USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=28 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 Set 1.1: A 527 SER OG : rot -93:sc= 0.471 USER MOD Set 1.2: A 529 HIS : no HE2:sc= 0.407 K(o=0.88,f=-0.18) USER MOD Single : A 448 SER OG : rot 14:sc= 0.532 USER MOD Single : A 449 SER OG : rot 180:sc= 0 USER MOD Single : A 451 SER OG : rot 44:sc= 0.408 USER MOD Single : A 452 SER OG : rot -2:sc= 0.936 USER MOD Single : A 454 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 457 LYS NZ :NH3+ -144:sc= 0.781 (180deg=0.0645) USER MOD Single : A 458 LYS NZ :NH3+ -147:sc= -1.33! (180deg=-2.67!) USER MOD Single : A 459 GLN : amide:sc= -0.0424 X(o=-0.042,f=-0.042) USER MOD Single : A 460 THR OG1 : rot 180:sc= 0 USER MOD Single : A 461 THR OG1 : rot 180:sc= -0.356 USER MOD Single : A 462 SER OG : rot -60:sc= -0.961 USER MOD Single : A 463 LYS NZ :NH3+ -119:sc= 0.0301 (180deg=0) USER MOD Single : A 468 ASN : amide:sc= 0.695 K(o=0.69,f=-0.25) USER MOD Single : A 472 GLN : amide:sc= -0.0817 X(o=-0.082,f=-0.082) USER MOD Single : A 474 ASN : amide:sc= -1.83! C(o=-1.8!,f=-8.7!) USER MOD Single : A 475 GLN : amide:sc= 0 X(o=0,f=-0.0055) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 THR OG1 : rot -39:sc= 0.0414 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 180:sc= -0.241 USER MOD Single : A 500 THR OG1 : rot 6:sc= 0.67 USER MOD Single : A 503 HIS : no HE2:sc= -2.19! C(o=-2.2!,f=-3.9!) USER MOD Single : A 513 THR OG1 : rot 163:sc= 0.172 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+ -155:sc= -0.105 (180deg=-0.462) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 522 ASN : amide:sc= -0.0614 K(o=-0.061,f=-1.4!) USER MOD Single : A 525 CYS SG : rot 180:sc= 0 USER MOD Single : A 526 HIS : no HD1:sc= 0 X(o=0,f=-0.0097) USER MOD Single : A 528 THR OG1 : rot 40:sc= -1.3 USER MOD Single : A 531 TYR OH : rot 180:sc= 0 USER MOD Single : A 542 SER OG : rot 180:sc= 0 USER MOD Single : A 545 THR OG1 : rot 27:sc= 0.258 USER MOD Single : A 547 GLN : amide:sc= 0 K(o=0,f=-1.1) 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 -7.035 -21.266 0.663 1.00 0.00 N ATOM 2 CA GLY A 447 -7.677 -21.072 -0.624 1.00 0.00 C ATOM 3 C GLY A 447 -7.442 -19.684 -1.186 1.00 0.00 C ATOM 4 O GLY A 447 -7.614 -18.686 -0.486 1.00 0.00 O ATOM 0 HA2 GLY A 447 -7.302 -21.814 -1.329 1.00 0.00 H new ATOM 0 HA3 GLY A 447 -8.749 -21.242 -0.521 1.00 0.00 H new ATOM 8 N SER A 448 -7.045 -19.619 -2.453 1.00 0.00 N ATOM 9 CA SER A 448 -6.780 -18.343 -3.107 1.00 0.00 C ATOM 10 C SER A 448 -6.965 -18.458 -4.617 1.00 0.00 C ATOM 11 O SER A 448 -6.563 -19.447 -5.230 1.00 0.00 O ATOM 12 CB SER A 448 -5.360 -17.869 -2.791 1.00 0.00 C ATOM 13 OG SER A 448 -5.268 -17.385 -1.462 1.00 0.00 O ATOM 0 H SER A 448 -6.900 -20.435 -3.047 1.00 0.00 H new ATOM 0 HA SER A 448 -7.493 -17.612 -2.725 1.00 0.00 H new ATOM 0 HB2 SER A 448 -4.659 -18.692 -2.931 1.00 0.00 H new ATOM 0 HB3 SER A 448 -5.072 -17.083 -3.489 1.00 0.00 H new ATOM 0 HG SER A 448 -6.067 -17.651 -0.961 1.00 0.00 H new ATOM 19 N SER A 449 -7.577 -17.438 -5.211 1.00 0.00 N ATOM 20 CA SER A 449 -7.820 -17.425 -6.649 1.00 0.00 C ATOM 21 C SER A 449 -7.992 -15.997 -7.157 1.00 0.00 C ATOM 22 O SER A 449 -7.963 -15.042 -6.382 1.00 0.00 O ATOM 23 CB SER A 449 -9.063 -18.251 -6.985 1.00 0.00 C ATOM 24 OG SER A 449 -10.247 -17.564 -6.619 1.00 0.00 O ATOM 0 H SER A 449 -7.913 -16.610 -4.719 1.00 0.00 H new ATOM 0 HA SER A 449 -6.955 -17.867 -7.143 1.00 0.00 H new ATOM 0 HB2 SER A 449 -9.081 -18.469 -8.053 1.00 0.00 H new ATOM 0 HB3 SER A 449 -9.019 -19.208 -6.465 1.00 0.00 H new ATOM 0 HG SER A 449 -11.027 -18.112 -6.846 1.00 0.00 H new ATOM 30 N GLY A 450 -8.171 -15.859 -8.468 1.00 0.00 N ATOM 31 CA GLY A 450 -8.346 -14.546 -9.059 1.00 0.00 C ATOM 32 C GLY A 450 -7.460 -14.333 -10.271 1.00 0.00 C ATOM 33 O GLY A 450 -6.322 -13.882 -10.145 1.00 0.00 O ATOM 0 H GLY A 450 -8.198 -16.634 -9.131 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -9.389 -14.417 -9.348 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -8.125 -13.783 -8.313 1.00 0.00 H new ATOM 37 N SER A 451 -7.983 -14.660 -11.449 1.00 0.00 N ATOM 38 CA SER A 451 -7.230 -14.508 -12.688 1.00 0.00 C ATOM 39 C SER A 451 -7.842 -13.420 -13.565 1.00 0.00 C ATOM 40 O SER A 451 -8.952 -13.571 -14.076 1.00 0.00 O ATOM 41 CB SER A 451 -7.191 -15.833 -13.452 1.00 0.00 C ATOM 42 OG SER A 451 -8.500 -16.321 -13.693 1.00 0.00 O ATOM 0 H SER A 451 -8.925 -15.032 -11.571 1.00 0.00 H new ATOM 0 HA SER A 451 -6.212 -14.215 -12.432 1.00 0.00 H new ATOM 0 HB2 SER A 451 -6.671 -15.695 -14.400 1.00 0.00 H new ATOM 0 HB3 SER A 451 -6.624 -16.569 -12.882 1.00 0.00 H new ATOM 0 HG SER A 451 -9.073 -15.585 -13.994 1.00 0.00 H new ATOM 48 N SER A 452 -7.110 -12.324 -13.735 1.00 0.00 N ATOM 49 CA SER A 452 -7.582 -11.208 -14.547 1.00 0.00 C ATOM 50 C SER A 452 -6.491 -10.153 -14.706 1.00 0.00 C ATOM 51 O SER A 452 -6.048 -9.551 -13.729 1.00 0.00 O ATOM 52 CB SER A 452 -8.826 -10.581 -13.916 1.00 0.00 C ATOM 53 OG SER A 452 -8.478 -9.739 -12.831 1.00 0.00 O ATOM 0 H SER A 452 -6.188 -12.185 -13.322 1.00 0.00 H new ATOM 0 HA SER A 452 -7.839 -11.592 -15.534 1.00 0.00 H new ATOM 0 HB2 SER A 452 -9.368 -10.006 -14.667 1.00 0.00 H new ATOM 0 HB3 SER A 452 -9.497 -11.367 -13.570 1.00 0.00 H new ATOM 0 HG SER A 452 -7.508 -9.765 -12.695 1.00 0.00 H new ATOM 59 N GLY A 453 -6.063 -9.935 -15.945 1.00 0.00 N ATOM 60 CA GLY A 453 -5.027 -8.953 -16.211 1.00 0.00 C ATOM 61 C GLY A 453 -5.595 -7.588 -16.544 1.00 0.00 C ATOM 62 O GLY A 453 -5.562 -7.161 -17.698 1.00 0.00 O ATOM 0 H GLY A 453 -6.415 -10.421 -16.770 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -4.377 -8.870 -15.340 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -4.408 -9.298 -17.039 1.00 0.00 H new ATOM 66 N GLN A 454 -6.119 -6.903 -15.533 1.00 0.00 N ATOM 67 CA GLN A 454 -6.698 -5.580 -15.726 1.00 0.00 C ATOM 68 C GLN A 454 -5.951 -4.533 -14.906 1.00 0.00 C ATOM 69 O GLN A 454 -6.471 -4.016 -13.917 1.00 0.00 O ATOM 70 CB GLN A 454 -8.178 -5.586 -15.338 1.00 0.00 C ATOM 71 CG GLN A 454 -8.870 -4.250 -15.554 1.00 0.00 C ATOM 72 CD GLN A 454 -10.310 -4.255 -15.081 1.00 0.00 C ATOM 73 OE1 GLN A 454 -10.855 -5.300 -14.725 1.00 0.00 O ATOM 74 NE2 GLN A 454 -10.936 -3.083 -15.076 1.00 0.00 N ATOM 0 H GLN A 454 -6.154 -7.243 -14.572 1.00 0.00 H new ATOM 0 HA GLN A 454 -6.606 -5.322 -16.781 1.00 0.00 H new ATOM 0 HB2 GLN A 454 -8.694 -6.351 -15.919 1.00 0.00 H new ATOM 0 HB3 GLN A 454 -8.269 -5.867 -14.289 1.00 0.00 H new ATOM 0 HG2 GLN A 454 -8.321 -3.471 -15.025 1.00 0.00 H new ATOM 0 HG3 GLN A 454 -8.841 -3.997 -16.614 1.00 0.00 H new ATOM 0 HE21 GLN A 454 -10.446 -2.242 -15.379 1.00 0.00 H new ATOM 0 HE22 GLN A 454 -11.907 -3.025 -14.769 1.00 0.00 H new ATOM 83 N VAL A 455 -4.727 -4.225 -15.323 1.00 0.00 N ATOM 84 CA VAL A 455 -3.907 -3.240 -14.628 1.00 0.00 C ATOM 85 C VAL A 455 -2.712 -2.822 -15.477 1.00 0.00 C ATOM 86 O VAL A 455 -1.971 -3.653 -16.003 1.00 0.00 O ATOM 87 CB VAL A 455 -3.400 -3.783 -13.279 1.00 0.00 C ATOM 88 CG1 VAL A 455 -2.510 -4.998 -13.493 1.00 0.00 C ATOM 89 CG2 VAL A 455 -2.659 -2.697 -12.513 1.00 0.00 C ATOM 0 H VAL A 455 -4.281 -4.644 -16.139 1.00 0.00 H new ATOM 0 HA VAL A 455 -4.541 -2.372 -14.446 1.00 0.00 H new ATOM 0 HB VAL A 455 -4.260 -4.093 -12.685 1.00 0.00 H new ATOM 0 HG11 VAL A 455 -2.161 -5.368 -12.529 1.00 0.00 H new ATOM 0 HG12 VAL A 455 -3.077 -5.780 -13.998 1.00 0.00 H new ATOM 0 HG13 VAL A 455 -1.653 -4.718 -14.106 1.00 0.00 H new ATOM 0 HG21 VAL A 455 -2.308 -3.098 -11.562 1.00 0.00 H new ATOM 0 HG22 VAL A 455 -1.807 -2.355 -13.100 1.00 0.00 H new ATOM 0 HG23 VAL A 455 -3.331 -1.859 -12.327 1.00 0.00 H new ATOM 99 N PRO A 456 -2.518 -1.502 -15.616 1.00 0.00 N ATOM 100 CA PRO A 456 -1.412 -0.943 -16.400 1.00 0.00 C ATOM 101 C PRO A 456 -0.058 -1.172 -15.738 1.00 0.00 C ATOM 102 O PRO A 456 0.149 -0.808 -14.580 1.00 0.00 O ATOM 103 CB PRO A 456 -1.736 0.553 -16.452 1.00 0.00 C ATOM 104 CG PRO A 456 -2.567 0.803 -15.242 1.00 0.00 C ATOM 105 CD PRO A 456 -3.361 -0.454 -15.018 1.00 0.00 C ATOM 0 HA PRO A 456 -1.331 -1.410 -17.381 1.00 0.00 H new ATOM 0 HB2 PRO A 456 -0.828 1.155 -16.440 1.00 0.00 H new ATOM 0 HB3 PRO A 456 -2.276 0.810 -17.363 1.00 0.00 H new ATOM 0 HG2 PRO A 456 -1.941 1.028 -14.379 1.00 0.00 H new ATOM 0 HG3 PRO A 456 -3.225 1.659 -15.391 1.00 0.00 H new ATOM 0 HD2 PRO A 456 -3.535 -0.635 -13.957 1.00 0.00 H new ATOM 0 HD3 PRO A 456 -4.338 -0.402 -15.498 1.00 0.00 H new ATOM 113 N LYS A 457 0.863 -1.777 -16.480 1.00 0.00 N ATOM 114 CA LYS A 457 2.199 -2.054 -15.966 1.00 0.00 C ATOM 115 C LYS A 457 2.808 -0.807 -15.333 1.00 0.00 C ATOM 116 O LYS A 457 3.317 -0.852 -14.213 1.00 0.00 O ATOM 117 CB LYS A 457 3.105 -2.562 -17.091 1.00 0.00 C ATOM 118 CG LYS A 457 3.089 -4.072 -17.250 1.00 0.00 C ATOM 119 CD LYS A 457 1.915 -4.530 -18.099 1.00 0.00 C ATOM 120 CE LYS A 457 0.689 -4.818 -17.247 1.00 0.00 C ATOM 121 NZ LYS A 457 -0.541 -4.965 -18.074 1.00 0.00 N ATOM 0 H LYS A 457 0.709 -2.085 -17.440 1.00 0.00 H new ATOM 0 HA LYS A 457 2.114 -2.824 -15.200 1.00 0.00 H new ATOM 0 HB2 LYS A 457 2.796 -2.103 -18.030 1.00 0.00 H new ATOM 0 HB3 LYS A 457 4.127 -2.236 -16.898 1.00 0.00 H new ATOM 0 HG2 LYS A 457 4.021 -4.400 -17.709 1.00 0.00 H new ATOM 0 HG3 LYS A 457 3.034 -4.542 -16.268 1.00 0.00 H new ATOM 0 HD2 LYS A 457 1.676 -3.762 -18.835 1.00 0.00 H new ATOM 0 HD3 LYS A 457 2.193 -5.427 -18.653 1.00 0.00 H new ATOM 0 HE2 LYS A 457 0.852 -5.731 -16.674 1.00 0.00 H new ATOM 0 HE3 LYS A 457 0.549 -4.011 -16.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 457 -1.353 -4.564 -17.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 457 -0.416 -4.461 -18.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 457 -0.714 -5.973 -18.263 1.00 0.00 H new ATOM 135 N LYS A 458 2.751 0.306 -16.056 1.00 0.00 N ATOM 136 CA LYS A 458 3.294 1.567 -15.565 1.00 0.00 C ATOM 137 C LYS A 458 4.690 1.369 -14.984 1.00 0.00 C ATOM 138 O LYS A 458 4.958 1.752 -13.845 1.00 0.00 O ATOM 139 CB LYS A 458 2.368 2.165 -14.502 1.00 0.00 C ATOM 140 CG LYS A 458 2.430 3.680 -14.425 1.00 0.00 C ATOM 141 CD LYS A 458 1.226 4.251 -13.694 1.00 0.00 C ATOM 142 CE LYS A 458 1.400 4.169 -12.185 1.00 0.00 C ATOM 143 NZ LYS A 458 0.094 4.035 -11.483 1.00 0.00 N ATOM 0 H LYS A 458 2.334 0.360 -16.985 1.00 0.00 H new ATOM 0 HA LYS A 458 3.364 2.256 -16.407 1.00 0.00 H new ATOM 0 HB2 LYS A 458 1.343 1.862 -14.713 1.00 0.00 H new ATOM 0 HB3 LYS A 458 2.629 1.749 -13.529 1.00 0.00 H new ATOM 0 HG2 LYS A 458 3.344 3.982 -13.914 1.00 0.00 H new ATOM 0 HG3 LYS A 458 2.476 4.095 -15.432 1.00 0.00 H new ATOM 0 HD2 LYS A 458 1.079 5.290 -13.989 1.00 0.00 H new ATOM 0 HD3 LYS A 458 0.329 3.707 -13.988 1.00 0.00 H new ATOM 0 HE2 LYS A 458 2.034 3.317 -11.938 1.00 0.00 H new ATOM 0 HE3 LYS A 458 1.913 5.062 -11.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 458 0.143 4.517 -10.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 458 -0.656 4.466 -12.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 458 -0.119 3.028 -11.335 1.00 0.00 H new ATOM 157 N GLN A 459 5.576 0.770 -15.774 1.00 0.00 N ATOM 158 CA GLN A 459 6.945 0.523 -15.337 1.00 0.00 C ATOM 159 C GLN A 459 6.966 -0.309 -14.060 1.00 0.00 C ATOM 160 O GLN A 459 7.662 0.024 -13.100 1.00 0.00 O ATOM 161 CB GLN A 459 7.677 1.847 -15.111 1.00 0.00 C ATOM 162 CG GLN A 459 7.806 2.694 -16.366 1.00 0.00 C ATOM 163 CD GLN A 459 8.709 2.062 -17.407 1.00 0.00 C ATOM 164 OE1 GLN A 459 9.907 1.888 -17.181 1.00 0.00 O ATOM 165 NE2 GLN A 459 8.139 1.714 -18.554 1.00 0.00 N ATOM 0 H GLN A 459 5.370 0.447 -16.719 1.00 0.00 H new ATOM 0 HA GLN A 459 7.456 -0.036 -16.121 1.00 0.00 H new ATOM 0 HB2 GLN A 459 7.148 2.420 -14.349 1.00 0.00 H new ATOM 0 HB3 GLN A 459 8.673 1.640 -14.719 1.00 0.00 H new ATOM 0 HG2 GLN A 459 6.817 2.852 -16.796 1.00 0.00 H new ATOM 0 HG3 GLN A 459 8.198 3.675 -16.099 1.00 0.00 H new ATOM 0 HE21 GLN A 459 7.142 1.877 -18.698 1.00 0.00 H new ATOM 0 HE22 GLN A 459 8.697 1.284 -19.291 1.00 0.00 H new ATOM 174 N THR A 460 6.199 -1.395 -14.053 1.00 0.00 N ATOM 175 CA THR A 460 6.128 -2.274 -12.893 1.00 0.00 C ATOM 176 C THR A 460 6.247 -1.483 -11.595 1.00 0.00 C ATOM 177 O THR A 460 7.067 -1.802 -10.734 1.00 0.00 O ATOM 178 CB THR A 460 7.235 -3.345 -12.932 1.00 0.00 C ATOM 179 OG1 THR A 460 7.492 -3.736 -14.285 1.00 0.00 O ATOM 180 CG2 THR A 460 6.838 -4.563 -12.112 1.00 0.00 C ATOM 0 H THR A 460 5.618 -1.687 -14.839 1.00 0.00 H new ATOM 0 HA THR A 460 5.156 -2.765 -12.927 1.00 0.00 H new ATOM 0 HB THR A 460 8.140 -2.916 -12.501 1.00 0.00 H new ATOM 0 HG1 THR A 460 8.198 -4.416 -14.301 1.00 0.00 H new ATOM 0 HG21 THR A 460 7.635 -5.306 -12.154 1.00 0.00 H new ATOM 0 HG22 THR A 460 6.673 -4.266 -11.076 1.00 0.00 H new ATOM 0 HG23 THR A 460 5.921 -4.991 -12.517 1.00 0.00 H new ATOM 188 N THR A 461 5.423 -0.449 -11.461 1.00 0.00 N ATOM 189 CA THR A 461 5.436 0.389 -10.268 1.00 0.00 C ATOM 190 C THR A 461 5.499 -0.458 -9.002 1.00 0.00 C ATOM 191 O THR A 461 5.326 -1.676 -9.050 1.00 0.00 O ATOM 192 CB THR A 461 4.192 1.295 -10.204 1.00 0.00 C ATOM 193 OG1 THR A 461 4.267 2.149 -9.058 1.00 0.00 O ATOM 194 CG2 THR A 461 2.919 0.463 -10.141 1.00 0.00 C ATOM 0 H THR A 461 4.738 -0.171 -12.164 1.00 0.00 H new ATOM 0 HA THR A 461 6.328 1.013 -10.330 1.00 0.00 H new ATOM 0 HB THR A 461 4.165 1.903 -11.108 1.00 0.00 H new ATOM 0 HG1 THR A 461 3.473 2.723 -9.025 1.00 0.00 H new ATOM 0 HG21 THR A 461 2.054 1.125 -10.096 1.00 0.00 H new ATOM 0 HG22 THR A 461 2.850 -0.165 -11.029 1.00 0.00 H new ATOM 0 HG23 THR A 461 2.940 -0.167 -9.252 1.00 0.00 H new ATOM 202 N SER A 462 5.748 0.194 -7.871 1.00 0.00 N ATOM 203 CA SER A 462 5.837 -0.501 -6.592 1.00 0.00 C ATOM 204 C SER A 462 5.017 0.219 -5.525 1.00 0.00 C ATOM 205 O SER A 462 5.504 1.139 -4.867 1.00 0.00 O ATOM 206 CB SER A 462 7.296 -0.606 -6.145 1.00 0.00 C ATOM 207 OG SER A 462 7.894 -1.795 -6.632 1.00 0.00 O ATOM 0 H SER A 462 5.892 1.202 -7.814 1.00 0.00 H new ATOM 0 HA SER A 462 5.431 -1.504 -6.722 1.00 0.00 H new ATOM 0 HB2 SER A 462 7.853 0.259 -6.505 1.00 0.00 H new ATOM 0 HB3 SER A 462 7.348 -0.588 -5.056 1.00 0.00 H new ATOM 0 HG SER A 462 7.406 -2.572 -6.288 1.00 0.00 H new ATOM 213 N LYS A 463 3.770 -0.207 -5.359 1.00 0.00 N ATOM 214 CA LYS A 463 2.880 0.394 -4.372 1.00 0.00 C ATOM 215 C LYS A 463 1.999 -0.665 -3.718 1.00 0.00 C ATOM 216 O LYS A 463 1.324 -1.434 -4.404 1.00 0.00 O ATOM 217 CB LYS A 463 2.007 1.466 -5.028 1.00 0.00 C ATOM 218 CG LYS A 463 2.647 2.844 -5.047 1.00 0.00 C ATOM 219 CD LYS A 463 2.358 3.610 -3.767 1.00 0.00 C ATOM 220 CE LYS A 463 1.056 4.390 -3.867 1.00 0.00 C ATOM 221 NZ LYS A 463 1.027 5.545 -2.926 1.00 0.00 N ATOM 0 H LYS A 463 3.352 -0.967 -5.896 1.00 0.00 H new ATOM 0 HA LYS A 463 3.494 0.857 -3.600 1.00 0.00 H new ATOM 0 HB2 LYS A 463 1.783 1.164 -6.051 1.00 0.00 H new ATOM 0 HB3 LYS A 463 1.057 1.523 -4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 463 3.725 2.744 -5.177 1.00 0.00 H new ATOM 0 HG3 LYS A 463 2.274 3.408 -5.902 1.00 0.00 H new ATOM 0 HD2 LYS A 463 2.303 2.914 -2.930 1.00 0.00 H new ATOM 0 HD3 LYS A 463 3.179 4.296 -3.559 1.00 0.00 H new ATOM 0 HE2 LYS A 463 0.926 4.750 -4.888 1.00 0.00 H new ATOM 0 HE3 LYS A 463 0.218 3.727 -3.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 0.239 5.428 -2.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 1.924 5.588 -2.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 0.898 6.427 -3.462 1.00 0.00 H new ATOM 235 N ILE A 464 2.008 -0.698 -2.390 1.00 0.00 N ATOM 236 CA ILE A 464 1.207 -1.661 -1.645 1.00 0.00 C ATOM 237 C ILE A 464 0.026 -0.981 -0.960 1.00 0.00 C ATOM 238 O ILE A 464 0.206 -0.144 -0.074 1.00 0.00 O ATOM 239 CB ILE A 464 2.049 -2.393 -0.583 1.00 0.00 C ATOM 240 CG1 ILE A 464 3.144 -3.224 -1.254 1.00 0.00 C ATOM 241 CG2 ILE A 464 1.162 -3.275 0.282 1.00 0.00 C ATOM 242 CD1 ILE A 464 4.301 -3.554 -0.337 1.00 0.00 C ATOM 0 H ILE A 464 2.561 -0.069 -1.808 1.00 0.00 H new ATOM 0 HA ILE A 464 0.836 -2.388 -2.367 1.00 0.00 H new ATOM 0 HB ILE A 464 2.524 -1.650 0.058 1.00 0.00 H new ATOM 0 HG12 ILE A 464 2.709 -4.152 -1.624 1.00 0.00 H new ATOM 0 HG13 ILE A 464 3.521 -2.681 -2.120 1.00 0.00 H new ATOM 0 HG21 ILE A 464 1.772 -3.785 1.027 1.00 0.00 H new ATOM 0 HG22 ILE A 464 0.416 -2.659 0.784 1.00 0.00 H new ATOM 0 HG23 ILE A 464 0.662 -4.013 -0.344 1.00 0.00 H new ATOM 0 HD11 ILE A 464 5.039 -4.145 -0.880 1.00 0.00 H new ATOM 0 HD12 ILE A 464 4.762 -2.631 0.014 1.00 0.00 H new ATOM 0 HD13 ILE A 464 3.937 -4.125 0.517 1.00 0.00 H new ATOM 254 N LEU A 465 -1.182 -1.347 -1.374 1.00 0.00 N ATOM 255 CA LEU A 465 -2.394 -0.774 -0.799 1.00 0.00 C ATOM 256 C LEU A 465 -3.178 -1.826 -0.021 1.00 0.00 C ATOM 257 O LEU A 465 -3.810 -2.704 -0.608 1.00 0.00 O ATOM 258 CB LEU A 465 -3.272 -0.178 -1.901 1.00 0.00 C ATOM 259 CG LEU A 465 -4.744 0.033 -1.545 1.00 0.00 C ATOM 260 CD1 LEU A 465 -4.893 1.162 -0.538 1.00 0.00 C ATOM 261 CD2 LEU A 465 -5.559 0.323 -2.798 1.00 0.00 C ATOM 0 H LEU A 465 -1.348 -2.038 -2.106 1.00 0.00 H new ATOM 0 HA LEU A 465 -2.101 0.017 -0.109 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -2.849 0.782 -2.196 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -3.219 -0.830 -2.773 1.00 0.00 H new ATOM 0 HG LEU A 465 -5.123 -0.883 -1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -5.947 1.298 -0.297 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -4.342 0.915 0.369 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -4.497 2.084 -0.964 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -6.604 0.471 -2.526 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.179 1.224 -3.279 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -5.479 -0.518 -3.487 1.00 0.00 H new ATOM 273 N VAL A 466 -3.134 -1.729 1.304 1.00 0.00 N ATOM 274 CA VAL A 466 -3.842 -2.670 2.163 1.00 0.00 C ATOM 275 C VAL A 466 -5.262 -2.193 2.448 1.00 0.00 C ATOM 276 O VAL A 466 -5.468 -1.081 2.933 1.00 0.00 O ATOM 277 CB VAL A 466 -3.104 -2.876 3.499 1.00 0.00 C ATOM 278 CG1 VAL A 466 -2.850 -1.540 4.180 1.00 0.00 C ATOM 279 CG2 VAL A 466 -3.896 -3.805 4.407 1.00 0.00 C ATOM 0 H VAL A 466 -2.615 -1.008 1.806 1.00 0.00 H new ATOM 0 HA VAL A 466 -3.881 -3.619 1.628 1.00 0.00 H new ATOM 0 HB VAL A 466 -2.140 -3.341 3.294 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.328 -1.705 5.122 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -2.239 -0.912 3.532 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.801 -1.044 4.374 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -3.360 -3.940 5.347 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -4.875 -3.370 4.607 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -4.021 -4.772 3.919 1.00 0.00 H new ATOM 289 N ARG A 467 -6.238 -3.042 2.143 1.00 0.00 N ATOM 290 CA ARG A 467 -7.639 -2.706 2.365 1.00 0.00 C ATOM 291 C ARG A 467 -8.258 -3.623 3.416 1.00 0.00 C ATOM 292 O ARG A 467 -7.635 -4.590 3.854 1.00 0.00 O ATOM 293 CB ARG A 467 -8.425 -2.810 1.056 1.00 0.00 C ATOM 294 CG ARG A 467 -8.397 -1.537 0.227 1.00 0.00 C ATOM 295 CD ARG A 467 -9.373 -1.609 -0.937 1.00 0.00 C ATOM 296 NE ARG A 467 -10.725 -1.221 -0.543 1.00 0.00 N ATOM 297 CZ ARG A 467 -11.054 0.008 -0.160 1.00 0.00 C ATOM 298 NH1 ARG A 467 -10.135 0.962 -0.120 1.00 0.00 N ATOM 299 NH2 ARG A 467 -12.305 0.284 0.184 1.00 0.00 N ATOM 0 H ARG A 467 -6.084 -3.967 1.742 1.00 0.00 H new ATOM 0 HA ARG A 467 -7.687 -1.680 2.729 1.00 0.00 H new ATOM 0 HB2 ARG A 467 -8.019 -3.629 0.462 1.00 0.00 H new ATOM 0 HB3 ARG A 467 -9.461 -3.063 1.283 1.00 0.00 H new ATOM 0 HG2 ARG A 467 -8.645 -0.684 0.859 1.00 0.00 H new ATOM 0 HG3 ARG A 467 -7.389 -1.370 -0.152 1.00 0.00 H new ATOM 0 HD2 ARG A 467 -9.028 -0.957 -1.740 1.00 0.00 H new ATOM 0 HD3 ARG A 467 -9.389 -2.624 -1.335 1.00 0.00 H new ATOM 0 HE ARG A 467 -11.456 -1.932 -0.563 1.00 0.00 H new ATOM 0 HH11 ARG A 467 -9.172 0.754 -0.384 1.00 0.00 H new ATOM 0 HH12 ARG A 467 -10.391 1.904 0.174 1.00 0.00 H new ATOM 0 HH21 ARG A 467 -13.015 -0.448 0.155 1.00 0.00 H new ATOM 0 HH22 ARG A 467 -12.557 1.228 0.478 1.00 0.00 H new ATOM 313 N ASN A 468 -9.486 -3.312 3.817 1.00 0.00 N ATOM 314 CA ASN A 468 -10.188 -4.108 4.817 1.00 0.00 C ATOM 315 C ASN A 468 -9.413 -4.138 6.131 1.00 0.00 C ATOM 316 O ASN A 468 -9.281 -5.187 6.761 1.00 0.00 O ATOM 317 CB ASN A 468 -10.403 -5.534 4.306 1.00 0.00 C ATOM 318 CG ASN A 468 -11.656 -6.170 4.877 1.00 0.00 C ATOM 319 OD1 ASN A 468 -12.739 -5.586 4.830 1.00 0.00 O ATOM 320 ND2 ASN A 468 -11.513 -7.373 5.421 1.00 0.00 N ATOM 0 H ASN A 468 -10.016 -2.515 3.465 1.00 0.00 H new ATOM 0 HA ASN A 468 -11.158 -3.644 4.998 1.00 0.00 H new ATOM 0 HB2 ASN A 468 -10.469 -5.521 3.218 1.00 0.00 H new ATOM 0 HB3 ASN A 468 -9.538 -6.144 4.566 1.00 0.00 H new ATOM 0 HD21 ASN A 468 -12.320 -7.851 5.822 1.00 0.00 H new ATOM 0 HD22 ASN A 468 -10.596 -7.819 5.438 1.00 0.00 H new ATOM 327 N ILE A 469 -8.903 -2.980 6.537 1.00 0.00 N ATOM 328 CA ILE A 469 -8.142 -2.874 7.776 1.00 0.00 C ATOM 329 C ILE A 469 -9.068 -2.729 8.979 1.00 0.00 C ATOM 330 O ILE A 469 -10.005 -1.930 8.980 1.00 0.00 O ATOM 331 CB ILE A 469 -7.174 -1.676 7.741 1.00 0.00 C ATOM 332 CG1 ILE A 469 -6.503 -1.575 6.370 1.00 0.00 C ATOM 333 CG2 ILE A 469 -6.130 -1.807 8.840 1.00 0.00 C ATOM 334 CD1 ILE A 469 -5.818 -0.248 6.128 1.00 0.00 C ATOM 0 H ILE A 469 -9.003 -2.103 6.026 1.00 0.00 H new ATOM 0 HA ILE A 469 -7.566 -3.794 7.872 1.00 0.00 H new ATOM 0 HB ILE A 469 -7.743 -0.762 7.914 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -5.770 -2.376 6.274 1.00 0.00 H new ATOM 0 HG13 ILE A 469 -7.253 -1.734 5.595 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -5.453 -0.953 8.803 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -6.625 -1.835 9.811 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -5.563 -2.726 8.695 1.00 0.00 H new ATOM 0 HD11 ILE A 469 -5.364 -0.248 5.137 1.00 0.00 H new ATOM 0 HD12 ILE A 469 -6.551 0.557 6.192 1.00 0.00 H new ATOM 0 HD13 ILE A 469 -5.045 -0.095 6.881 1.00 0.00 H new ATOM 346 N PRO A 470 -8.801 -3.520 10.029 1.00 0.00 N ATOM 347 CA PRO A 470 -9.598 -3.497 11.259 1.00 0.00 C ATOM 348 C PRO A 470 -9.402 -2.210 12.053 1.00 0.00 C ATOM 349 O PRO A 470 -8.321 -1.621 12.043 1.00 0.00 O ATOM 350 CB PRO A 470 -9.068 -4.697 12.047 1.00 0.00 C ATOM 351 CG PRO A 470 -7.679 -4.896 11.546 1.00 0.00 C ATOM 352 CD PRO A 470 -7.701 -4.496 10.097 1.00 0.00 C ATOM 0 HA PRO A 470 -10.667 -3.543 11.053 1.00 0.00 H new ATOM 0 HB2 PRO A 470 -9.078 -4.502 13.119 1.00 0.00 H new ATOM 0 HB3 PRO A 470 -9.680 -5.583 11.879 1.00 0.00 H new ATOM 0 HG2 PRO A 470 -6.970 -4.288 12.108 1.00 0.00 H new ATOM 0 HG3 PRO A 470 -7.368 -5.935 11.660 1.00 0.00 H new ATOM 0 HD2 PRO A 470 -6.753 -4.055 9.787 1.00 0.00 H new ATOM 0 HD3 PRO A 470 -7.882 -5.352 9.447 1.00 0.00 H new ATOM 360 N PHE A 471 -10.454 -1.778 12.741 1.00 0.00 N ATOM 361 CA PHE A 471 -10.397 -0.560 13.540 1.00 0.00 C ATOM 362 C PHE A 471 -9.256 -0.626 14.552 1.00 0.00 C ATOM 363 O PHE A 471 -8.549 0.358 14.768 1.00 0.00 O ATOM 364 CB PHE A 471 -11.726 -0.339 14.267 1.00 0.00 C ATOM 365 CG PHE A 471 -11.606 0.537 15.481 1.00 0.00 C ATOM 366 CD1 PHE A 471 -11.280 1.878 15.354 1.00 0.00 C ATOM 367 CD2 PHE A 471 -11.821 0.021 16.748 1.00 0.00 C ATOM 368 CE1 PHE A 471 -11.169 2.687 16.470 1.00 0.00 C ATOM 369 CE2 PHE A 471 -11.712 0.825 17.868 1.00 0.00 C ATOM 370 CZ PHE A 471 -11.387 2.160 17.728 1.00 0.00 C ATOM 0 H PHE A 471 -11.356 -2.254 12.761 1.00 0.00 H new ATOM 0 HA PHE A 471 -10.215 0.278 12.867 1.00 0.00 H new ATOM 0 HB2 PHE A 471 -12.440 0.108 13.575 1.00 0.00 H new ATOM 0 HB3 PHE A 471 -12.133 -1.305 14.565 1.00 0.00 H new ATOM 0 HD1 PHE A 471 -11.111 2.296 14.373 1.00 0.00 H new ATOM 0 HD2 PHE A 471 -12.077 -1.022 16.863 1.00 0.00 H new ATOM 0 HE1 PHE A 471 -10.912 3.730 16.358 1.00 0.00 H new ATOM 0 HE2 PHE A 471 -11.881 0.410 18.851 1.00 0.00 H new ATOM 0 HZ PHE A 471 -11.303 2.791 18.601 1.00 0.00 H new ATOM 380 N GLN A 472 -9.086 -1.791 15.168 1.00 0.00 N ATOM 381 CA GLN A 472 -8.032 -1.985 16.157 1.00 0.00 C ATOM 382 C GLN A 472 -6.669 -1.619 15.579 1.00 0.00 C ATOM 383 O GLN A 472 -5.832 -1.031 16.262 1.00 0.00 O ATOM 384 CB GLN A 472 -8.021 -3.435 16.643 1.00 0.00 C ATOM 385 CG GLN A 472 -7.198 -3.647 17.904 1.00 0.00 C ATOM 386 CD GLN A 472 -7.816 -2.989 19.122 1.00 0.00 C ATOM 387 OE1 GLN A 472 -8.932 -3.321 19.522 1.00 0.00 O ATOM 388 NE2 GLN A 472 -7.092 -2.050 19.719 1.00 0.00 N ATOM 0 H GLN A 472 -9.664 -2.614 15.000 1.00 0.00 H new ATOM 0 HA GLN A 472 -8.236 -1.328 17.002 1.00 0.00 H new ATOM 0 HB2 GLN A 472 -9.046 -3.755 16.830 1.00 0.00 H new ATOM 0 HB3 GLN A 472 -7.628 -4.072 15.851 1.00 0.00 H new ATOM 0 HG2 GLN A 472 -7.091 -4.716 18.088 1.00 0.00 H new ATOM 0 HG3 GLN A 472 -6.195 -3.248 17.750 1.00 0.00 H new ATOM 0 HE21 GLN A 472 -6.171 -1.806 19.353 1.00 0.00 H new ATOM 0 HE22 GLN A 472 -7.456 -1.572 20.543 1.00 0.00 H new ATOM 397 N ALA A 473 -6.453 -1.972 14.316 1.00 0.00 N ATOM 398 CA ALA A 473 -5.192 -1.680 13.646 1.00 0.00 C ATOM 399 C ALA A 473 -4.975 -0.176 13.518 1.00 0.00 C ATOM 400 O ALA A 473 -5.914 0.578 13.268 1.00 0.00 O ATOM 401 CB ALA A 473 -5.158 -2.339 12.275 1.00 0.00 C ATOM 0 H ALA A 473 -7.135 -2.461 13.736 1.00 0.00 H new ATOM 0 HA ALA A 473 -4.383 -2.087 14.253 1.00 0.00 H new ATOM 0 HB1 ALA A 473 -4.211 -2.113 11.786 1.00 0.00 H new ATOM 0 HB2 ALA A 473 -5.259 -3.418 12.388 1.00 0.00 H new ATOM 0 HB3 ALA A 473 -5.980 -1.959 11.668 1.00 0.00 H new ATOM 407 N ASN A 474 -3.729 0.254 13.691 1.00 0.00 N ATOM 408 CA ASN A 474 -3.388 1.668 13.596 1.00 0.00 C ATOM 409 C ASN A 474 -2.220 1.884 12.638 1.00 0.00 C ATOM 410 O ASN A 474 -1.531 0.936 12.262 1.00 0.00 O ATOM 411 CB ASN A 474 -3.038 2.224 14.978 1.00 0.00 C ATOM 412 CG ASN A 474 -1.573 2.037 15.322 1.00 0.00 C ATOM 413 OD1 ASN A 474 -0.786 2.982 15.268 1.00 0.00 O ATOM 414 ND2 ASN A 474 -1.201 0.813 15.679 1.00 0.00 N ATOM 0 H ASN A 474 -2.939 -0.357 13.898 1.00 0.00 H new ATOM 0 HA ASN A 474 -4.257 2.199 13.207 1.00 0.00 H new ATOM 0 HB2 ASN A 474 -3.284 3.285 15.013 1.00 0.00 H new ATOM 0 HB3 ASN A 474 -3.651 1.730 15.731 1.00 0.00 H new ATOM 0 HD21 ASN A 474 -0.228 0.626 15.922 1.00 0.00 H new ATOM 0 HD22 ASN A 474 -1.888 0.060 15.710 1.00 0.00 H new ATOM 421 N GLN A 475 -2.003 3.136 12.250 1.00 0.00 N ATOM 422 CA GLN A 475 -0.919 3.475 11.336 1.00 0.00 C ATOM 423 C GLN A 475 0.365 2.748 11.722 1.00 0.00 C ATOM 424 O GLN A 475 0.984 2.079 10.894 1.00 0.00 O ATOM 425 CB GLN A 475 -0.681 4.986 11.331 1.00 0.00 C ATOM 426 CG GLN A 475 0.435 5.424 10.397 1.00 0.00 C ATOM 427 CD GLN A 475 0.939 6.820 10.704 1.00 0.00 C ATOM 428 OE1 GLN A 475 0.153 7.737 10.945 1.00 0.00 O ATOM 429 NE2 GLN A 475 2.256 6.990 10.696 1.00 0.00 N ATOM 0 H GLN A 475 -2.563 3.932 12.554 1.00 0.00 H new ATOM 0 HA GLN A 475 -1.209 3.157 10.335 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -1.604 5.490 11.042 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -0.444 5.311 12.344 1.00 0.00 H new ATOM 0 HG2 GLN A 475 1.263 4.719 10.470 1.00 0.00 H new ATOM 0 HG3 GLN A 475 0.077 5.389 9.368 1.00 0.00 H new ATOM 0 HE21 GLN A 475 2.871 6.202 10.491 1.00 0.00 H new ATOM 0 HE22 GLN A 475 2.653 7.908 10.895 1.00 0.00 H new ATOM 438 N ARG A 476 0.760 2.884 12.983 1.00 0.00 N ATOM 439 CA ARG A 476 1.971 2.241 13.478 1.00 0.00 C ATOM 440 C ARG A 476 1.946 0.742 13.194 1.00 0.00 C ATOM 441 O ARG A 476 2.912 0.183 12.676 1.00 0.00 O ATOM 442 CB ARG A 476 2.126 2.483 14.981 1.00 0.00 C ATOM 443 CG ARG A 476 3.441 1.974 15.548 1.00 0.00 C ATOM 444 CD ARG A 476 3.330 1.682 17.036 1.00 0.00 C ATOM 445 NE ARG A 476 3.511 2.885 17.845 1.00 0.00 N ATOM 446 CZ ARG A 476 3.272 2.935 19.151 1.00 0.00 C ATOM 447 NH1 ARG A 476 2.845 1.856 19.792 1.00 0.00 N ATOM 448 NH2 ARG A 476 3.460 4.067 19.818 1.00 0.00 N ATOM 0 H ARG A 476 0.259 3.434 13.681 1.00 0.00 H new ATOM 0 HA ARG A 476 2.823 2.678 12.957 1.00 0.00 H new ATOM 0 HB2 ARG A 476 2.045 3.552 15.178 1.00 0.00 H new ATOM 0 HB3 ARG A 476 1.302 1.998 15.505 1.00 0.00 H new ATOM 0 HG2 ARG A 476 3.740 1.069 15.020 1.00 0.00 H new ATOM 0 HG3 ARG A 476 4.223 2.715 15.379 1.00 0.00 H new ATOM 0 HD2 ARG A 476 2.354 1.246 17.248 1.00 0.00 H new ATOM 0 HD3 ARG A 476 4.078 0.940 17.317 1.00 0.00 H new ATOM 0 HE ARG A 476 3.839 3.733 17.382 1.00 0.00 H new ATOM 0 HH11 ARG A 476 2.699 0.984 19.283 1.00 0.00 H new ATOM 0 HH12 ARG A 476 2.662 1.897 20.795 1.00 0.00 H new ATOM 0 HH21 ARG A 476 3.788 4.899 19.328 1.00 0.00 H new ATOM 0 HH22 ARG A 476 3.276 4.105 20.821 1.00 0.00 H new ATOM 462 N GLU A 477 0.835 0.098 13.539 1.00 0.00 N ATOM 463 CA GLU A 477 0.686 -1.336 13.322 1.00 0.00 C ATOM 464 C GLU A 477 0.991 -1.702 11.872 1.00 0.00 C ATOM 465 O GLU A 477 1.706 -2.668 11.602 1.00 0.00 O ATOM 466 CB GLU A 477 -0.732 -1.785 13.685 1.00 0.00 C ATOM 467 CG GLU A 477 -1.005 -3.247 13.377 1.00 0.00 C ATOM 468 CD GLU A 477 -0.322 -4.186 14.353 1.00 0.00 C ATOM 469 OE1 GLU A 477 0.026 -3.735 15.464 1.00 0.00 O ATOM 470 OE2 GLU A 477 -0.134 -5.370 14.005 1.00 0.00 O ATOM 0 H GLU A 477 0.026 0.546 13.969 1.00 0.00 H new ATOM 0 HA GLU A 477 1.399 -1.851 13.966 1.00 0.00 H new ATOM 0 HB2 GLU A 477 -0.899 -1.609 14.748 1.00 0.00 H new ATOM 0 HB3 GLU A 477 -1.449 -1.168 13.143 1.00 0.00 H new ATOM 0 HG2 GLU A 477 -2.080 -3.425 13.400 1.00 0.00 H new ATOM 0 HG3 GLU A 477 -0.666 -3.471 12.365 1.00 0.00 H new ATOM 477 N ILE A 478 0.444 -0.924 10.944 1.00 0.00 N ATOM 478 CA ILE A 478 0.658 -1.166 9.523 1.00 0.00 C ATOM 479 C ILE A 478 2.120 -0.954 9.143 1.00 0.00 C ATOM 480 O ILE A 478 2.719 -1.782 8.457 1.00 0.00 O ATOM 481 CB ILE A 478 -0.224 -0.247 8.657 1.00 0.00 C ATOM 482 CG1 ILE A 478 -1.704 -0.501 8.948 1.00 0.00 C ATOM 483 CG2 ILE A 478 0.076 -0.462 7.181 1.00 0.00 C ATOM 484 CD1 ILE A 478 -2.117 -1.945 8.762 1.00 0.00 C ATOM 0 H ILE A 478 -0.150 -0.121 11.151 1.00 0.00 H new ATOM 0 HA ILE A 478 0.383 -2.204 9.335 1.00 0.00 H new ATOM 0 HB ILE A 478 0.003 0.790 8.907 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -1.922 -0.198 9.972 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -2.308 0.128 8.294 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.555 0.194 6.582 1.00 0.00 H new ATOM 0 HG22 ILE A 478 1.124 -0.235 6.986 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -0.126 -1.500 6.916 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.179 -2.052 8.985 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -1.931 -2.247 7.731 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -1.539 -2.578 9.435 1.00 0.00 H new ATOM 496 N ARG A 479 2.688 0.159 9.596 1.00 0.00 N ATOM 497 CA ARG A 479 4.080 0.479 9.304 1.00 0.00 C ATOM 498 C ARG A 479 4.994 -0.687 9.669 1.00 0.00 C ATOM 499 O ARG A 479 5.779 -1.153 8.844 1.00 0.00 O ATOM 500 CB ARG A 479 4.508 1.734 10.068 1.00 0.00 C ATOM 501 CG ARG A 479 5.682 2.462 9.435 1.00 0.00 C ATOM 502 CD ARG A 479 5.913 3.817 10.084 1.00 0.00 C ATOM 503 NE ARG A 479 6.497 3.693 11.417 1.00 0.00 N ATOM 504 CZ ARG A 479 7.799 3.553 11.638 1.00 0.00 C ATOM 505 NH1 ARG A 479 8.649 3.520 10.621 1.00 0.00 N ATOM 506 NH2 ARG A 479 8.255 3.446 12.880 1.00 0.00 N ATOM 0 H ARG A 479 2.206 0.854 10.166 1.00 0.00 H new ATOM 0 HA ARG A 479 4.167 0.666 8.234 1.00 0.00 H new ATOM 0 HB2 ARG A 479 3.660 2.416 10.133 1.00 0.00 H new ATOM 0 HB3 ARG A 479 4.772 1.456 11.088 1.00 0.00 H new ATOM 0 HG2 ARG A 479 6.582 1.854 9.529 1.00 0.00 H new ATOM 0 HG3 ARG A 479 5.497 2.595 8.369 1.00 0.00 H new ATOM 0 HD2 ARG A 479 6.572 4.413 9.453 1.00 0.00 H new ATOM 0 HD3 ARG A 479 4.966 4.353 10.151 1.00 0.00 H new ATOM 0 HE ARG A 479 5.871 3.715 12.222 1.00 0.00 H new ATOM 0 HH11 ARG A 479 8.304 3.602 9.665 1.00 0.00 H new ATOM 0 HH12 ARG A 479 9.648 3.412 10.795 1.00 0.00 H new ATOM 0 HH21 ARG A 479 7.605 3.471 13.666 1.00 0.00 H new ATOM 0 HH22 ARG A 479 9.255 3.338 13.049 1.00 0.00 H new ATOM 520 N GLU A 480 4.885 -1.153 10.909 1.00 0.00 N ATOM 521 CA GLU A 480 5.703 -2.264 11.382 1.00 0.00 C ATOM 522 C GLU A 480 5.325 -3.559 10.670 1.00 0.00 C ATOM 523 O GLU A 480 6.173 -4.420 10.431 1.00 0.00 O ATOM 524 CB GLU A 480 5.545 -2.435 12.894 1.00 0.00 C ATOM 525 CG GLU A 480 6.461 -1.536 13.707 1.00 0.00 C ATOM 526 CD GLU A 480 6.812 -2.130 15.058 1.00 0.00 C ATOM 527 OE1 GLU A 480 7.355 -3.254 15.090 1.00 0.00 O ATOM 528 OE2 GLU A 480 6.543 -1.469 16.083 1.00 0.00 O ATOM 0 H GLU A 480 4.239 -0.779 11.604 1.00 0.00 H new ATOM 0 HA GLU A 480 6.745 -2.037 11.157 1.00 0.00 H new ATOM 0 HB2 GLU A 480 4.510 -2.229 13.168 1.00 0.00 H new ATOM 0 HB3 GLU A 480 5.743 -3.474 13.156 1.00 0.00 H new ATOM 0 HG2 GLU A 480 7.377 -1.354 13.145 1.00 0.00 H new ATOM 0 HG3 GLU A 480 5.979 -0.569 13.853 1.00 0.00 H new ATOM 535 N LEU A 481 4.046 -3.691 10.334 1.00 0.00 N ATOM 536 CA LEU A 481 3.554 -4.882 9.650 1.00 0.00 C ATOM 537 C LEU A 481 4.355 -5.150 8.380 1.00 0.00 C ATOM 538 O LEU A 481 4.736 -6.288 8.102 1.00 0.00 O ATOM 539 CB LEU A 481 2.072 -4.721 9.307 1.00 0.00 C ATOM 540 CG LEU A 481 1.368 -5.967 8.767 1.00 0.00 C ATOM 541 CD1 LEU A 481 1.160 -6.985 9.878 1.00 0.00 C ATOM 542 CD2 LEU A 481 0.039 -5.594 8.127 1.00 0.00 C ATOM 0 H LEU A 481 3.331 -2.988 10.524 1.00 0.00 H new ATOM 0 HA LEU A 481 3.675 -5.733 10.321 1.00 0.00 H new ATOM 0 HB2 LEU A 481 1.546 -4.391 10.203 1.00 0.00 H new ATOM 0 HB3 LEU A 481 1.975 -3.925 8.569 1.00 0.00 H new ATOM 0 HG LEU A 481 2.002 -6.417 8.003 1.00 0.00 H new ATOM 0 HD11 LEU A 481 0.658 -7.865 9.476 1.00 0.00 H new ATOM 0 HD12 LEU A 481 2.126 -7.275 10.291 1.00 0.00 H new ATOM 0 HD13 LEU A 481 0.547 -6.545 10.664 1.00 0.00 H new ATOM 0 HD21 LEU A 481 -0.448 -6.493 7.748 1.00 0.00 H new ATOM 0 HD22 LEU A 481 -0.602 -5.120 8.870 1.00 0.00 H new ATOM 0 HD23 LEU A 481 0.213 -4.902 7.303 1.00 0.00 H new ATOM 554 N PHE A 482 4.610 -4.096 7.613 1.00 0.00 N ATOM 555 CA PHE A 482 5.367 -4.217 6.372 1.00 0.00 C ATOM 556 C PHE A 482 6.857 -4.003 6.622 1.00 0.00 C ATOM 557 O PHE A 482 7.700 -4.659 6.010 1.00 0.00 O ATOM 558 CB PHE A 482 4.861 -3.208 5.340 1.00 0.00 C ATOM 559 CG PHE A 482 3.519 -3.561 4.764 1.00 0.00 C ATOM 560 CD1 PHE A 482 3.415 -4.471 3.725 1.00 0.00 C ATOM 561 CD2 PHE A 482 2.363 -2.982 5.261 1.00 0.00 C ATOM 562 CE1 PHE A 482 2.182 -4.797 3.192 1.00 0.00 C ATOM 563 CE2 PHE A 482 1.127 -3.305 4.733 1.00 0.00 C ATOM 564 CZ PHE A 482 1.037 -4.214 3.698 1.00 0.00 C ATOM 0 H PHE A 482 4.303 -3.147 7.829 1.00 0.00 H new ATOM 0 HA PHE A 482 5.222 -5.225 5.984 1.00 0.00 H new ATOM 0 HB2 PHE A 482 4.800 -2.224 5.805 1.00 0.00 H new ATOM 0 HB3 PHE A 482 5.587 -3.134 4.530 1.00 0.00 H new ATOM 0 HD1 PHE A 482 4.307 -4.931 3.327 1.00 0.00 H new ATOM 0 HD2 PHE A 482 2.428 -2.270 6.070 1.00 0.00 H new ATOM 0 HE1 PHE A 482 2.114 -5.507 2.381 1.00 0.00 H new ATOM 0 HE2 PHE A 482 0.233 -2.847 5.130 1.00 0.00 H new ATOM 0 HZ PHE A 482 0.072 -4.469 3.285 1.00 0.00 H new ATOM 574 N SER A 483 7.173 -3.080 7.525 1.00 0.00 N ATOM 575 CA SER A 483 8.561 -2.775 7.853 1.00 0.00 C ATOM 576 C SER A 483 9.317 -4.041 8.244 1.00 0.00 C ATOM 577 O SER A 483 10.504 -4.188 7.947 1.00 0.00 O ATOM 578 CB SER A 483 8.626 -1.756 8.992 1.00 0.00 C ATOM 579 OG SER A 483 9.948 -1.279 9.174 1.00 0.00 O ATOM 0 H SER A 483 6.487 -2.531 8.042 1.00 0.00 H new ATOM 0 HA SER A 483 9.033 -2.350 6.967 1.00 0.00 H new ATOM 0 HB2 SER A 483 7.961 -0.920 8.775 1.00 0.00 H new ATOM 0 HB3 SER A 483 8.271 -2.214 9.915 1.00 0.00 H new ATOM 0 HG SER A 483 9.963 -0.628 9.906 1.00 0.00 H new ATOM 585 N THR A 484 8.622 -4.956 8.913 1.00 0.00 N ATOM 586 CA THR A 484 9.226 -6.209 9.346 1.00 0.00 C ATOM 587 C THR A 484 9.783 -6.990 8.161 1.00 0.00 C ATOM 588 O THR A 484 10.579 -7.913 8.332 1.00 0.00 O ATOM 589 CB THR A 484 8.211 -7.092 10.097 1.00 0.00 C ATOM 590 OG1 THR A 484 8.898 -8.106 10.839 1.00 0.00 O ATOM 591 CG2 THR A 484 7.235 -7.740 9.127 1.00 0.00 C ATOM 0 H THR A 484 7.640 -4.852 9.167 1.00 0.00 H new ATOM 0 HA THR A 484 10.041 -5.950 10.022 1.00 0.00 H new ATOM 0 HB THR A 484 7.649 -6.458 10.783 1.00 0.00 H new ATOM 0 HG1 THR A 484 9.655 -8.440 10.313 1.00 0.00 H new ATOM 0 HG21 THR A 484 6.528 -8.358 9.681 1.00 0.00 H new ATOM 0 HG22 THR A 484 6.692 -6.965 8.585 1.00 0.00 H new ATOM 0 HG23 THR A 484 7.784 -8.361 8.419 1.00 0.00 H new ATOM 599 N PHE A 485 9.359 -6.614 6.959 1.00 0.00 N ATOM 600 CA PHE A 485 9.815 -7.280 5.745 1.00 0.00 C ATOM 601 C PHE A 485 10.952 -6.499 5.091 1.00 0.00 C ATOM 602 O PHE A 485 11.939 -7.079 4.640 1.00 0.00 O ATOM 603 CB PHE A 485 8.657 -7.439 4.758 1.00 0.00 C ATOM 604 CG PHE A 485 7.729 -8.570 5.100 1.00 0.00 C ATOM 605 CD1 PHE A 485 7.968 -9.848 4.619 1.00 0.00 C ATOM 606 CD2 PHE A 485 6.619 -8.356 5.901 1.00 0.00 C ATOM 607 CE1 PHE A 485 7.117 -10.891 4.932 1.00 0.00 C ATOM 608 CE2 PHE A 485 5.765 -9.395 6.217 1.00 0.00 C ATOM 609 CZ PHE A 485 6.013 -10.664 5.731 1.00 0.00 C ATOM 0 H PHE A 485 8.700 -5.852 6.800 1.00 0.00 H new ATOM 0 HA PHE A 485 10.186 -8.267 6.020 1.00 0.00 H new ATOM 0 HB2 PHE A 485 8.088 -6.510 4.725 1.00 0.00 H new ATOM 0 HB3 PHE A 485 9.061 -7.601 3.759 1.00 0.00 H new ATOM 0 HD1 PHE A 485 8.829 -10.031 3.993 1.00 0.00 H new ATOM 0 HD2 PHE A 485 6.419 -7.366 6.283 1.00 0.00 H new ATOM 0 HE1 PHE A 485 7.315 -11.883 4.552 1.00 0.00 H new ATOM 0 HE2 PHE A 485 4.904 -9.215 6.844 1.00 0.00 H new ATOM 0 HZ PHE A 485 5.345 -11.477 5.975 1.00 0.00 H new ATOM 619 N GLY A 486 10.803 -5.179 5.042 1.00 0.00 N ATOM 620 CA GLY A 486 11.823 -4.340 4.441 1.00 0.00 C ATOM 621 C GLY A 486 11.677 -2.882 4.829 1.00 0.00 C ATOM 622 O GLY A 486 10.798 -2.527 5.614 1.00 0.00 O ATOM 0 H GLY A 486 9.995 -4.676 5.408 1.00 0.00 H new ATOM 0 HA2 GLY A 486 12.807 -4.697 4.744 1.00 0.00 H new ATOM 0 HA3 GLY A 486 11.771 -4.431 3.356 1.00 0.00 H new ATOM 626 N GLU A 487 12.541 -2.035 4.279 1.00 0.00 N ATOM 627 CA GLU A 487 12.505 -0.607 4.575 1.00 0.00 C ATOM 628 C GLU A 487 11.276 0.047 3.949 1.00 0.00 C ATOM 629 O GLU A 487 10.949 -0.204 2.788 1.00 0.00 O ATOM 630 CB GLU A 487 13.776 0.075 4.063 1.00 0.00 C ATOM 631 CG GLU A 487 14.185 1.289 4.879 1.00 0.00 C ATOM 632 CD GLU A 487 14.532 0.938 6.313 1.00 0.00 C ATOM 633 OE1 GLU A 487 15.638 0.403 6.542 1.00 0.00 O ATOM 634 OE2 GLU A 487 13.699 1.198 7.206 1.00 0.00 O ATOM 0 H GLU A 487 13.274 -2.312 3.626 1.00 0.00 H new ATOM 0 HA GLU A 487 12.448 -0.487 5.657 1.00 0.00 H new ATOM 0 HB2 GLU A 487 14.593 -0.647 4.067 1.00 0.00 H new ATOM 0 HB3 GLU A 487 13.624 0.378 3.027 1.00 0.00 H new ATOM 0 HG2 GLU A 487 15.044 1.766 4.408 1.00 0.00 H new ATOM 0 HG3 GLU A 487 13.373 2.016 4.873 1.00 0.00 H new ATOM 641 N LEU A 488 10.600 0.886 4.726 1.00 0.00 N ATOM 642 CA LEU A 488 9.407 1.577 4.249 1.00 0.00 C ATOM 643 C LEU A 488 9.715 3.035 3.924 1.00 0.00 C ATOM 644 O LEU A 488 10.558 3.661 4.567 1.00 0.00 O ATOM 645 CB LEU A 488 8.296 1.500 5.298 1.00 0.00 C ATOM 646 CG LEU A 488 7.674 0.120 5.517 1.00 0.00 C ATOM 647 CD1 LEU A 488 6.492 0.213 6.470 1.00 0.00 C ATOM 648 CD2 LEU A 488 7.245 -0.488 4.190 1.00 0.00 C ATOM 0 H LEU A 488 10.857 1.104 5.689 1.00 0.00 H new ATOM 0 HA LEU A 488 9.072 1.084 3.336 1.00 0.00 H new ATOM 0 HB2 LEU A 488 8.697 1.851 6.249 1.00 0.00 H new ATOM 0 HB3 LEU A 488 7.504 2.192 5.011 1.00 0.00 H new ATOM 0 HG LEU A 488 8.426 -0.530 5.965 1.00 0.00 H new ATOM 0 HD11 LEU A 488 6.062 -0.778 6.614 1.00 0.00 H new ATOM 0 HD12 LEU A 488 6.828 0.606 7.430 1.00 0.00 H new ATOM 0 HD13 LEU A 488 5.738 0.878 6.050 1.00 0.00 H new ATOM 0 HD21 LEU A 488 6.805 -1.470 4.365 1.00 0.00 H new ATOM 0 HD22 LEU A 488 6.509 0.160 3.714 1.00 0.00 H new ATOM 0 HD23 LEU A 488 8.113 -0.591 3.539 1.00 0.00 H new ATOM 660 N LYS A 489 9.025 3.571 2.923 1.00 0.00 N ATOM 661 CA LYS A 489 9.221 4.957 2.514 1.00 0.00 C ATOM 662 C LYS A 489 8.298 5.889 3.291 1.00 0.00 C ATOM 663 O LYS A 489 8.730 6.919 3.809 1.00 0.00 O ATOM 664 CB LYS A 489 8.970 5.107 1.012 1.00 0.00 C ATOM 665 CG LYS A 489 10.206 4.870 0.162 1.00 0.00 C ATOM 666 CD LYS A 489 10.072 5.515 -1.208 1.00 0.00 C ATOM 667 CE LYS A 489 11.208 5.102 -2.131 1.00 0.00 C ATOM 668 NZ LYS A 489 11.314 6.000 -3.315 1.00 0.00 N ATOM 0 H LYS A 489 8.325 3.066 2.380 1.00 0.00 H new ATOM 0 HA LYS A 489 10.253 5.232 2.733 1.00 0.00 H new ATOM 0 HB2 LYS A 489 8.192 4.406 0.710 1.00 0.00 H new ATOM 0 HB3 LYS A 489 8.590 6.109 0.814 1.00 0.00 H new ATOM 0 HG2 LYS A 489 11.082 5.273 0.671 1.00 0.00 H new ATOM 0 HG3 LYS A 489 10.369 3.799 0.046 1.00 0.00 H new ATOM 0 HD2 LYS A 489 9.118 5.231 -1.653 1.00 0.00 H new ATOM 0 HD3 LYS A 489 10.064 6.600 -1.102 1.00 0.00 H new ATOM 0 HE2 LYS A 489 12.148 5.116 -1.579 1.00 0.00 H new ATOM 0 HE3 LYS A 489 11.050 4.077 -2.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 489 12.100 5.686 -3.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 489 10.426 5.968 -3.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 489 11.490 6.974 -2.997 1.00 0.00 H new ATOM 682 N THR A 490 7.022 5.522 3.369 1.00 0.00 N ATOM 683 CA THR A 490 6.038 6.325 4.083 1.00 0.00 C ATOM 684 C THR A 490 4.690 5.616 4.145 1.00 0.00 C ATOM 685 O THR A 490 4.250 5.011 3.167 1.00 0.00 O ATOM 686 CB THR A 490 5.850 7.703 3.421 1.00 0.00 C ATOM 687 OG1 THR A 490 4.946 8.500 4.194 1.00 0.00 O ATOM 688 CG2 THR A 490 5.318 7.554 2.003 1.00 0.00 C ATOM 0 H THR A 490 6.647 4.673 2.946 1.00 0.00 H new ATOM 0 HA THR A 490 6.419 6.465 5.095 1.00 0.00 H new ATOM 0 HB THR A 490 6.821 8.196 3.378 1.00 0.00 H new ATOM 0 HG1 THR A 490 4.834 9.375 3.767 1.00 0.00 H new ATOM 0 HG21 THR A 490 5.193 8.540 1.556 1.00 0.00 H new ATOM 0 HG22 THR A 490 6.023 6.973 1.409 1.00 0.00 H new ATOM 0 HG23 THR A 490 4.356 7.042 2.027 1.00 0.00 H new ATOM 696 N VAL A 491 4.038 5.694 5.300 1.00 0.00 N ATOM 697 CA VAL A 491 2.738 5.061 5.489 1.00 0.00 C ATOM 698 C VAL A 491 1.640 6.103 5.668 1.00 0.00 C ATOM 699 O VAL A 491 1.788 7.049 6.441 1.00 0.00 O ATOM 700 CB VAL A 491 2.743 4.122 6.710 1.00 0.00 C ATOM 701 CG1 VAL A 491 1.321 3.754 7.107 1.00 0.00 C ATOM 702 CG2 VAL A 491 3.563 2.874 6.419 1.00 0.00 C ATOM 0 H VAL A 491 4.389 6.190 6.120 1.00 0.00 H new ATOM 0 HA VAL A 491 2.537 4.477 4.591 1.00 0.00 H new ATOM 0 HB VAL A 491 3.205 4.646 7.547 1.00 0.00 H new ATOM 0 HG11 VAL A 491 1.345 3.090 7.971 1.00 0.00 H new ATOM 0 HG12 VAL A 491 0.768 4.659 7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 491 0.830 3.249 6.275 1.00 0.00 H new ATOM 0 HG21 VAL A 491 3.556 2.222 7.292 1.00 0.00 H new ATOM 0 HG22 VAL A 491 3.132 2.346 5.568 1.00 0.00 H new ATOM 0 HG23 VAL A 491 4.589 3.159 6.188 1.00 0.00 H new ATOM 712 N ARG A 492 0.537 5.922 4.948 1.00 0.00 N ATOM 713 CA ARG A 492 -0.587 6.847 5.026 1.00 0.00 C ATOM 714 C ARG A 492 -1.859 6.122 5.453 1.00 0.00 C ATOM 715 O ARG A 492 -2.310 5.190 4.784 1.00 0.00 O ATOM 716 CB ARG A 492 -0.806 7.532 3.676 1.00 0.00 C ATOM 717 CG ARG A 492 0.156 8.679 3.412 1.00 0.00 C ATOM 718 CD ARG A 492 0.317 8.940 1.922 1.00 0.00 C ATOM 719 NE ARG A 492 0.965 10.221 1.658 1.00 0.00 N ATOM 720 CZ ARG A 492 0.359 11.395 1.800 1.00 0.00 C ATOM 721 NH1 ARG A 492 -0.903 11.448 2.202 1.00 0.00 N ATOM 722 NH2 ARG A 492 1.016 12.518 1.539 1.00 0.00 N ATOM 0 H ARG A 492 0.398 5.143 4.304 1.00 0.00 H new ATOM 0 HA ARG A 492 -0.352 7.603 5.775 1.00 0.00 H new ATOM 0 HB2 ARG A 492 -0.703 6.792 2.882 1.00 0.00 H new ATOM 0 HB3 ARG A 492 -1.828 7.908 3.631 1.00 0.00 H new ATOM 0 HG2 ARG A 492 -0.208 9.581 3.903 1.00 0.00 H new ATOM 0 HG3 ARG A 492 1.128 8.448 3.849 1.00 0.00 H new ATOM 0 HD2 ARG A 492 0.904 8.138 1.475 1.00 0.00 H new ATOM 0 HD3 ARG A 492 -0.662 8.924 1.443 1.00 0.00 H new ATOM 0 HE ARG A 492 1.937 10.215 1.347 1.00 0.00 H new ATOM 0 HH11 ARG A 492 -1.411 10.587 2.403 1.00 0.00 H new ATOM 0 HH12 ARG A 492 -1.366 12.350 2.310 1.00 0.00 H new ATOM 0 HH21 ARG A 492 1.987 12.480 1.229 1.00 0.00 H new ATOM 0 HH22 ARG A 492 0.550 13.419 1.648 1.00 0.00 H new ATOM 736 N LEU A 493 -2.434 6.554 6.570 1.00 0.00 N ATOM 737 CA LEU A 493 -3.655 5.945 7.087 1.00 0.00 C ATOM 738 C LEU A 493 -4.595 7.006 7.651 1.00 0.00 C ATOM 739 O LEU A 493 -4.168 7.998 8.242 1.00 0.00 O ATOM 740 CB LEU A 493 -3.318 4.918 8.170 1.00 0.00 C ATOM 741 CG LEU A 493 -3.038 3.496 7.682 1.00 0.00 C ATOM 742 CD1 LEU A 493 -1.558 3.318 7.377 1.00 0.00 C ATOM 743 CD2 LEU A 493 -3.498 2.478 8.715 1.00 0.00 C ATOM 0 H LEU A 493 -2.075 7.323 7.135 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.158 5.441 6.262 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -2.445 5.271 8.718 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -4.146 4.881 8.878 1.00 0.00 H new ATOM 0 HG LEU A 493 -3.600 3.330 6.763 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -1.378 2.300 7.031 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -1.259 4.023 6.601 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -0.976 3.503 8.280 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -3.291 1.472 8.351 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -2.964 2.643 9.651 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.569 2.590 8.884 1.00 0.00 H new ATOM 755 N PRO A 494 -5.906 6.792 7.468 1.00 0.00 N ATOM 756 CA PRO A 494 -6.935 7.717 7.953 1.00 0.00 C ATOM 757 C PRO A 494 -7.047 7.713 9.474 1.00 0.00 C ATOM 758 O PRO A 494 -6.979 6.660 10.109 1.00 0.00 O ATOM 759 CB PRO A 494 -8.221 7.181 7.321 1.00 0.00 C ATOM 760 CG PRO A 494 -7.954 5.735 7.085 1.00 0.00 C ATOM 761 CD PRO A 494 -6.487 5.631 6.772 1.00 0.00 C ATOM 0 HA PRO A 494 -6.712 8.750 7.687 1.00 0.00 H new ATOM 0 HB2 PRO A 494 -9.076 7.323 7.982 1.00 0.00 H new ATOM 0 HB3 PRO A 494 -8.450 7.698 6.389 1.00 0.00 H new ATOM 0 HG2 PRO A 494 -8.209 5.143 7.964 1.00 0.00 H new ATOM 0 HG3 PRO A 494 -8.557 5.356 6.260 1.00 0.00 H new ATOM 0 HD2 PRO A 494 -6.065 4.693 7.133 1.00 0.00 H new ATOM 0 HD3 PRO A 494 -6.301 5.672 5.699 1.00 0.00 H new ATOM 769 N LYS A 495 -7.220 8.896 10.053 1.00 0.00 N ATOM 770 CA LYS A 495 -7.344 9.029 11.500 1.00 0.00 C ATOM 771 C LYS A 495 -8.784 9.337 11.897 1.00 0.00 C ATOM 772 O LYS A 495 -9.441 10.180 11.286 1.00 0.00 O ATOM 773 CB LYS A 495 -6.415 10.132 12.013 1.00 0.00 C ATOM 774 CG LYS A 495 -4.958 9.925 11.636 1.00 0.00 C ATOM 775 CD LYS A 495 -4.030 10.710 12.548 1.00 0.00 C ATOM 776 CE LYS A 495 -3.753 9.960 13.841 1.00 0.00 C ATOM 777 NZ LYS A 495 -2.622 9.001 13.695 1.00 0.00 N ATOM 0 H LYS A 495 -7.278 9.777 9.542 1.00 0.00 H new ATOM 0 HA LYS A 495 -7.056 8.080 11.953 1.00 0.00 H new ATOM 0 HB2 LYS A 495 -6.751 11.091 11.618 1.00 0.00 H new ATOM 0 HB3 LYS A 495 -6.496 10.188 13.099 1.00 0.00 H new ATOM 0 HG2 LYS A 495 -4.714 8.864 11.692 1.00 0.00 H new ATOM 0 HG3 LYS A 495 -4.801 10.234 10.602 1.00 0.00 H new ATOM 0 HD2 LYS A 495 -3.090 10.906 12.031 1.00 0.00 H new ATOM 0 HD3 LYS A 495 -4.476 11.678 12.776 1.00 0.00 H new ATOM 0 HE2 LYS A 495 -3.524 10.673 14.633 1.00 0.00 H new ATOM 0 HE3 LYS A 495 -4.649 9.421 14.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 495 -2.465 8.510 14.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 495 -2.850 8.305 12.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 495 -1.760 9.518 13.428 1.00 0.00 H new ATOM 791 N LYS A 496 -9.270 8.650 12.925 1.00 0.00 N ATOM 792 CA LYS A 496 -10.631 8.851 13.406 1.00 0.00 C ATOM 793 C LYS A 496 -10.726 10.113 14.257 1.00 0.00 C ATOM 794 O LYS A 496 -10.220 10.157 15.378 1.00 0.00 O ATOM 795 CB LYS A 496 -11.091 7.639 14.219 1.00 0.00 C ATOM 796 CG LYS A 496 -12.552 7.701 14.630 1.00 0.00 C ATOM 797 CD LYS A 496 -13.132 6.312 14.841 1.00 0.00 C ATOM 798 CE LYS A 496 -14.290 6.336 15.827 1.00 0.00 C ATOM 799 NZ LYS A 496 -14.479 5.017 16.491 1.00 0.00 N ATOM 0 H LYS A 496 -8.740 7.948 13.442 1.00 0.00 H new ATOM 0 HA LYS A 496 -11.282 8.968 12.540 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -10.925 6.735 13.633 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -10.474 7.557 15.114 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.648 8.280 15.549 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -13.125 8.223 13.863 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -13.473 5.910 13.887 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.354 5.643 15.208 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -14.108 7.100 16.582 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -15.206 6.615 15.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -15.277 5.074 17.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -14.678 4.292 15.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -13.614 4.762 17.010 1.00 0.00 H new ATOM 813 N MET A 497 -11.379 11.137 13.718 1.00 0.00 N ATOM 814 CA MET A 497 -11.543 12.399 14.431 1.00 0.00 C ATOM 815 C MET A 497 -13.010 12.648 14.767 1.00 0.00 C ATOM 816 O MET A 497 -13.366 12.847 15.929 1.00 0.00 O ATOM 817 CB MET A 497 -10.997 13.557 13.593 1.00 0.00 C ATOM 818 CG MET A 497 -11.222 14.922 14.222 1.00 0.00 C ATOM 819 SD MET A 497 -10.433 15.081 15.836 1.00 0.00 S ATOM 820 CE MET A 497 -8.781 15.581 15.358 1.00 0.00 C ATOM 0 H MET A 497 -11.803 11.118 12.791 1.00 0.00 H new ATOM 0 HA MET A 497 -10.981 12.336 15.363 1.00 0.00 H new ATOM 0 HB2 MET A 497 -9.928 13.410 13.437 1.00 0.00 H new ATOM 0 HB3 MET A 497 -11.468 13.537 12.610 1.00 0.00 H new ATOM 0 HG2 MET A 497 -10.836 15.693 13.555 1.00 0.00 H new ATOM 0 HG3 MET A 497 -12.293 15.098 14.326 1.00 0.00 H new ATOM 0 HE1 MET A 497 -8.170 15.720 16.250 1.00 0.00 H new ATOM 0 HE2 MET A 497 -8.335 14.810 14.729 1.00 0.00 H new ATOM 0 HE3 MET A 497 -8.831 16.518 14.803 1.00 0.00 H new ATOM 830 N THR A 498 -13.858 12.635 13.744 1.00 0.00 N ATOM 831 CA THR A 498 -15.285 12.860 13.931 1.00 0.00 C ATOM 832 C THR A 498 -15.943 11.672 14.624 1.00 0.00 C ATOM 833 O THR A 498 -16.692 11.839 15.586 1.00 0.00 O ATOM 834 CB THR A 498 -15.995 13.114 12.588 1.00 0.00 C ATOM 835 OG1 THR A 498 -16.128 11.885 11.864 1.00 0.00 O ATOM 836 CG2 THR A 498 -15.223 14.121 11.749 1.00 0.00 C ATOM 0 H THR A 498 -13.581 12.471 12.776 1.00 0.00 H new ATOM 0 HA THR A 498 -15.385 13.745 14.559 1.00 0.00 H new ATOM 0 HB THR A 498 -16.984 13.522 12.797 1.00 0.00 H new ATOM 0 HG1 THR A 498 -16.582 12.055 11.012 1.00 0.00 H new ATOM 0 HG21 THR A 498 -15.744 14.284 10.806 1.00 0.00 H new ATOM 0 HG22 THR A 498 -15.149 15.064 12.290 1.00 0.00 H new ATOM 0 HG23 THR A 498 -14.222 13.737 11.549 1.00 0.00 H new ATOM 844 N GLY A 499 -15.657 10.472 14.129 1.00 0.00 N ATOM 845 CA GLY A 499 -16.229 9.273 14.714 1.00 0.00 C ATOM 846 C GLY A 499 -17.133 8.532 13.750 1.00 0.00 C ATOM 847 O GLY A 499 -17.009 8.677 12.533 1.00 0.00 O ATOM 0 H GLY A 499 -15.040 10.308 13.334 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -15.425 8.611 15.036 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -16.796 9.542 15.605 1.00 0.00 H new ATOM 851 N THR A 500 -18.047 7.732 14.293 1.00 0.00 N ATOM 852 CA THR A 500 -18.974 6.963 13.472 1.00 0.00 C ATOM 853 C THR A 500 -18.242 6.239 12.348 1.00 0.00 C ATOM 854 O THR A 500 -18.702 6.220 11.207 1.00 0.00 O ATOM 855 CB THR A 500 -20.065 7.863 12.863 1.00 0.00 C ATOM 856 OG1 THR A 500 -19.482 8.774 11.925 1.00 0.00 O ATOM 857 CG2 THR A 500 -20.792 8.643 13.949 1.00 0.00 C ATOM 0 H THR A 500 -18.164 7.600 15.298 1.00 0.00 H new ATOM 0 HA THR A 500 -19.443 6.230 14.128 1.00 0.00 H new ATOM 0 HB THR A 500 -20.786 7.226 12.350 1.00 0.00 H new ATOM 0 HG1 THR A 500 -18.533 8.560 11.808 1.00 0.00 H new ATOM 0 HG21 THR A 500 -21.558 9.272 13.495 1.00 0.00 H new ATOM 0 HG22 THR A 500 -21.260 7.947 14.646 1.00 0.00 H new ATOM 0 HG23 THR A 500 -20.080 9.270 14.486 1.00 0.00 H new ATOM 865 N GLY A 501 -17.100 5.644 12.677 1.00 0.00 N ATOM 866 CA GLY A 501 -16.323 4.926 11.684 1.00 0.00 C ATOM 867 C GLY A 501 -15.715 5.849 10.646 1.00 0.00 C ATOM 868 O GLY A 501 -16.218 5.953 9.527 1.00 0.00 O ATOM 0 H GLY A 501 -16.699 5.646 13.615 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -15.528 4.370 12.181 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -16.961 4.195 11.187 1.00 0.00 H new ATOM 872 N ALA A 502 -14.631 6.522 11.017 1.00 0.00 N ATOM 873 CA ALA A 502 -13.954 7.440 10.110 1.00 0.00 C ATOM 874 C ALA A 502 -12.787 6.755 9.406 1.00 0.00 C ATOM 875 O ALA A 502 -12.655 6.832 8.184 1.00 0.00 O ATOM 876 CB ALA A 502 -13.469 8.668 10.866 1.00 0.00 C ATOM 0 H ALA A 502 -14.203 6.449 11.940 1.00 0.00 H new ATOM 0 HA ALA A 502 -14.669 7.754 9.350 1.00 0.00 H new ATOM 0 HB1 ALA A 502 -12.965 9.345 10.176 1.00 0.00 H new ATOM 0 HB2 ALA A 502 -14.321 9.177 11.317 1.00 0.00 H new ATOM 0 HB3 ALA A 502 -12.773 8.363 11.648 1.00 0.00 H new ATOM 882 N HIS A 503 -11.942 6.087 10.185 1.00 0.00 N ATOM 883 CA HIS A 503 -10.785 5.389 9.635 1.00 0.00 C ATOM 884 C HIS A 503 -11.213 4.378 8.576 1.00 0.00 C ATOM 885 O HIS A 503 -11.677 3.284 8.900 1.00 0.00 O ATOM 886 CB HIS A 503 -10.013 4.682 10.749 1.00 0.00 C ATOM 887 CG HIS A 503 -9.199 3.520 10.270 1.00 0.00 C ATOM 888 ND1 HIS A 503 -9.724 2.257 10.088 1.00 0.00 N ATOM 889 CD2 HIS A 503 -7.891 3.434 9.932 1.00 0.00 C ATOM 890 CE1 HIS A 503 -8.774 1.445 9.661 1.00 0.00 C ATOM 891 NE2 HIS A 503 -7.652 2.134 9.557 1.00 0.00 N ATOM 0 H HIS A 503 -12.036 6.014 11.198 1.00 0.00 H new ATOM 0 HA HIS A 503 -10.136 6.128 9.165 1.00 0.00 H new ATOM 0 HB2 HIS A 503 -9.354 5.401 11.235 1.00 0.00 H new ATOM 0 HB3 HIS A 503 -10.718 4.334 11.504 1.00 0.00 H new ATOM 0 HD1 HIS A 503 -10.694 1.992 10.257 1.00 0.00 H new ATOM 0 HD2 HIS A 503 -7.170 4.238 9.953 1.00 0.00 H new ATOM 0 HE1 HIS A 503 -8.894 0.396 9.435 1.00 0.00 H new ATOM 899 N ARG A 504 -11.055 4.751 7.310 1.00 0.00 N ATOM 900 CA ARG A 504 -11.428 3.878 6.204 1.00 0.00 C ATOM 901 C ARG A 504 -10.591 2.602 6.213 1.00 0.00 C ATOM 902 O ARG A 504 -9.445 2.602 6.662 1.00 0.00 O ATOM 903 CB ARG A 504 -11.253 4.606 4.870 1.00 0.00 C ATOM 904 CG ARG A 504 -12.180 4.103 3.776 1.00 0.00 C ATOM 905 CD ARG A 504 -13.634 4.131 4.221 1.00 0.00 C ATOM 906 NE ARG A 504 -14.551 4.236 3.090 1.00 0.00 N ATOM 907 CZ ARG A 504 -15.819 4.615 3.205 1.00 0.00 C ATOM 908 NH1 ARG A 504 -16.318 4.923 4.394 1.00 0.00 N ATOM 909 NH2 ARG A 504 -16.592 4.686 2.128 1.00 0.00 N ATOM 0 H ARG A 504 -10.671 5.652 7.025 1.00 0.00 H new ATOM 0 HA ARG A 504 -12.476 3.606 6.326 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -11.428 5.671 5.021 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -10.220 4.496 4.539 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -12.059 4.718 2.884 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -11.902 3.085 3.501 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -13.858 3.226 4.786 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -13.791 4.974 4.894 1.00 0.00 H new ATOM 0 HE ARG A 504 -14.199 4.006 2.161 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -15.728 4.869 5.224 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -17.292 5.214 4.479 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -16.212 4.449 1.211 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -17.566 4.977 2.217 1.00 0.00 H new ATOM 923 N GLY A 505 -11.172 1.515 5.714 1.00 0.00 N ATOM 924 CA GLY A 505 -10.465 0.248 5.675 1.00 0.00 C ATOM 925 C GLY A 505 -9.460 0.180 4.543 1.00 0.00 C ATOM 926 O GLY A 505 -9.448 -0.779 3.770 1.00 0.00 O ATOM 0 H GLY A 505 -12.119 1.489 5.336 1.00 0.00 H new ATOM 0 HA2 GLY A 505 -9.950 0.093 6.623 1.00 0.00 H new ATOM 0 HA3 GLY A 505 -11.185 -0.563 5.567 1.00 0.00 H new ATOM 930 N PHE A 506 -8.614 1.200 4.442 1.00 0.00 N ATOM 931 CA PHE A 506 -7.602 1.253 3.394 1.00 0.00 C ATOM 932 C PHE A 506 -6.352 1.980 3.882 1.00 0.00 C ATOM 933 O PHE A 506 -6.436 2.928 4.662 1.00 0.00 O ATOM 934 CB PHE A 506 -8.159 1.951 2.152 1.00 0.00 C ATOM 935 CG PHE A 506 -7.940 3.437 2.149 1.00 0.00 C ATOM 936 CD1 PHE A 506 -6.683 3.964 1.902 1.00 0.00 C ATOM 937 CD2 PHE A 506 -8.991 4.306 2.395 1.00 0.00 C ATOM 938 CE1 PHE A 506 -6.479 5.331 1.900 1.00 0.00 C ATOM 939 CE2 PHE A 506 -8.793 5.674 2.394 1.00 0.00 C ATOM 940 CZ PHE A 506 -7.535 6.187 2.145 1.00 0.00 C ATOM 0 H PHE A 506 -8.609 2.001 5.073 1.00 0.00 H new ATOM 0 HA PHE A 506 -7.329 0.230 3.135 1.00 0.00 H new ATOM 0 HB2 PHE A 506 -7.694 1.522 1.265 1.00 0.00 H new ATOM 0 HB3 PHE A 506 -9.228 1.749 2.081 1.00 0.00 H new ATOM 0 HD1 PHE A 506 -5.854 3.300 1.709 1.00 0.00 H new ATOM 0 HD2 PHE A 506 -9.977 3.910 2.590 1.00 0.00 H new ATOM 0 HE1 PHE A 506 -5.494 5.730 1.707 1.00 0.00 H new ATOM 0 HE2 PHE A 506 -9.620 6.341 2.588 1.00 0.00 H new ATOM 0 HZ PHE A 506 -7.377 7.255 2.142 1.00 0.00 H new ATOM 950 N GLY A 507 -5.192 1.528 3.416 1.00 0.00 N ATOM 951 CA GLY A 507 -3.941 2.146 3.815 1.00 0.00 C ATOM 952 C GLY A 507 -2.885 2.073 2.729 1.00 0.00 C ATOM 953 O GLY A 507 -2.778 1.069 2.024 1.00 0.00 O ATOM 0 H GLY A 507 -5.096 0.745 2.769 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -4.121 3.190 4.073 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -3.568 1.656 4.714 1.00 0.00 H new ATOM 957 N PHE A 508 -2.105 3.140 2.592 1.00 0.00 N ATOM 958 CA PHE A 508 -1.055 3.194 1.582 1.00 0.00 C ATOM 959 C PHE A 508 0.306 2.873 2.194 1.00 0.00 C ATOM 960 O PHE A 508 0.707 3.473 3.191 1.00 0.00 O ATOM 961 CB PHE A 508 -1.019 4.576 0.927 1.00 0.00 C ATOM 962 CG PHE A 508 -1.993 4.728 -0.206 1.00 0.00 C ATOM 963 CD1 PHE A 508 -1.832 4.006 -1.378 1.00 0.00 C ATOM 964 CD2 PHE A 508 -3.070 5.593 -0.099 1.00 0.00 C ATOM 965 CE1 PHE A 508 -2.727 4.144 -2.422 1.00 0.00 C ATOM 966 CE2 PHE A 508 -3.969 5.734 -1.140 1.00 0.00 C ATOM 967 CZ PHE A 508 -3.797 5.009 -2.303 1.00 0.00 C ATOM 0 H PHE A 508 -2.180 3.979 3.168 1.00 0.00 H new ATOM 0 HA PHE A 508 -1.278 2.445 0.822 1.00 0.00 H new ATOM 0 HB2 PHE A 508 -1.231 5.333 1.682 1.00 0.00 H new ATOM 0 HB3 PHE A 508 -0.012 4.768 0.558 1.00 0.00 H new ATOM 0 HD1 PHE A 508 -0.997 3.328 -1.477 1.00 0.00 H new ATOM 0 HD2 PHE A 508 -3.209 6.163 0.808 1.00 0.00 H new ATOM 0 HE1 PHE A 508 -2.590 3.576 -3.330 1.00 0.00 H new ATOM 0 HE2 PHE A 508 -4.805 6.411 -1.044 1.00 0.00 H new ATOM 0 HZ PHE A 508 -4.498 5.118 -3.118 1.00 0.00 H new ATOM 977 N VAL A 509 1.010 1.921 1.590 1.00 0.00 N ATOM 978 CA VAL A 509 2.326 1.520 2.075 1.00 0.00 C ATOM 979 C VAL A 509 3.359 1.558 0.954 1.00 0.00 C ATOM 980 O VAL A 509 3.261 0.813 -0.021 1.00 0.00 O ATOM 981 CB VAL A 509 2.293 0.104 2.680 1.00 0.00 C ATOM 982 CG1 VAL A 509 3.668 -0.285 3.202 1.00 0.00 C ATOM 983 CG2 VAL A 509 1.251 0.022 3.785 1.00 0.00 C ATOM 0 H VAL A 509 0.692 1.413 0.765 1.00 0.00 H new ATOM 0 HA VAL A 509 2.609 2.232 2.850 1.00 0.00 H new ATOM 0 HB VAL A 509 2.015 -0.601 1.897 1.00 0.00 H new ATOM 0 HG11 VAL A 509 3.626 -1.288 3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 509 4.387 -0.267 2.383 1.00 0.00 H new ATOM 0 HG13 VAL A 509 3.978 0.421 3.972 1.00 0.00 H new ATOM 0 HG21 VAL A 509 1.241 -0.985 4.202 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.496 0.737 4.570 1.00 0.00 H new ATOM 0 HG23 VAL A 509 0.268 0.255 3.376 1.00 0.00 H new ATOM 993 N ASP A 510 4.350 2.431 1.100 1.00 0.00 N ATOM 994 CA ASP A 510 5.404 2.566 0.101 1.00 0.00 C ATOM 995 C ASP A 510 6.706 1.946 0.598 1.00 0.00 C ATOM 996 O ASP A 510 6.982 1.933 1.798 1.00 0.00 O ATOM 997 CB ASP A 510 5.625 4.040 -0.242 1.00 0.00 C ATOM 998 CG ASP A 510 6.337 4.225 -1.568 1.00 0.00 C ATOM 999 OD1 ASP A 510 7.082 3.308 -1.974 1.00 0.00 O ATOM 1000 OD2 ASP A 510 6.149 5.285 -2.199 1.00 0.00 O ATOM 0 H ASP A 510 4.445 3.056 1.901 1.00 0.00 H new ATOM 0 HA ASP A 510 5.089 2.035 -0.797 1.00 0.00 H new ATOM 0 HB2 ASP A 510 4.663 4.551 -0.275 1.00 0.00 H new ATOM 0 HB3 ASP A 510 6.208 4.511 0.549 1.00 0.00 H new ATOM 1005 N PHE A 511 7.503 1.431 -0.333 1.00 0.00 N ATOM 1006 CA PHE A 511 8.775 0.807 0.010 1.00 0.00 C ATOM 1007 C PHE A 511 9.940 1.560 -0.626 1.00 0.00 C ATOM 1008 O PHE A 511 9.762 2.287 -1.604 1.00 0.00 O ATOM 1009 CB PHE A 511 8.790 -0.654 -0.443 1.00 0.00 C ATOM 1010 CG PHE A 511 8.279 -1.610 0.597 1.00 0.00 C ATOM 1011 CD1 PHE A 511 6.967 -1.538 1.038 1.00 0.00 C ATOM 1012 CD2 PHE A 511 9.110 -2.580 1.134 1.00 0.00 C ATOM 1013 CE1 PHE A 511 6.495 -2.416 1.996 1.00 0.00 C ATOM 1014 CE2 PHE A 511 8.643 -3.460 2.092 1.00 0.00 C ATOM 1015 CZ PHE A 511 7.334 -3.378 2.523 1.00 0.00 C ATOM 0 H PHE A 511 7.290 1.434 -1.331 1.00 0.00 H new ATOM 0 HA PHE A 511 8.889 0.845 1.093 1.00 0.00 H new ATOM 0 HB2 PHE A 511 8.185 -0.753 -1.344 1.00 0.00 H new ATOM 0 HB3 PHE A 511 9.809 -0.932 -0.711 1.00 0.00 H new ATOM 0 HD1 PHE A 511 6.306 -0.788 0.629 1.00 0.00 H new ATOM 0 HD2 PHE A 511 10.135 -2.649 0.800 1.00 0.00 H new ATOM 0 HE1 PHE A 511 5.471 -2.350 2.332 1.00 0.00 H new ATOM 0 HE2 PHE A 511 9.301 -4.211 2.503 1.00 0.00 H new ATOM 0 HZ PHE A 511 6.967 -4.065 3.271 1.00 0.00 H new ATOM 1025 N ILE A 512 11.130 1.381 -0.065 1.00 0.00 N ATOM 1026 CA ILE A 512 12.324 2.042 -0.577 1.00 0.00 C ATOM 1027 C ILE A 512 12.722 1.481 -1.938 1.00 0.00 C ATOM 1028 O ILE A 512 13.092 2.227 -2.846 1.00 0.00 O ATOM 1029 CB ILE A 512 13.510 1.895 0.394 1.00 0.00 C ATOM 1030 CG1 ILE A 512 13.134 2.428 1.778 1.00 0.00 C ATOM 1031 CG2 ILE A 512 14.731 2.623 -0.147 1.00 0.00 C ATOM 1032 CD1 ILE A 512 12.786 3.900 1.784 1.00 0.00 C ATOM 0 H ILE A 512 11.294 0.783 0.745 1.00 0.00 H new ATOM 0 HA ILE A 512 12.079 3.099 -0.680 1.00 0.00 H new ATOM 0 HB ILE A 512 13.755 0.837 0.488 1.00 0.00 H new ATOM 0 HG12 ILE A 512 12.285 1.861 2.159 1.00 0.00 H new ATOM 0 HG13 ILE A 512 13.965 2.256 2.463 1.00 0.00 H new ATOM 0 HG21 ILE A 512 15.561 2.510 0.551 1.00 0.00 H new ATOM 0 HG22 ILE A 512 15.008 2.200 -1.113 1.00 0.00 H new ATOM 0 HG23 ILE A 512 14.500 3.681 -0.267 1.00 0.00 H new ATOM 0 HD11 ILE A 512 12.530 4.209 2.797 1.00 0.00 H new ATOM 0 HD12 ILE A 512 13.641 4.478 1.434 1.00 0.00 H new ATOM 0 HD13 ILE A 512 11.936 4.076 1.125 1.00 0.00 H new ATOM 1044 N THR A 513 12.642 0.161 -2.074 1.00 0.00 N ATOM 1045 CA THR A 513 12.993 -0.501 -3.324 1.00 0.00 C ATOM 1046 C THR A 513 11.801 -1.255 -3.900 1.00 0.00 C ATOM 1047 O THR A 513 10.726 -1.291 -3.300 1.00 0.00 O ATOM 1048 CB THR A 513 14.163 -1.484 -3.130 1.00 0.00 C ATOM 1049 OG1 THR A 513 13.773 -2.541 -2.246 1.00 0.00 O ATOM 1050 CG2 THR A 513 15.382 -0.770 -2.566 1.00 0.00 C ATOM 0 H THR A 513 12.337 -0.471 -1.333 1.00 0.00 H new ATOM 0 HA THR A 513 13.296 0.280 -4.021 1.00 0.00 H new ATOM 0 HB THR A 513 14.423 -1.901 -4.103 1.00 0.00 H new ATOM 0 HG1 THR A 513 14.394 -3.293 -2.342 1.00 0.00 H new ATOM 0 HG21 THR A 513 16.195 -1.484 -2.438 1.00 0.00 H new ATOM 0 HG22 THR A 513 15.694 0.015 -3.254 1.00 0.00 H new ATOM 0 HG23 THR A 513 15.131 -0.329 -1.601 1.00 0.00 H new ATOM 1058 N LYS A 514 11.996 -1.859 -5.068 1.00 0.00 N ATOM 1059 CA LYS A 514 10.937 -2.615 -5.726 1.00 0.00 C ATOM 1060 C LYS A 514 10.922 -4.062 -5.243 1.00 0.00 C ATOM 1061 O LYS A 514 9.901 -4.554 -4.763 1.00 0.00 O ATOM 1062 CB LYS A 514 11.122 -2.575 -7.245 1.00 0.00 C ATOM 1063 CG LYS A 514 10.193 -3.514 -7.995 1.00 0.00 C ATOM 1064 CD LYS A 514 10.219 -3.245 -9.490 1.00 0.00 C ATOM 1065 CE LYS A 514 11.347 -4.003 -10.174 1.00 0.00 C ATOM 1066 NZ LYS A 514 11.842 -3.289 -11.382 1.00 0.00 N ATOM 0 H LYS A 514 12.879 -1.839 -5.579 1.00 0.00 H new ATOM 0 HA LYS A 514 9.983 -2.155 -5.470 1.00 0.00 H new ATOM 0 HB2 LYS A 514 10.957 -1.556 -7.596 1.00 0.00 H new ATOM 0 HB3 LYS A 514 12.154 -2.831 -7.484 1.00 0.00 H new ATOM 0 HG2 LYS A 514 10.486 -4.546 -7.805 1.00 0.00 H new ATOM 0 HG3 LYS A 514 9.176 -3.397 -7.621 1.00 0.00 H new ATOM 0 HD2 LYS A 514 9.265 -3.536 -9.930 1.00 0.00 H new ATOM 0 HD3 LYS A 514 10.338 -2.176 -9.666 1.00 0.00 H new ATOM 0 HE2 LYS A 514 12.169 -4.142 -9.472 1.00 0.00 H new ATOM 0 HE3 LYS A 514 10.998 -4.996 -10.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 514 12.610 -3.838 -11.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 514 11.064 -3.179 -12.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 514 12.199 -2.351 -11.109 1.00 0.00 H new ATOM 1080 N GLN A 515 12.060 -4.736 -5.372 1.00 0.00 N ATOM 1081 CA GLN A 515 12.175 -6.127 -4.948 1.00 0.00 C ATOM 1082 C GLN A 515 11.515 -6.338 -3.590 1.00 0.00 C ATOM 1083 O GLN A 515 10.755 -7.288 -3.399 1.00 0.00 O ATOM 1084 CB GLN A 515 13.646 -6.541 -4.884 1.00 0.00 C ATOM 1085 CG GLN A 515 14.298 -6.686 -6.249 1.00 0.00 C ATOM 1086 CD GLN A 515 15.759 -7.081 -6.160 1.00 0.00 C ATOM 1087 OE1 GLN A 515 16.103 -8.096 -5.552 1.00 0.00 O ATOM 1088 NE2 GLN A 515 16.627 -6.281 -6.766 1.00 0.00 N ATOM 0 H GLN A 515 12.915 -4.343 -5.766 1.00 0.00 H new ATOM 0 HA GLN A 515 11.661 -6.749 -5.681 1.00 0.00 H new ATOM 0 HB2 GLN A 515 14.198 -5.801 -4.304 1.00 0.00 H new ATOM 0 HB3 GLN A 515 13.725 -7.488 -4.351 1.00 0.00 H new ATOM 0 HG2 GLN A 515 13.758 -7.435 -6.827 1.00 0.00 H new ATOM 0 HG3 GLN A 515 14.213 -5.743 -6.790 1.00 0.00 H new ATOM 0 HE21 GLN A 515 16.298 -5.451 -7.258 1.00 0.00 H new ATOM 0 HE22 GLN A 515 17.624 -6.497 -6.740 1.00 0.00 H new ATOM 1097 N ASP A 516 11.810 -5.447 -2.649 1.00 0.00 N ATOM 1098 CA ASP A 516 11.244 -5.536 -1.308 1.00 0.00 C ATOM 1099 C ASP A 516 9.727 -5.385 -1.347 1.00 0.00 C ATOM 1100 O ASP A 516 9.005 -6.091 -0.644 1.00 0.00 O ATOM 1101 CB ASP A 516 11.853 -4.463 -0.403 1.00 0.00 C ATOM 1102 CG ASP A 516 13.348 -4.636 -0.225 1.00 0.00 C ATOM 1103 OD1 ASP A 516 14.050 -4.817 -1.241 1.00 0.00 O ATOM 1104 OD2 ASP A 516 13.817 -4.591 0.932 1.00 0.00 O ATOM 0 H ASP A 516 12.438 -4.655 -2.790 1.00 0.00 H new ATOM 0 HA ASP A 516 11.482 -6.520 -0.904 1.00 0.00 H new ATOM 0 HB2 ASP A 516 11.652 -3.479 -0.826 1.00 0.00 H new ATOM 0 HB3 ASP A 516 11.368 -4.496 0.572 1.00 0.00 H new ATOM 1109 N ALA A 517 9.250 -4.459 -2.173 1.00 0.00 N ATOM 1110 CA ALA A 517 7.819 -4.217 -2.305 1.00 0.00 C ATOM 1111 C ALA A 517 7.092 -5.468 -2.786 1.00 0.00 C ATOM 1112 O ALA A 517 5.946 -5.716 -2.410 1.00 0.00 O ATOM 1113 CB ALA A 517 7.566 -3.058 -3.257 1.00 0.00 C ATOM 0 H ALA A 517 9.834 -3.864 -2.761 1.00 0.00 H new ATOM 0 HA ALA A 517 7.427 -3.957 -1.321 1.00 0.00 H new ATOM 0 HB1 ALA A 517 6.493 -2.888 -3.346 1.00 0.00 H new ATOM 0 HB2 ALA A 517 8.045 -2.158 -2.870 1.00 0.00 H new ATOM 0 HB3 ALA A 517 7.979 -3.296 -4.237 1.00 0.00 H new ATOM 1119 N LYS A 518 7.765 -6.253 -3.620 1.00 0.00 N ATOM 1120 CA LYS A 518 7.184 -7.480 -4.153 1.00 0.00 C ATOM 1121 C LYS A 518 7.178 -8.582 -3.098 1.00 0.00 C ATOM 1122 O LYS A 518 6.119 -9.012 -2.640 1.00 0.00 O ATOM 1123 CB LYS A 518 7.962 -7.943 -5.386 1.00 0.00 C ATOM 1124 CG LYS A 518 7.801 -7.027 -6.587 1.00 0.00 C ATOM 1125 CD LYS A 518 8.308 -7.683 -7.860 1.00 0.00 C ATOM 1126 CE LYS A 518 7.665 -7.071 -9.096 1.00 0.00 C ATOM 1127 NZ LYS A 518 6.207 -7.365 -9.166 1.00 0.00 N ATOM 0 H LYS A 518 8.714 -6.062 -3.942 1.00 0.00 H new ATOM 0 HA LYS A 518 6.153 -7.270 -4.439 1.00 0.00 H new ATOM 0 HB2 LYS A 518 9.020 -8.013 -5.132 1.00 0.00 H new ATOM 0 HB3 LYS A 518 7.632 -8.946 -5.658 1.00 0.00 H new ATOM 0 HG2 LYS A 518 6.750 -6.763 -6.706 1.00 0.00 H new ATOM 0 HG3 LYS A 518 8.345 -6.099 -6.413 1.00 0.00 H new ATOM 0 HD2 LYS A 518 9.391 -7.575 -7.920 1.00 0.00 H new ATOM 0 HD3 LYS A 518 8.096 -8.752 -7.829 1.00 0.00 H new ATOM 0 HE2 LYS A 518 7.818 -5.992 -9.088 1.00 0.00 H new ATOM 0 HE3 LYS A 518 8.156 -7.456 -9.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 518 5.892 -7.324 -10.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 518 6.026 -8.315 -8.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 518 5.684 -6.661 -8.607 1.00 0.00 H new ATOM 1141 N LYS A 519 8.367 -9.036 -2.717 1.00 0.00 N ATOM 1142 CA LYS A 519 8.501 -10.086 -1.714 1.00 0.00 C ATOM 1143 C LYS A 519 7.495 -9.890 -0.584 1.00 0.00 C ATOM 1144 O LYS A 519 6.897 -10.851 -0.100 1.00 0.00 O ATOM 1145 CB LYS A 519 9.922 -10.102 -1.148 1.00 0.00 C ATOM 1146 CG LYS A 519 10.222 -8.935 -0.223 1.00 0.00 C ATOM 1147 CD LYS A 519 11.637 -9.007 0.325 1.00 0.00 C ATOM 1148 CE LYS A 519 11.710 -9.884 1.566 1.00 0.00 C ATOM 1149 NZ LYS A 519 13.101 -10.338 1.843 1.00 0.00 N ATOM 0 H LYS A 519 9.253 -8.693 -3.088 1.00 0.00 H new ATOM 0 HA LYS A 519 8.298 -11.042 -2.196 1.00 0.00 H new ATOM 0 HB2 LYS A 519 10.077 -11.034 -0.605 1.00 0.00 H new ATOM 0 HB3 LYS A 519 10.633 -10.092 -1.974 1.00 0.00 H new ATOM 0 HG2 LYS A 519 10.087 -7.998 -0.763 1.00 0.00 H new ATOM 0 HG3 LYS A 519 9.511 -8.932 0.603 1.00 0.00 H new ATOM 0 HD2 LYS A 519 12.305 -9.402 -0.440 1.00 0.00 H new ATOM 0 HD3 LYS A 519 11.986 -8.003 0.566 1.00 0.00 H new ATOM 0 HE2 LYS A 519 11.331 -9.330 2.425 1.00 0.00 H new ATOM 0 HE3 LYS A 519 11.064 -10.752 1.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 13.109 -10.933 2.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 13.454 -10.888 1.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 13.713 -9.511 1.993 1.00 0.00 H new ATOM 1163 N ALA A 520 7.312 -8.640 -0.171 1.00 0.00 N ATOM 1164 CA ALA A 520 6.376 -8.319 0.899 1.00 0.00 C ATOM 1165 C ALA A 520 4.933 -8.477 0.432 1.00 0.00 C ATOM 1166 O ALA A 520 4.178 -9.284 0.976 1.00 0.00 O ATOM 1167 CB ALA A 520 6.617 -6.904 1.405 1.00 0.00 C ATOM 0 H ALA A 520 7.800 -7.834 -0.561 1.00 0.00 H new ATOM 0 HA ALA A 520 6.544 -9.019 1.717 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.911 -6.678 2.204 1.00 0.00 H new ATOM 0 HB2 ALA A 520 7.635 -6.822 1.787 1.00 0.00 H new ATOM 0 HB3 ALA A 520 6.478 -6.197 0.587 1.00 0.00 H new ATOM 1173 N PHE A 521 4.554 -7.702 -0.578 1.00 0.00 N ATOM 1174 CA PHE A 521 3.201 -7.755 -1.118 1.00 0.00 C ATOM 1175 C PHE A 521 2.703 -9.195 -1.199 1.00 0.00 C ATOM 1176 O PHE A 521 1.618 -9.516 -0.717 1.00 0.00 O ATOM 1177 CB PHE A 521 3.156 -7.109 -2.504 1.00 0.00 C ATOM 1178 CG PHE A 521 1.788 -7.117 -3.125 1.00 0.00 C ATOM 1179 CD1 PHE A 521 0.893 -6.089 -2.877 1.00 0.00 C ATOM 1180 CD2 PHE A 521 1.397 -8.154 -3.958 1.00 0.00 C ATOM 1181 CE1 PHE A 521 -0.366 -6.094 -3.447 1.00 0.00 C ATOM 1182 CE2 PHE A 521 0.140 -8.164 -4.531 1.00 0.00 C ATOM 1183 CZ PHE A 521 -0.743 -7.133 -4.274 1.00 0.00 C ATOM 0 H PHE A 521 5.166 -7.029 -1.040 1.00 0.00 H new ATOM 0 HA PHE A 521 2.547 -7.201 -0.445 1.00 0.00 H new ATOM 0 HB2 PHE A 521 3.506 -6.079 -2.428 1.00 0.00 H new ATOM 0 HB3 PHE A 521 3.848 -7.633 -3.163 1.00 0.00 H new ATOM 0 HD1 PHE A 521 1.183 -5.274 -2.230 1.00 0.00 H new ATOM 0 HD2 PHE A 521 2.083 -8.963 -4.161 1.00 0.00 H new ATOM 0 HE1 PHE A 521 -1.054 -5.286 -3.246 1.00 0.00 H new ATOM 0 HE2 PHE A 521 -0.152 -8.977 -5.179 1.00 0.00 H new ATOM 0 HZ PHE A 521 -1.727 -7.140 -4.719 1.00 0.00 H new ATOM 1193 N ASN A 522 3.506 -10.058 -1.812 1.00 0.00 N ATOM 1194 CA ASN A 522 3.148 -11.464 -1.958 1.00 0.00 C ATOM 1195 C ASN A 522 3.144 -12.168 -0.604 1.00 0.00 C ATOM 1196 O ASN A 522 2.222 -12.917 -0.285 1.00 0.00 O ATOM 1197 CB ASN A 522 4.123 -12.165 -2.907 1.00 0.00 C ATOM 1198 CG ASN A 522 3.566 -13.467 -3.450 1.00 0.00 C ATOM 1199 OD1 ASN A 522 2.353 -13.628 -3.584 1.00 0.00 O ATOM 1200 ND2 ASN A 522 4.453 -14.404 -3.765 1.00 0.00 N ATOM 0 H ASN A 522 4.409 -9.809 -2.216 1.00 0.00 H new ATOM 0 HA ASN A 522 2.143 -11.515 -2.377 1.00 0.00 H new ATOM 0 HB2 ASN A 522 4.359 -11.500 -3.737 1.00 0.00 H new ATOM 0 HB3 ASN A 522 5.057 -12.364 -2.382 1.00 0.00 H new ATOM 0 HD21 ASN A 522 4.138 -15.301 -4.135 1.00 0.00 H new ATOM 0 HD22 ASN A 522 5.449 -14.227 -3.637 1.00 0.00 H new ATOM 1207 N ALA A 523 4.183 -11.921 0.188 1.00 0.00 N ATOM 1208 CA ALA A 523 4.298 -12.528 1.508 1.00 0.00 C ATOM 1209 C ALA A 523 2.987 -12.419 2.279 1.00 0.00 C ATOM 1210 O ALA A 523 2.478 -13.412 2.801 1.00 0.00 O ATOM 1211 CB ALA A 523 5.429 -11.877 2.291 1.00 0.00 C ATOM 0 H ALA A 523 4.957 -11.305 -0.062 1.00 0.00 H new ATOM 0 HA ALA A 523 4.524 -13.586 1.376 1.00 0.00 H new ATOM 0 HB1 ALA A 523 5.504 -12.340 3.275 1.00 0.00 H new ATOM 0 HB2 ALA A 523 6.368 -12.012 1.754 1.00 0.00 H new ATOM 0 HB3 ALA A 523 5.226 -10.812 2.405 1.00 0.00 H new ATOM 1217 N LEU A 524 2.446 -11.208 2.348 1.00 0.00 N ATOM 1218 CA LEU A 524 1.193 -10.969 3.056 1.00 0.00 C ATOM 1219 C LEU A 524 -0.003 -11.372 2.199 1.00 0.00 C ATOM 1220 O LEU A 524 -0.849 -12.158 2.627 1.00 0.00 O ATOM 1221 CB LEU A 524 1.080 -9.495 3.449 1.00 0.00 C ATOM 1222 CG LEU A 524 1.850 -9.073 4.701 1.00 0.00 C ATOM 1223 CD1 LEU A 524 3.345 -9.262 4.496 1.00 0.00 C ATOM 1224 CD2 LEU A 524 1.537 -7.628 5.058 1.00 0.00 C ATOM 0 H LEU A 524 2.855 -10.376 1.922 1.00 0.00 H new ATOM 0 HA LEU A 524 1.192 -11.581 3.958 1.00 0.00 H new ATOM 0 HB2 LEU A 524 1.427 -8.889 2.612 1.00 0.00 H new ATOM 0 HB3 LEU A 524 0.026 -9.259 3.598 1.00 0.00 H new ATOM 0 HG LEU A 524 1.534 -9.707 5.530 1.00 0.00 H new ATOM 0 HD11 LEU A 524 3.877 -8.957 5.397 1.00 0.00 H new ATOM 0 HD12 LEU A 524 3.554 -10.312 4.289 1.00 0.00 H new ATOM 0 HD13 LEU A 524 3.677 -8.653 3.655 1.00 0.00 H new ATOM 0 HD21 LEU A 524 2.094 -7.345 5.951 1.00 0.00 H new ATOM 0 HD22 LEU A 524 1.824 -6.979 4.231 1.00 0.00 H new ATOM 0 HD23 LEU A 524 0.469 -7.523 5.248 1.00 0.00 H new ATOM 1236 N CYS A 525 -0.065 -10.831 0.988 1.00 0.00 N ATOM 1237 CA CYS A 525 -1.156 -11.135 0.069 1.00 0.00 C ATOM 1238 C CYS A 525 -1.589 -12.591 0.202 1.00 0.00 C ATOM 1239 O CYS A 525 -2.759 -12.882 0.452 1.00 0.00 O ATOM 1240 CB CYS A 525 -0.734 -10.845 -1.372 1.00 0.00 C ATOM 1241 SG CYS A 525 -1.965 -11.314 -2.611 1.00 0.00 S ATOM 0 H CYS A 525 0.628 -10.179 0.619 1.00 0.00 H new ATOM 0 HA CYS A 525 -2.002 -10.498 0.326 1.00 0.00 H new ATOM 0 HB2 CYS A 525 -0.523 -9.780 -1.470 1.00 0.00 H new ATOM 0 HB3 CYS A 525 0.196 -11.375 -1.581 1.00 0.00 H new ATOM 0 HG CYS A 525 -1.517 -11.028 -3.797 1.00 0.00 H new ATOM 1247 N HIS A 526 -0.638 -13.504 0.032 1.00 0.00 N ATOM 1248 CA HIS A 526 -0.921 -14.931 0.132 1.00 0.00 C ATOM 1249 C HIS A 526 -1.964 -15.204 1.211 1.00 0.00 C ATOM 1250 O HIS A 526 -3.019 -15.777 0.938 1.00 0.00 O ATOM 1251 CB HIS A 526 0.361 -15.706 0.438 1.00 0.00 C ATOM 1252 CG HIS A 526 0.185 -17.193 0.402 1.00 0.00 C ATOM 1253 ND1 HIS A 526 -0.294 -17.868 -0.701 1.00 0.00 N ATOM 1254 CD2 HIS A 526 0.427 -18.137 1.342 1.00 0.00 C ATOM 1255 CE1 HIS A 526 -0.339 -19.162 -0.438 1.00 0.00 C ATOM 1256 NE2 HIS A 526 0.093 -19.351 0.795 1.00 0.00 N ATOM 0 H HIS A 526 0.335 -13.281 -0.176 1.00 0.00 H new ATOM 0 HA HIS A 526 -1.319 -15.265 -0.826 1.00 0.00 H new ATOM 0 HB2 HIS A 526 1.128 -15.422 -0.282 1.00 0.00 H new ATOM 0 HB3 HIS A 526 0.725 -15.415 1.423 1.00 0.00 H new ATOM 0 HD2 HIS A 526 0.811 -17.967 2.337 1.00 0.00 H new ATOM 0 HE1 HIS A 526 -0.672 -19.934 -1.116 1.00 0.00 H new ATOM 0 HE2 HIS A 526 0.167 -20.253 1.265 1.00 0.00 H new ATOM 1264 N SER A 527 -1.663 -14.789 2.437 1.00 0.00 N ATOM 1265 CA SER A 527 -2.572 -14.993 3.558 1.00 0.00 C ATOM 1266 C SER A 527 -2.192 -14.101 4.736 1.00 0.00 C ATOM 1267 O SER A 527 -1.204 -14.352 5.428 1.00 0.00 O ATOM 1268 CB SER A 527 -2.562 -16.460 3.991 1.00 0.00 C ATOM 1269 OG SER A 527 -3.812 -16.839 4.542 1.00 0.00 O ATOM 0 H SER A 527 -0.796 -14.309 2.679 1.00 0.00 H new ATOM 0 HA SER A 527 -3.577 -14.725 3.231 1.00 0.00 H new ATOM 0 HB2 SER A 527 -2.332 -17.093 3.134 1.00 0.00 H new ATOM 0 HB3 SER A 527 -1.774 -16.620 4.727 1.00 0.00 H new ATOM 0 HG SER A 527 -3.787 -16.729 5.515 1.00 0.00 H new ATOM 1275 N THR A 528 -2.983 -13.056 4.959 1.00 0.00 N ATOM 1276 CA THR A 528 -2.730 -12.125 6.051 1.00 0.00 C ATOM 1277 C THR A 528 -3.960 -11.970 6.938 1.00 0.00 C ATOM 1278 O THR A 528 -4.977 -11.418 6.516 1.00 0.00 O ATOM 1279 CB THR A 528 -2.314 -10.739 5.523 1.00 0.00 C ATOM 1280 OG1 THR A 528 -1.140 -10.856 4.711 1.00 0.00 O ATOM 1281 CG2 THR A 528 -2.048 -9.779 6.673 1.00 0.00 C ATOM 0 H THR A 528 -3.805 -12.833 4.397 1.00 0.00 H new ATOM 0 HA THR A 528 -1.912 -12.542 6.638 1.00 0.00 H new ATOM 0 HB THR A 528 -3.133 -10.343 4.922 1.00 0.00 H new ATOM 0 HG1 THR A 528 -1.200 -11.667 4.165 1.00 0.00 H new ATOM 0 HG21 THR A 528 -1.756 -8.807 6.275 1.00 0.00 H new ATOM 0 HG22 THR A 528 -2.952 -9.669 7.272 1.00 0.00 H new ATOM 0 HG23 THR A 528 -1.245 -10.172 7.297 1.00 0.00 H new ATOM 1289 N HIS A 529 -3.862 -12.460 8.170 1.00 0.00 N ATOM 1290 CA HIS A 529 -4.967 -12.375 9.117 1.00 0.00 C ATOM 1291 C HIS A 529 -4.613 -11.457 10.284 1.00 0.00 C ATOM 1292 O HIS A 529 -3.677 -11.727 11.037 1.00 0.00 O ATOM 1293 CB HIS A 529 -5.329 -13.766 9.639 1.00 0.00 C ATOM 1294 CG HIS A 529 -5.316 -14.824 8.579 1.00 0.00 C ATOM 1295 ND1 HIS A 529 -6.100 -14.765 7.446 1.00 0.00 N ATOM 1296 CD2 HIS A 529 -4.607 -15.973 8.484 1.00 0.00 C ATOM 1297 CE1 HIS A 529 -5.875 -15.832 6.701 1.00 0.00 C ATOM 1298 NE2 HIS A 529 -4.972 -16.582 7.309 1.00 0.00 N ATOM 0 H HIS A 529 -3.028 -12.920 8.535 1.00 0.00 H new ATOM 0 HA HIS A 529 -5.828 -11.956 8.596 1.00 0.00 H new ATOM 0 HB2 HIS A 529 -4.628 -14.043 10.427 1.00 0.00 H new ATOM 0 HB3 HIS A 529 -6.320 -13.729 10.092 1.00 0.00 H new ATOM 0 HD1 HIS A 529 -6.752 -14.014 7.219 1.00 0.00 H new ATOM 0 HD2 HIS A 529 -3.888 -16.342 9.200 1.00 0.00 H new ATOM 0 HE1 HIS A 529 -6.348 -16.054 5.756 1.00 0.00 H new ATOM 1306 N LEU A 530 -5.367 -10.373 10.427 1.00 0.00 N ATOM 1307 CA LEU A 530 -5.133 -9.414 11.502 1.00 0.00 C ATOM 1308 C LEU A 530 -6.390 -9.220 12.342 1.00 0.00 C ATOM 1309 O LEU A 530 -7.476 -8.986 11.809 1.00 0.00 O ATOM 1310 CB LEU A 530 -4.679 -8.072 10.925 1.00 0.00 C ATOM 1311 CG LEU A 530 -4.015 -7.109 11.909 1.00 0.00 C ATOM 1312 CD1 LEU A 530 -2.572 -7.516 12.165 1.00 0.00 C ATOM 1313 CD2 LEU A 530 -4.084 -5.681 11.386 1.00 0.00 C ATOM 0 H LEU A 530 -6.146 -10.136 9.812 1.00 0.00 H new ATOM 0 HA LEU A 530 -4.347 -9.811 12.145 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -3.981 -8.267 10.111 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -5.546 -7.575 10.489 1.00 0.00 H new ATOM 0 HG LEU A 530 -4.556 -7.156 12.854 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -2.116 -6.818 12.868 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -2.547 -8.522 12.584 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -2.017 -7.500 11.227 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -3.607 -5.009 12.099 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -3.568 -5.619 10.428 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -5.127 -5.391 11.256 1.00 0.00 H new ATOM 1325 N TYR A 531 -6.237 -9.317 13.658 1.00 0.00 N ATOM 1326 CA TYR A 531 -7.360 -9.153 14.573 1.00 0.00 C ATOM 1327 C TYR A 531 -8.588 -9.907 14.070 1.00 0.00 C ATOM 1328 O TYR A 531 -9.718 -9.443 14.214 1.00 0.00 O ATOM 1329 CB TYR A 531 -7.693 -7.670 14.743 1.00 0.00 C ATOM 1330 CG TYR A 531 -6.546 -6.850 15.288 1.00 0.00 C ATOM 1331 CD1 TYR A 531 -6.161 -6.955 16.618 1.00 0.00 C ATOM 1332 CD2 TYR A 531 -5.845 -5.971 14.471 1.00 0.00 C ATOM 1333 CE1 TYR A 531 -5.113 -6.207 17.120 1.00 0.00 C ATOM 1334 CE2 TYR A 531 -4.795 -5.220 14.963 1.00 0.00 C ATOM 1335 CZ TYR A 531 -4.433 -5.341 16.289 1.00 0.00 C ATOM 1336 OH TYR A 531 -3.388 -4.596 16.785 1.00 0.00 O ATOM 0 H TYR A 531 -5.345 -9.509 14.115 1.00 0.00 H new ATOM 0 HA TYR A 531 -7.072 -9.568 15.539 1.00 0.00 H new ATOM 0 HB2 TYR A 531 -7.995 -7.261 13.779 1.00 0.00 H new ATOM 0 HB3 TYR A 531 -8.548 -7.573 15.412 1.00 0.00 H new ATOM 0 HD1 TYR A 531 -6.690 -7.633 17.272 1.00 0.00 H new ATOM 0 HD2 TYR A 531 -6.126 -5.873 13.433 1.00 0.00 H new ATOM 0 HE1 TYR A 531 -4.828 -6.300 18.158 1.00 0.00 H new ATOM 0 HE2 TYR A 531 -4.261 -4.542 14.314 1.00 0.00 H new ATOM 0 HH TYR A 531 -3.016 -4.038 16.070 1.00 0.00 H new ATOM 1346 N GLY A 532 -8.355 -11.074 13.478 1.00 0.00 N ATOM 1347 CA GLY A 532 -9.450 -11.875 12.962 1.00 0.00 C ATOM 1348 C GLY A 532 -10.072 -11.274 11.718 1.00 0.00 C ATOM 1349 O GLY A 532 -11.269 -11.433 11.475 1.00 0.00 O ATOM 0 H GLY A 532 -7.428 -11.479 13.346 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -9.087 -12.877 12.735 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -10.214 -11.979 13.732 1.00 0.00 H new ATOM 1353 N ARG A 533 -9.259 -10.580 10.928 1.00 0.00 N ATOM 1354 CA ARG A 533 -9.738 -9.951 9.703 1.00 0.00 C ATOM 1355 C ARG A 533 -8.779 -10.215 8.545 1.00 0.00 C ATOM 1356 O ARG A 533 -7.561 -10.138 8.705 1.00 0.00 O ATOM 1357 CB ARG A 533 -9.902 -8.444 9.909 1.00 0.00 C ATOM 1358 CG ARG A 533 -11.009 -8.080 10.885 1.00 0.00 C ATOM 1359 CD ARG A 533 -11.589 -6.707 10.583 1.00 0.00 C ATOM 1360 NE ARG A 533 -12.150 -6.075 11.774 1.00 0.00 N ATOM 1361 CZ ARG A 533 -13.333 -6.395 12.287 1.00 0.00 C ATOM 1362 NH1 ARG A 533 -14.075 -7.333 11.716 1.00 0.00 N ATOM 1363 NH2 ARG A 533 -13.775 -5.775 13.373 1.00 0.00 N ATOM 0 H ARG A 533 -8.266 -10.439 11.114 1.00 0.00 H new ATOM 0 HA ARG A 533 -10.707 -10.385 9.456 1.00 0.00 H new ATOM 0 HB2 ARG A 533 -8.960 -8.031 10.270 1.00 0.00 H new ATOM 0 HB3 ARG A 533 -10.108 -7.975 8.947 1.00 0.00 H new ATOM 0 HG2 ARG A 533 -11.799 -8.829 10.836 1.00 0.00 H new ATOM 0 HG3 ARG A 533 -10.618 -8.095 11.902 1.00 0.00 H new ATOM 0 HD2 ARG A 533 -10.810 -6.068 10.167 1.00 0.00 H new ATOM 0 HD3 ARG A 533 -12.365 -6.800 9.823 1.00 0.00 H new ATOM 0 HE ARG A 533 -11.604 -5.349 12.237 1.00 0.00 H new ATOM 0 HH11 ARG A 533 -13.738 -7.811 10.880 1.00 0.00 H new ATOM 0 HH12 ARG A 533 -14.983 -7.577 12.112 1.00 0.00 H new ATOM 0 HH21 ARG A 533 -13.207 -5.052 13.815 1.00 0.00 H new ATOM 0 HH22 ARG A 533 -14.683 -6.021 13.767 1.00 0.00 H new ATOM 1377 N ARG A 534 -9.338 -10.526 7.380 1.00 0.00 N ATOM 1378 CA ARG A 534 -8.533 -10.804 6.197 1.00 0.00 C ATOM 1379 C ARG A 534 -8.251 -9.522 5.419 1.00 0.00 C ATOM 1380 O ARG A 534 -9.151 -8.941 4.810 1.00 0.00 O ATOM 1381 CB ARG A 534 -9.245 -11.814 5.295 1.00 0.00 C ATOM 1382 CG ARG A 534 -8.473 -12.151 4.030 1.00 0.00 C ATOM 1383 CD ARG A 534 -7.364 -13.154 4.305 1.00 0.00 C ATOM 1384 NE ARG A 534 -7.879 -14.512 4.454 1.00 0.00 N ATOM 1385 CZ ARG A 534 -8.204 -15.292 3.428 1.00 0.00 C ATOM 1386 NH1 ARG A 534 -8.067 -14.849 2.186 1.00 0.00 N ATOM 1387 NH2 ARG A 534 -8.666 -16.517 3.645 1.00 0.00 N ATOM 0 H ARG A 534 -10.345 -10.592 7.230 1.00 0.00 H new ATOM 0 HA ARG A 534 -7.583 -11.227 6.525 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -9.421 -12.731 5.858 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -10.222 -11.417 5.019 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -9.155 -12.557 3.283 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -8.046 -11.241 3.610 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -6.641 -13.128 3.490 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -6.832 -12.867 5.212 1.00 0.00 H new ATOM 0 HE ARG A 534 -7.996 -14.882 5.397 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -7.712 -13.908 2.016 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -8.317 -15.449 1.400 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -8.772 -16.860 4.600 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -8.915 -17.115 2.857 1.00 0.00 H new ATOM 1401 N LEU A 535 -6.997 -9.085 5.443 1.00 0.00 N ATOM 1402 CA LEU A 535 -6.595 -7.871 4.740 1.00 0.00 C ATOM 1403 C LEU A 535 -6.455 -8.130 3.244 1.00 0.00 C ATOM 1404 O LEU A 535 -5.971 -9.182 2.827 1.00 0.00 O ATOM 1405 CB LEU A 535 -5.274 -7.345 5.305 1.00 0.00 C ATOM 1406 CG LEU A 535 -5.310 -6.856 6.753 1.00 0.00 C ATOM 1407 CD1 LEU A 535 -3.904 -6.782 7.326 1.00 0.00 C ATOM 1408 CD2 LEU A 535 -5.997 -5.501 6.841 1.00 0.00 C ATOM 0 H LEU A 535 -6.240 -9.553 5.942 1.00 0.00 H new ATOM 0 HA LEU A 535 -7.371 -7.120 4.889 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -4.529 -8.137 5.228 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -4.933 -6.524 4.674 1.00 0.00 H new ATOM 0 HG LEU A 535 -5.883 -7.570 7.344 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -3.949 -6.432 8.357 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -3.447 -7.771 7.298 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -3.306 -6.089 6.734 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -6.014 -5.168 7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -5.451 -4.777 6.236 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -7.019 -5.586 6.471 1.00 0.00 H new ATOM 1420 N VAL A 536 -6.881 -7.161 2.439 1.00 0.00 N ATOM 1421 CA VAL A 536 -6.800 -7.282 0.988 1.00 0.00 C ATOM 1422 C VAL A 536 -5.674 -6.420 0.427 1.00 0.00 C ATOM 1423 O VAL A 536 -5.707 -5.193 0.530 1.00 0.00 O ATOM 1424 CB VAL A 536 -8.125 -6.877 0.316 1.00 0.00 C ATOM 1425 CG1 VAL A 536 -7.999 -6.942 -1.198 1.00 0.00 C ATOM 1426 CG2 VAL A 536 -9.261 -7.763 0.804 1.00 0.00 C ATOM 0 H VAL A 536 -7.285 -6.284 2.767 1.00 0.00 H new ATOM 0 HA VAL A 536 -6.596 -8.330 0.769 1.00 0.00 H new ATOM 0 HB VAL A 536 -8.353 -5.847 0.592 1.00 0.00 H new ATOM 0 HG11 VAL A 536 -8.945 -6.652 -1.655 1.00 0.00 H new ATOM 0 HG12 VAL A 536 -7.214 -6.261 -1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 536 -7.747 -7.959 -1.499 1.00 0.00 H new ATOM 0 HG21 VAL A 536 -10.190 -7.463 0.319 1.00 0.00 H new ATOM 0 HG22 VAL A 536 -9.043 -8.802 0.559 1.00 0.00 H new ATOM 0 HG23 VAL A 536 -9.365 -7.659 1.884 1.00 0.00 H new ATOM 1436 N LEU A 537 -4.679 -7.070 -0.167 1.00 0.00 N ATOM 1437 CA LEU A 537 -3.542 -6.363 -0.747 1.00 0.00 C ATOM 1438 C LEU A 537 -3.698 -6.228 -2.258 1.00 0.00 C ATOM 1439 O LEU A 537 -4.014 -7.196 -2.948 1.00 0.00 O ATOM 1440 CB LEU A 537 -2.240 -7.096 -0.420 1.00 0.00 C ATOM 1441 CG LEU A 537 -1.618 -6.785 0.942 1.00 0.00 C ATOM 1442 CD1 LEU A 537 -2.228 -7.666 2.021 1.00 0.00 C ATOM 1443 CD2 LEU A 537 -0.108 -6.967 0.892 1.00 0.00 C ATOM 0 H LEU A 537 -4.636 -8.085 -0.260 1.00 0.00 H new ATOM 0 HA LEU A 537 -3.507 -5.363 -0.314 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -2.427 -8.168 -0.475 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -1.509 -6.859 -1.193 1.00 0.00 H new ATOM 0 HG LEU A 537 -1.831 -5.745 1.189 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -1.773 -7.431 2.983 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -3.302 -7.486 2.074 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -2.047 -8.714 1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 537 0.318 -6.742 1.870 1.00 0.00 H new ATOM 0 HD22 LEU A 537 0.126 -7.997 0.623 1.00 0.00 H new ATOM 0 HD23 LEU A 537 0.315 -6.293 0.147 1.00 0.00 H new ATOM 1455 N GLU A 538 -3.471 -5.020 -2.766 1.00 0.00 N ATOM 1456 CA GLU A 538 -3.584 -4.759 -4.196 1.00 0.00 C ATOM 1457 C GLU A 538 -2.518 -3.770 -4.655 1.00 0.00 C ATOM 1458 O GLU A 538 -1.855 -3.132 -3.837 1.00 0.00 O ATOM 1459 CB GLU A 538 -4.976 -4.217 -4.529 1.00 0.00 C ATOM 1460 CG GLU A 538 -6.100 -4.937 -3.802 1.00 0.00 C ATOM 1461 CD GLU A 538 -6.430 -4.303 -2.465 1.00 0.00 C ATOM 1462 OE1 GLU A 538 -5.497 -4.100 -1.659 1.00 0.00 O ATOM 1463 OE2 GLU A 538 -7.619 -4.009 -2.224 1.00 0.00 O ATOM 0 H GLU A 538 -3.208 -4.207 -2.208 1.00 0.00 H new ATOM 0 HA GLU A 538 -3.432 -5.700 -4.724 1.00 0.00 H new ATOM 0 HB2 GLU A 538 -5.013 -3.157 -4.279 1.00 0.00 H new ATOM 0 HB3 GLU A 538 -5.140 -4.297 -5.604 1.00 0.00 H new ATOM 0 HG2 GLU A 538 -6.991 -4.938 -4.429 1.00 0.00 H new ATOM 0 HG3 GLU A 538 -5.819 -5.978 -3.646 1.00 0.00 H new ATOM 1470 N TRP A 539 -2.358 -3.649 -5.968 1.00 0.00 N ATOM 1471 CA TRP A 539 -1.371 -2.737 -6.537 1.00 0.00 C ATOM 1472 C TRP A 539 -2.025 -1.432 -6.975 1.00 0.00 C ATOM 1473 O TRP A 539 -2.571 -1.339 -8.074 1.00 0.00 O ATOM 1474 CB TRP A 539 -0.666 -3.393 -7.725 1.00 0.00 C ATOM 1475 CG TRP A 539 0.129 -4.606 -7.348 1.00 0.00 C ATOM 1476 CD1 TRP A 539 -0.260 -5.910 -7.464 1.00 0.00 C ATOM 1477 CD2 TRP A 539 1.449 -4.627 -6.793 1.00 0.00 C ATOM 1478 NE1 TRP A 539 0.739 -6.740 -7.014 1.00 0.00 N ATOM 1479 CE2 TRP A 539 1.798 -5.978 -6.598 1.00 0.00 C ATOM 1480 CE3 TRP A 539 2.371 -3.636 -6.444 1.00 0.00 C ATOM 1481 CZ2 TRP A 539 3.027 -6.360 -6.068 1.00 0.00 C ATOM 1482 CZ3 TRP A 539 3.591 -4.017 -5.918 1.00 0.00 C ATOM 1483 CH2 TRP A 539 3.911 -5.369 -5.735 1.00 0.00 C ATOM 0 H TRP A 539 -2.898 -4.170 -6.659 1.00 0.00 H new ATOM 0 HA TRP A 539 -0.634 -2.511 -5.766 1.00 0.00 H new ATOM 0 HB2 TRP A 539 -1.410 -3.673 -8.471 1.00 0.00 H new ATOM 0 HB3 TRP A 539 -0.004 -2.664 -8.193 1.00 0.00 H new ATOM 0 HD1 TRP A 539 -1.212 -6.240 -7.852 1.00 0.00 H new ATOM 0 HE1 TRP A 539 0.698 -7.759 -6.993 1.00 0.00 H new ATOM 0 HE3 TRP A 539 2.134 -2.591 -6.583 1.00 0.00 H new ATOM 0 HZ2 TRP A 539 3.275 -7.401 -5.924 1.00 0.00 H new ATOM 0 HZ3 TRP A 539 4.310 -3.260 -5.643 1.00 0.00 H new ATOM 0 HH2 TRP A 539 4.874 -5.634 -5.323 1.00 0.00 H new ATOM 1494 N ALA A 540 -1.966 -0.425 -6.109 1.00 0.00 N ATOM 1495 CA ALA A 540 -2.550 0.876 -6.409 1.00 0.00 C ATOM 1496 C ALA A 540 -1.993 1.442 -7.711 1.00 0.00 C ATOM 1497 O ALA A 540 -0.790 1.375 -7.963 1.00 0.00 O ATOM 1498 CB ALA A 540 -2.301 1.844 -5.261 1.00 0.00 C ATOM 0 H ALA A 540 -1.519 -0.486 -5.194 1.00 0.00 H new ATOM 0 HA ALA A 540 -3.625 0.744 -6.532 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -2.743 2.812 -5.499 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -2.754 1.452 -4.350 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -1.228 1.962 -5.111 1.00 0.00 H new ATOM 1504 N ASP A 541 -2.875 1.997 -8.534 1.00 0.00 N ATOM 1505 CA ASP A 541 -2.470 2.575 -9.811 1.00 0.00 C ATOM 1506 C ASP A 541 -2.562 4.097 -9.772 1.00 0.00 C ATOM 1507 O ASP A 541 -3.518 4.685 -10.277 1.00 0.00 O ATOM 1508 CB ASP A 541 -3.343 2.028 -10.942 1.00 0.00 C ATOM 1509 CG ASP A 541 -4.822 2.092 -10.614 1.00 0.00 C ATOM 1510 OD1 ASP A 541 -5.219 1.560 -9.556 1.00 0.00 O ATOM 1511 OD2 ASP A 541 -5.583 2.673 -11.416 1.00 0.00 O ATOM 0 H ASP A 541 -3.875 2.059 -8.341 1.00 0.00 H new ATOM 0 HA ASP A 541 -1.433 2.296 -9.995 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -3.151 2.596 -11.853 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -3.063 0.994 -11.146 1.00 0.00 H new ATOM 1516 N SER A 542 -1.561 4.729 -9.167 1.00 0.00 N ATOM 1517 CA SER A 542 -1.531 6.183 -9.057 1.00 0.00 C ATOM 1518 C SER A 542 -0.623 6.790 -10.123 1.00 0.00 C ATOM 1519 O SER A 542 0.453 6.266 -10.408 1.00 0.00 O ATOM 1520 CB SER A 542 -1.052 6.601 -7.666 1.00 0.00 C ATOM 1521 OG SER A 542 -1.121 8.007 -7.503 1.00 0.00 O ATOM 0 H SER A 542 -0.761 4.257 -8.746 1.00 0.00 H new ATOM 0 HA SER A 542 -2.544 6.555 -9.212 1.00 0.00 H new ATOM 0 HB2 SER A 542 -1.663 6.113 -6.906 1.00 0.00 H new ATOM 0 HB3 SER A 542 -0.026 6.264 -7.515 1.00 0.00 H new ATOM 0 HG SER A 542 -0.811 8.248 -6.605 1.00 0.00 H new ATOM 1527 N GLU A 543 -1.067 7.897 -10.709 1.00 0.00 N ATOM 1528 CA GLU A 543 -0.296 8.575 -11.744 1.00 0.00 C ATOM 1529 C GLU A 543 1.044 9.059 -11.196 1.00 0.00 C ATOM 1530 O GLU A 543 1.242 9.127 -9.983 1.00 0.00 O ATOM 1531 CB GLU A 543 -1.086 9.758 -12.308 1.00 0.00 C ATOM 1532 CG GLU A 543 -1.224 10.917 -11.335 1.00 0.00 C ATOM 1533 CD GLU A 543 -1.578 12.219 -12.026 1.00 0.00 C ATOM 1534 OE1 GLU A 543 -0.711 12.769 -12.737 1.00 0.00 O ATOM 1535 OE2 GLU A 543 -2.723 12.689 -11.856 1.00 0.00 O ATOM 0 H GLU A 543 -1.956 8.343 -10.485 1.00 0.00 H new ATOM 0 HA GLU A 543 -0.105 7.860 -12.545 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -0.596 10.112 -13.215 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -2.080 9.416 -12.596 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.993 10.680 -10.600 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -0.289 11.042 -10.790 1.00 0.00 H new ATOM 1542 N VAL A 544 1.960 9.393 -12.099 1.00 0.00 N ATOM 1543 CA VAL A 544 3.280 9.871 -11.707 1.00 0.00 C ATOM 1544 C VAL A 544 3.499 11.312 -12.156 1.00 0.00 C ATOM 1545 O VAL A 544 3.054 11.714 -13.231 1.00 0.00 O ATOM 1546 CB VAL A 544 4.395 8.987 -12.296 1.00 0.00 C ATOM 1547 CG1 VAL A 544 4.403 9.078 -13.815 1.00 0.00 C ATOM 1548 CG2 VAL A 544 5.748 9.383 -11.724 1.00 0.00 C ATOM 0 H VAL A 544 1.812 9.341 -13.107 1.00 0.00 H new ATOM 0 HA VAL A 544 3.324 9.822 -10.619 1.00 0.00 H new ATOM 0 HB VAL A 544 4.198 7.952 -12.018 1.00 0.00 H new ATOM 0 HG11 VAL A 544 5.197 8.447 -14.213 1.00 0.00 H new ATOM 0 HG12 VAL A 544 3.442 8.741 -14.205 1.00 0.00 H new ATOM 0 HG13 VAL A 544 4.575 10.111 -14.117 1.00 0.00 H new ATOM 0 HG21 VAL A 544 6.524 8.748 -12.151 1.00 0.00 H new ATOM 0 HG22 VAL A 544 5.956 10.425 -11.969 1.00 0.00 H new ATOM 0 HG23 VAL A 544 5.735 9.261 -10.641 1.00 0.00 H new ATOM 1558 N THR A 545 4.188 12.087 -11.324 1.00 0.00 N ATOM 1559 CA THR A 545 4.466 13.484 -11.634 1.00 0.00 C ATOM 1560 C THR A 545 5.466 13.604 -12.779 1.00 0.00 C ATOM 1561 O THR A 545 6.590 13.110 -12.690 1.00 0.00 O ATOM 1562 CB THR A 545 5.016 14.233 -10.406 1.00 0.00 C ATOM 1563 OG1 THR A 545 6.172 13.558 -9.898 1.00 0.00 O ATOM 1564 CG2 THR A 545 3.960 14.333 -9.316 1.00 0.00 C ATOM 0 H THR A 545 4.564 11.771 -10.430 1.00 0.00 H new ATOM 0 HA THR A 545 3.520 13.936 -11.932 1.00 0.00 H new ATOM 0 HB THR A 545 5.292 15.241 -10.716 1.00 0.00 H new ATOM 0 HG1 THR A 545 6.610 13.067 -10.625 1.00 0.00 H new ATOM 0 HG21 THR A 545 4.371 14.866 -8.459 1.00 0.00 H new ATOM 0 HG22 THR A 545 3.093 14.873 -9.697 1.00 0.00 H new ATOM 0 HG23 THR A 545 3.657 13.332 -9.010 1.00 0.00 H new ATOM 1572 N VAL A 546 5.050 14.265 -13.855 1.00 0.00 N ATOM 1573 CA VAL A 546 5.910 14.452 -15.017 1.00 0.00 C ATOM 1574 C VAL A 546 6.833 15.651 -14.830 1.00 0.00 C ATOM 1575 O VAL A 546 6.604 16.493 -13.962 1.00 0.00 O ATOM 1576 CB VAL A 546 5.083 14.651 -16.301 1.00 0.00 C ATOM 1577 CG1 VAL A 546 4.225 13.425 -16.578 1.00 0.00 C ATOM 1578 CG2 VAL A 546 4.222 15.900 -16.193 1.00 0.00 C ATOM 0 H VAL A 546 4.123 14.680 -13.946 1.00 0.00 H new ATOM 0 HA VAL A 546 6.509 13.547 -15.116 1.00 0.00 H new ATOM 0 HB VAL A 546 5.769 14.782 -17.137 1.00 0.00 H new ATOM 0 HG11 VAL A 546 3.648 13.583 -17.489 1.00 0.00 H new ATOM 0 HG12 VAL A 546 4.866 12.552 -16.702 1.00 0.00 H new ATOM 0 HG13 VAL A 546 3.546 13.260 -15.742 1.00 0.00 H new ATOM 0 HG21 VAL A 546 3.645 16.024 -17.109 1.00 0.00 H new ATOM 0 HG22 VAL A 546 3.542 15.801 -15.347 1.00 0.00 H new ATOM 0 HG23 VAL A 546 4.861 16.771 -16.046 1.00 0.00 H new ATOM 1588 N GLN A 547 7.876 15.722 -15.651 1.00 0.00 N ATOM 1589 CA GLN A 547 8.834 16.818 -15.575 1.00 0.00 C ATOM 1590 C GLN A 547 9.768 16.809 -16.781 1.00 0.00 C ATOM 1591 O GLN A 547 10.377 15.789 -17.099 1.00 0.00 O ATOM 1592 CB GLN A 547 9.649 16.723 -14.284 1.00 0.00 C ATOM 1593 CG GLN A 547 10.710 17.804 -14.153 1.00 0.00 C ATOM 1594 CD GLN A 547 11.308 17.870 -12.762 1.00 0.00 C ATOM 1595 OE1 GLN A 547 10.924 17.110 -11.872 1.00 0.00 O ATOM 1596 NE2 GLN A 547 12.253 18.782 -12.566 1.00 0.00 N ATOM 0 H GLN A 547 8.079 15.034 -16.376 1.00 0.00 H new ATOM 0 HA GLN A 547 8.277 17.755 -15.576 1.00 0.00 H new ATOM 0 HB2 GLN A 547 8.972 16.785 -13.432 1.00 0.00 H new ATOM 0 HB3 GLN A 547 10.130 15.746 -14.239 1.00 0.00 H new ATOM 0 HG2 GLN A 547 11.503 17.618 -14.877 1.00 0.00 H new ATOM 0 HG3 GLN A 547 10.271 18.770 -14.402 1.00 0.00 H new ATOM 0 HE21 GLN A 547 12.541 19.391 -13.332 1.00 0.00 H new ATOM 0 HE22 GLN A 547 12.691 18.873 -11.650 1.00 0.00 H new ATOM 1605 N SER A 548 9.874 17.954 -17.449 1.00 0.00 N ATOM 1606 CA SER A 548 10.730 18.077 -18.623 1.00 0.00 C ATOM 1607 C SER A 548 12.185 18.290 -18.215 1.00 0.00 C ATOM 1608 O SER A 548 12.476 18.636 -17.071 1.00 0.00 O ATOM 1609 CB SER A 548 10.260 19.236 -19.504 1.00 0.00 C ATOM 1610 OG SER A 548 10.694 19.068 -20.843 1.00 0.00 O ATOM 0 H SER A 548 9.378 18.809 -17.197 1.00 0.00 H new ATOM 0 HA SER A 548 10.662 17.149 -19.190 1.00 0.00 H new ATOM 0 HB2 SER A 548 9.172 19.300 -19.476 1.00 0.00 H new ATOM 0 HB3 SER A 548 10.645 20.176 -19.109 1.00 0.00 H new ATOM 0 HG SER A 548 10.379 19.821 -21.386 1.00 0.00 H new ATOM 1616 N GLY A 549 13.095 18.080 -19.161 1.00 0.00 N ATOM 1617 CA GLY A 549 14.509 18.254 -18.882 1.00 0.00 C ATOM 1618 C GLY A 549 15.390 17.507 -19.863 1.00 0.00 C ATOM 1619 O GLY A 549 15.840 16.391 -19.602 1.00 0.00 O ATOM 0 H GLY A 549 12.879 17.793 -20.115 1.00 0.00 H new ATOM 0 HA2 GLY A 549 14.754 19.316 -18.914 1.00 0.00 H new ATOM 0 HA3 GLY A 549 14.722 17.908 -17.871 1.00 0.00 H new ATOM 1623 N PRO A 550 15.647 18.127 -21.025 1.00 0.00 N ATOM 1624 CA PRO A 550 16.481 17.531 -22.072 1.00 0.00 C ATOM 1625 C PRO A 550 17.950 17.459 -21.673 1.00 0.00 C ATOM 1626 O PRO A 550 18.439 18.297 -20.915 1.00 0.00 O ATOM 1627 CB PRO A 550 16.294 18.482 -23.257 1.00 0.00 C ATOM 1628 CG PRO A 550 15.931 19.789 -22.641 1.00 0.00 C ATOM 1629 CD PRO A 550 15.143 19.458 -21.404 1.00 0.00 C ATOM 0 HA PRO A 550 16.195 16.501 -22.284 1.00 0.00 H new ATOM 0 HB2 PRO A 550 17.207 18.563 -23.848 1.00 0.00 H new ATOM 0 HB3 PRO A 550 15.510 18.129 -23.928 1.00 0.00 H new ATOM 0 HG2 PRO A 550 16.823 20.365 -22.393 1.00 0.00 H new ATOM 0 HG3 PRO A 550 15.341 20.395 -23.329 1.00 0.00 H new ATOM 0 HD2 PRO A 550 15.309 20.190 -20.614 1.00 0.00 H new ATOM 0 HD3 PRO A 550 14.071 19.440 -21.603 1.00 0.00 H new ATOM 1637 N SER A 551 18.650 16.454 -22.188 1.00 0.00 N ATOM 1638 CA SER A 551 20.064 16.271 -21.882 1.00 0.00 C ATOM 1639 C SER A 551 20.935 17.110 -22.813 1.00 0.00 C ATOM 1640 O SER A 551 20.555 17.391 -23.950 1.00 0.00 O ATOM 1641 CB SER A 551 20.447 14.794 -22.001 1.00 0.00 C ATOM 1642 OG SER A 551 20.095 14.080 -20.828 1.00 0.00 O ATOM 0 H SER A 551 18.261 15.754 -22.819 1.00 0.00 H new ATOM 0 HA SER A 551 20.234 16.602 -20.857 1.00 0.00 H new ATOM 0 HB2 SER A 551 19.946 14.353 -22.863 1.00 0.00 H new ATOM 0 HB3 SER A 551 21.519 14.706 -22.176 1.00 0.00 H new ATOM 0 HG SER A 551 20.348 13.139 -20.930 1.00 0.00 H new ATOM 1648 N SER A 552 22.104 17.507 -22.321 1.00 0.00 N ATOM 1649 CA SER A 552 23.028 18.317 -23.106 1.00 0.00 C ATOM 1650 C SER A 552 24.475 17.973 -22.768 1.00 0.00 C ATOM 1651 O SER A 552 24.887 18.042 -21.611 1.00 0.00 O ATOM 1652 CB SER A 552 22.774 19.805 -22.856 1.00 0.00 C ATOM 1653 OG SER A 552 23.384 20.602 -23.857 1.00 0.00 O ATOM 0 H SER A 552 22.434 17.281 -21.383 1.00 0.00 H new ATOM 0 HA SER A 552 22.858 18.098 -24.160 1.00 0.00 H new ATOM 0 HB2 SER A 552 21.701 19.996 -22.838 1.00 0.00 H new ATOM 0 HB3 SER A 552 23.164 20.084 -21.877 1.00 0.00 H new ATOM 0 HG SER A 552 23.206 21.548 -23.675 1.00 0.00 H new ATOM 1659 N GLY A 553 25.243 17.601 -23.788 1.00 0.00 N ATOM 1660 CA GLY A 553 26.635 17.251 -23.579 1.00 0.00 C ATOM 1661 C GLY A 553 26.825 15.776 -23.284 1.00 0.00 C ATOM 1662 O GLY A 553 27.479 15.063 -24.045 1.00 0.00 O ATOM 0 H GLY A 553 24.925 17.536 -24.755 1.00 0.00 H new ATOM 0 HA2 GLY A 553 27.210 17.518 -24.465 1.00 0.00 H new ATOM 0 HA3 GLY A 553 27.034 17.838 -22.752 1.00 0.00 H new TER 1666 GLY A 553