 -8.166 0.919 1.00 0.00 C ATOM 0 H VAL A 536 -7.177 -6.504 2.861 1.00 0.00 H new ATOM 0 HA VAL A 536 -6.446 -8.614 0.935 1.00 0.00 H new ATOM 0 HB VAL A 536 -8.312 -6.222 0.651 1.00 0.00 H new ATOM 0 HG11 VAL A 536 -8.833 -7.133 -1.575 1.00 0.00 H new ATOM 0 HG12 VAL A 536 -7.122 -6.662 -1.437 1.00 0.00 H new ATOM 0 HG13 VAL A 536 -7.582 -8.379 -1.353 1.00 0.00 H new ATOM 0 HG21 VAL A 536 -10.073 -7.925 0.411 1.00 0.00 H new ATOM 0 HG22 VAL A 536 -8.872 -9.203 0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 536 -9.264 -8.029 1.993 1.00 0.00 H new ATOM 1436 N LEU A 537 -4.588 -7.294 -0.032 1.00 0.00 N ATOM 1437 CA LEU A 537 -3.477 -6.552 -0.618 1.00 0.00 C ATOM 1438 C LEU A 537 -3.658 -6.399 -2.124 1.00 0.00 C ATOM 1439 O LEU A 537 -3.714 -7.388 -2.855 1.00 0.00 O ATOM 1440 CB LEU A 537 -2.153 -7.259 -0.321 1.00 0.00 C ATOM 1441 CG LEU A 537 -1.485 -6.903 1.008 1.00 0.00 C ATOM 1442 CD1 LEU A 537 -2.021 -7.782 2.127 1.00 0.00 C ATOM 1443 CD2 LEU A 537 0.027 -7.039 0.898 1.00 0.00 C ATOM 0 H LEU A 537 -4.506 -8.308 -0.110 1.00 0.00 H new ATOM 0 HA LEU A 537 -3.460 -5.558 -0.170 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -2.326 -8.335 -0.341 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -1.455 -7.034 -1.127 1.00 0.00 H new ATOM 0 HG LEU A 537 -1.720 -5.865 1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -1.534 -7.514 3.065 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -3.097 -7.635 2.222 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -1.817 -8.828 1.898 1.00 0.00 H new ATOM 0 HD21 LEU A 537 0.486 -6.782 1.853 1.00 0.00 H new ATOM 0 HD22 LEU A 537 0.282 -8.066 0.638 1.00 0.00 H new ATOM 0 HD23 LEU A 537 0.398 -6.366 0.124 1.00 0.00 H new ATOM 1455 N GLU A 538 -3.748 -5.154 -2.581 1.00 0.00 N ATOM 1456 CA GLU A 538 -3.921 -4.873 -4.002 1.00 0.00 C ATOM 1457 C GLU A 538 -3.049 -3.699 -4.434 1.00 0.00 C ATOM 1458 O GLU A 538 -2.916 -2.711 -3.712 1.00 0.00 O ATOM 1459 CB GLU A 538 -5.390 -4.572 -4.309 1.00 0.00 C ATOM 1460 CG GLU A 538 -6.211 -5.809 -4.629 1.00 0.00 C ATOM 1461 CD GLU A 538 -5.640 -6.605 -5.787 1.00 0.00 C ATOM 1462 OE1 GLU A 538 -5.969 -6.282 -6.948 1.00 0.00 O ATOM 1463 OE2 GLU A 538 -4.864 -7.550 -5.533 1.00 0.00 O ATOM 0 H GLU A 538 -3.704 -4.325 -1.989 1.00 0.00 H new ATOM 0 HA GLU A 538 -3.614 -5.756 -4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 538 -5.834 -4.063 -3.454 1.00 0.00 H new ATOM 0 HB3 GLU A 538 -5.442 -3.883 -5.152 1.00 0.00 H new ATOM 0 HG2 GLU A 538 -6.262 -6.445 -3.746 1.00 0.00 H new ATOM 0 HG3 GLU A 538 -7.232 -5.511 -4.866 1.00 0.00 H new ATOM 1470 N TRP A 539 -2.456 -3.814 -5.617 1.00 0.00 N ATOM 1471 CA TRP A 539 -1.595 -2.763 -6.146 1.00 0.00 C ATOM 1472 C TRP A 539 -2.400 -1.507 -6.463 1.00 0.00 C ATOM 1473 O TRP A 539 -3.327 -1.541 -7.272 1.00 0.00 O ATOM 1474 CB TRP A 539 -0.873 -3.251 -7.404 1.00 0.00 C ATOM 1475 CG TRP A 539 0.047 -4.406 -7.150 1.00 0.00 C ATOM 1476 CD1 TRP A 539 -0.221 -5.729 -7.359 1.00 0.00 C ATOM 1477 CD2 TRP A 539 1.382 -4.341 -6.637 1.00 0.00 C ATOM 1478 NE1 TRP A 539 0.868 -6.490 -7.007 1.00 0.00 N ATOM 1479 CE2 TRP A 539 1.864 -5.663 -6.562 1.00 0.00 C ATOM 1480 CE3 TRP A 539 2.218 -3.296 -6.236 1.00 0.00 C ATOM 1481 CZ2 TRP A 539 3.143 -5.963 -6.101 1.00 0.00 C ATOM 1482 CZ3 TRP A 539 3.487 -3.596 -5.778 1.00 0.00 C ATOM 1483 CH2 TRP A 539 3.941 -4.920 -5.715 1.00 0.00 C ATOM 0 H TRP A 539 -2.556 -4.625 -6.228 1.00 0.00 H new ATOM 0 HA TRP A 539 -0.856 -2.516 -5.384 1.00 0.00 H new ATOM 0 HB2 TRP A 539 -1.613 -3.542 -8.149 1.00 0.00 H new ATOM 0 HB3 TRP A 539 -0.301 -2.426 -7.829 1.00 0.00 H new ATOM 0 HD1 TRP A 539 -1.151 -6.119 -7.744 1.00 0.00 H new ATOM 0 HE1 TRP A 539 0.925 -7.507 -7.068 1.00 0.00 H new ATOM 0 HE3 TRP A 539 1.879 -2.272 -6.283 1.00 0.00 H new ATOM 0 HZ2 TRP A 539 3.493 -6.983 -6.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 539 4.140 -2.796 -5.463 1.00 0.00 H new ATOM 0 HH2 TRP A 539 4.939 -5.121 -5.355 1.00 0.00 H new ATOM 1494 N ALA A 540 -2.041 -0.401 -5.819 1.00 0.00 N ATOM 1495 CA ALA A 540 -2.730 0.865 -6.034 1.00 0.00 C ATOM 1496 C ALA A 540 -2.716 1.254 -7.509 1.00 0.00 C ATOM 1497 O ALA A 540 -1.693 1.134 -8.183 1.00 0.00 O ATOM 1498 CB ALA A 540 -2.094 1.961 -5.192 1.00 0.00 C ATOM 0 H ALA A 540 -1.277 -0.357 -5.144 1.00 0.00 H new ATOM 0 HA ALA A 540 -3.769 0.742 -5.727 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -2.618 2.901 -5.362 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -2.160 1.694 -4.137 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -1.047 2.074 -5.472 1.00 0.00 H new ATOM 1504 N ASP A 541 -3.858 1.719 -8.003 1.00 0.00 N ATOM 1505 CA ASP A 541 -3.977 2.126 -9.399 1.00 0.00 C ATOM 1506 C ASP A 541 -3.632 3.602 -9.566 1.00 0.00 C ATOM 1507 O ASP A 541 -4.448 4.477 -9.276 1.00 0.00 O ATOM 1508 CB ASP A 541 -5.394 1.860 -9.910 1.00 0.00 C ATOM 1509 CG ASP A 541 -5.656 0.385 -10.147 1.00 0.00 C ATOM 1510 OD1 ASP A 541 -4.744 -0.306 -10.646 1.00 0.00 O ATOM 1511 OD2 ASP A 541 -6.774 -0.077 -9.835 1.00 0.00 O ATOM 0 H ASP A 541 -4.714 1.824 -7.458 1.00 0.00 H new ATOM 0 HA ASP A 541 -3.271 1.538 -9.985 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -6.115 2.243 -9.188 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -5.551 2.408 -10.839 1.00 0.00 H new ATOM 1516 N SER A 542 -2.418 3.872 -10.034 1.00 0.00 N ATOM 1517 CA SER A 542 -1.962 5.242 -10.235 1.00 0.00 C ATOM 1518 C SER A 542 -1.888 5.577 -11.722 1.00 0.00 C ATOM 1519 O SER A 542 -1.691 4.696 -12.558 1.00 0.00 O ATOM 1520 CB SER A 542 -0.593 5.448 -9.585 1.00 0.00 C ATOM 1521 OG SER A 542 -0.207 6.810 -9.629 1.00 0.00 O ATOM 0 H SER A 542 -1.732 3.159 -10.281 1.00 0.00 H new ATOM 0 HA SER A 542 -2.683 5.911 -9.765 1.00 0.00 H new ATOM 0 HB2 SER A 542 -0.624 5.109 -8.550 1.00 0.00 H new ATOM 0 HB3 SER A 542 0.152 4.839 -10.098 1.00 0.00 H new ATOM 0 HG SER A 542 0.671 6.915 -9.206 1.00 0.00 H new ATOM 1527 N GLU A 543 -2.047 6.858 -12.042 1.00 0.00 N ATOM 1528 CA GLU A 543 -1.998 7.309 -13.428 1.00 0.00 C ATOM 1529 C GLU A 543 -0.692 8.043 -13.716 1.00 0.00 C ATOM 1530 O GLU A 543 -0.223 8.842 -12.904 1.00 0.00 O ATOM 1531 CB GLU A 543 -3.187 8.224 -13.731 1.00 0.00 C ATOM 1532 CG GLU A 543 -3.530 8.307 -15.210 1.00 0.00 C ATOM 1533 CD GLU A 543 -2.543 9.152 -15.990 1.00 0.00 C ATOM 1534 OE1 GLU A 543 -2.224 10.268 -15.529 1.00 0.00 O ATOM 1535 OE2 GLU A 543 -2.089 8.699 -17.062 1.00 0.00 O ATOM 0 H GLU A 543 -2.210 7.600 -11.362 1.00 0.00 H new ATOM 0 HA GLU A 543 -2.050 6.431 -14.071 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -4.059 7.866 -13.184 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -2.968 9.225 -13.361 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -3.554 7.302 -15.631 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -4.530 8.725 -15.324 1.00 0.00 H new ATOM 1542 N VAL A 544 -0.108 7.767 -14.877 1.00 0.00 N ATOM 1543 CA VAL A 544 1.144 8.400 -15.273 1.00 0.00 C ATOM 1544 C VAL A 544 0.903 9.806 -15.811 1.00 0.00 C ATOM 1545 O VAL A 544 0.561 9.986 -16.981 1.00 0.00 O ATOM 1546 CB VAL A 544 1.878 7.572 -16.345 1.00 0.00 C ATOM 1547 CG1 VAL A 544 3.170 8.259 -16.759 1.00 0.00 C ATOM 1548 CG2 VAL A 544 2.152 6.165 -15.835 1.00 0.00 C ATOM 0 H VAL A 544 -0.482 7.109 -15.560 1.00 0.00 H new ATOM 0 HA VAL A 544 1.766 8.457 -14.379 1.00 0.00 H new ATOM 0 HB VAL A 544 1.237 7.497 -17.224 1.00 0.00 H new ATOM 0 HG11 VAL A 544 3.674 7.659 -17.517 1.00 0.00 H new ATOM 0 HG12 VAL A 544 2.944 9.244 -17.167 1.00 0.00 H new ATOM 0 HG13 VAL A 544 3.819 8.367 -15.890 1.00 0.00 H new ATOM 0 HG21 VAL A 544 2.671 5.594 -16.605 1.00 0.00 H new ATOM 0 HG22 VAL A 544 2.773 6.217 -14.941 1.00 0.00 H new ATOM 0 HG23 VAL A 544 1.209 5.675 -15.594 1.00 0.00 H new ATOM 1558 N THR A 545 1.082 10.802 -14.949 1.00 0.00 N ATOM 1559 CA THR A 545 0.884 12.193 -15.337 1.00 0.00 C ATOM 1560 C THR A 545 2.109 12.743 -16.059 1.00 0.00 C ATOM 1561 O THR A 545 3.170 12.120 -16.065 1.00 0.00 O ATOM 1562 CB THR A 545 0.581 13.079 -14.114 1.00 0.00 C ATOM 1563 OG1 THR A 545 1.676 13.032 -13.192 1.00 0.00 O ATOM 1564 CG2 THR A 545 -0.693 12.626 -13.418 1.00 0.00 C ATOM 0 H THR A 545 1.364 10.671 -13.977 1.00 0.00 H new ATOM 0 HA THR A 545 0.029 12.214 -16.013 1.00 0.00 H new ATOM 0 HB THR A 545 0.441 14.103 -14.461 1.00 0.00 H new ATOM 0 HG1 THR A 545 1.477 13.599 -12.418 1.00 0.00 H new ATOM 0 HG21 THR A 545 -0.885 13.267 -12.558 1.00 0.00 H new ATOM 0 HG22 THR A 545 -1.530 12.691 -14.113 1.00 0.00 H new ATOM 0 HG23 THR A 545 -0.578 11.595 -13.083 1.00 0.00 H new ATOM 1572 N VAL A 546 1.955 13.916 -16.665 1.00 0.00 N ATOM 1573 CA VAL A 546 3.050 14.552 -17.389 1.00 0.00 C ATOM 1574 C VAL A 546 3.374 15.921 -16.803 1.00 0.00 C ATOM 1575 O VAL A 546 2.717 16.378 -15.867 1.00 0.00 O ATOM 1576 CB VAL A 546 2.717 14.710 -18.884 1.00 0.00 C ATOM 1577 CG1 VAL A 546 2.487 13.351 -19.527 1.00 0.00 C ATOM 1578 CG2 VAL A 546 1.502 15.608 -19.067 1.00 0.00 C ATOM 0 H VAL A 546 1.083 14.445 -16.669 1.00 0.00 H new ATOM 0 HA VAL A 546 3.919 13.902 -17.285 1.00 0.00 H new ATOM 0 HB VAL A 546 3.566 15.180 -19.380 1.00 0.00 H new ATOM 0 HG11 VAL A 546 2.253 13.483 -20.583 1.00 0.00 H new ATOM 0 HG12 VAL A 546 3.387 12.745 -19.428 1.00 0.00 H new ATOM 0 HG13 VAL A 546 1.656 12.850 -19.031 1.00 0.00 H new ATOM 0 HG21 VAL A 546 1.281 15.709 -20.130 1.00 0.00 H new ATOM 0 HG22 VAL A 546 0.644 15.168 -18.558 1.00 0.00 H new ATOM 0 HG23 VAL A 546 1.709 16.591 -18.645 1.00 0.00 H new ATOM 1588 N GLN A 547 4.389 16.572 -17.361 1.00 0.00 N ATOM 1589 CA GLN A 547 4.800 17.891 -16.893 1.00 0.00 C ATOM 1590 C GLN A 547 5.615 18.617 -17.959 1.00 0.00 C ATOM 1591 O GLN A 547 6.574 18.069 -18.502 1.00 0.00 O ATOM 1592 CB GLN A 547 5.617 17.767 -15.606 1.00 0.00 C ATOM 1593 CG GLN A 547 5.805 19.086 -14.875 1.00 0.00 C ATOM 1594 CD GLN A 547 4.674 19.385 -13.911 1.00 0.00 C ATOM 1595 OE1 GLN A 547 3.927 20.347 -14.091 1.00 0.00 O ATOM 1596 NE2 GLN A 547 4.541 18.559 -12.879 1.00 0.00 N ATOM 0 H GLN A 547 4.942 16.208 -18.137 1.00 0.00 H new ATOM 0 HA GLN A 547 3.901 18.473 -16.690 1.00 0.00 H new ATOM 0 HB2 GLN A 547 5.124 17.059 -14.940 1.00 0.00 H new ATOM 0 HB3 GLN A 547 6.596 17.351 -15.846 1.00 0.00 H new ATOM 0 HG2 GLN A 547 6.747 19.063 -14.328 1.00 0.00 H new ATOM 0 HG3 GLN A 547 5.880 19.893 -15.603 1.00 0.00 H new ATOM 0 HE21 GLN A 547 5.183 17.774 -12.768 1.00 0.00 H new ATOM 0 HE22 GLN A 547 3.797 18.710 -12.197 1.00 0.00 H new ATOM 1605 N SER A 548 5.225 19.853 -18.254 1.00 0.00 N ATOM 1606 CA SER A 548 5.917 20.653 -19.258 1.00 0.00 C ATOM 1607 C SER A 548 6.443 21.950 -18.651 1.00 0.00 C ATOM 1608 O SER A 548 5.674 22.853 -18.324 1.00 0.00 O ATOM 1609 CB SER A 548 4.979 20.967 -20.425 1.00 0.00 C ATOM 1610 OG SER A 548 5.692 21.518 -21.519 1.00 0.00 O ATOM 0 H SER A 548 4.434 20.322 -17.812 1.00 0.00 H new ATOM 0 HA SER A 548 6.764 20.075 -19.627 1.00 0.00 H new ATOM 0 HB2 SER A 548 4.469 20.057 -20.741 1.00 0.00 H new ATOM 0 HB3 SER A 548 4.210 21.667 -20.099 1.00 0.00 H new ATOM 0 HG SER A 548 5.070 21.708 -22.252 1.00 0.00 H new ATOM 1616 N GLY A 549 7.762 22.035 -18.503 1.00 0.00 N ATOM 1617 CA GLY A 549 8.370 23.224 -17.935 1.00 0.00 C ATOM 1618 C GLY A 549 9.629 22.913 -17.150 1.00 0.00 C ATOM 1619 O GLY A 549 9.596 22.727 -15.933 1.00 0.00 O ATOM 0 H GLY A 549 8.420 21.301 -18.766 1.00 0.00 H new ATOM 0 HA2 GLY A 549 8.608 23.924 -18.736 1.00 0.00 H new ATOM 0 HA3 GLY A 549 7.651 23.719 -17.282 1.00 0.00 H new ATOM 1623 N PRO A 550 10.769 22.851 -17.852 1.00 0.00 N ATOM 1624 CA PRO A 550 12.066 22.558 -17.233 1.00 0.00 C ATOM 1625 C PRO A 550 12.557 23.701 -16.350 1.00 0.00 C ATOM 1626 O PRO A 550 11.935 24.761 -16.288 1.00 0.00 O ATOM 1627 CB PRO A 550 12.998 22.371 -18.433 1.00 0.00 C ATOM 1628 CG PRO A 550 12.366 23.156 -19.530 1.00 0.00 C ATOM 1629 CD PRO A 550 10.882 23.061 -19.305 1.00 0.00 C ATOM 0 HA PRO A 550 12.017 21.690 -16.575 1.00 0.00 H new ATOM 0 HB2 PRO A 550 14.002 22.734 -18.214 1.00 0.00 H new ATOM 0 HB3 PRO A 550 13.091 21.319 -18.702 1.00 0.00 H new ATOM 0 HG2 PRO A 550 12.698 24.194 -19.509 1.00 0.00 H new ATOM 0 HG3 PRO A 550 12.639 22.754 -20.505 1.00 0.00 H new ATOM 0 HD2 PRO A 550 10.369 23.969 -19.621 1.00 0.00 H new ATOM 0 HD3 PRO A 550 10.443 22.236 -19.865 1.00 0.00 H new ATOM 1637 N SER A 551 13.676 23.477 -15.669 1.00 0.00 N ATOM 1638 CA SER A 551 14.249 24.487 -14.787 1.00 0.00 C ATOM 1639 C SER A 551 15.412 25.204 -15.465 1.00 0.00 C ATOM 1640 O SER A 551 16.141 24.613 -16.261 1.00 0.00 O ATOM 1641 CB SER A 551 14.722 23.844 -13.481 1.00 0.00 C ATOM 1642 OG SER A 551 14.942 24.824 -12.481 1.00 0.00 O ATOM 0 H SER A 551 14.204 22.605 -15.711 1.00 0.00 H new ATOM 0 HA SER A 551 13.474 25.221 -14.563 1.00 0.00 H new ATOM 0 HB2 SER A 551 13.978 23.127 -13.135 1.00 0.00 H new ATOM 0 HB3 SER A 551 15.642 23.288 -13.658 1.00 0.00 H new ATOM 0 HG SER A 551 15.242 24.388 -11.656 1.00 0.00 H new ATOM 1648 N SER A 552 15.579 26.483 -15.143 1.00 0.00 N ATOM 1649 CA SER A 552 16.650 27.284 -15.724 1.00 0.00 C ATOM 1650 C SER A 552 16.923 28.523 -14.876 1.00 0.00 C ATOM 1651 O SER A 552 16.118 28.894 -14.023 1.00 0.00 O ATOM 1652 CB SER A 552 16.290 27.698 -17.152 1.00 0.00 C ATOM 1653 OG SER A 552 14.901 27.955 -17.273 1.00 0.00 O ATOM 0 H SER A 552 14.986 26.986 -14.483 1.00 0.00 H new ATOM 0 HA SER A 552 17.554 26.675 -15.748 1.00 0.00 H new ATOM 0 HB2 SER A 552 16.854 28.589 -17.429 1.00 0.00 H new ATOM 0 HB3 SER A 552 16.579 26.909 -17.847 1.00 0.00 H new ATOM 0 HG SER A 552 14.696 28.219 -18.194 1.00 0.00 H new ATOM 1659 N GLY A 553 18.065 29.159 -15.119 1.00 0.00 N ATOM 1660 CA GLY A 553 18.425 30.349 -14.371 1.00 0.00 C ATOM 1661 C GLY A 553 19.801 30.246 -13.745 1.00 0.00 C ATOM 1662 O GLY A 553 20.470 31.257 -13.531 1.00 0.00 O ATOM 0 H GLY A 553 18.747 28.871 -15.821 1.00 0.00 H new ATOM 0 HA2 GLY A 553 18.395 31.214 -15.034 1.00 0.00 H new ATOM 0 HA3 GLY A 553 17.685 30.520 -13.589 1.00 0.00 H new TER 1666 GLY A 553