USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 556 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 519 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 522 THR OG1 : rot 180:sc= 0 USER MOD Single : A 523 SER OG : rot 160:sc= 0.0125 USER MOD Single : A 524 ASN : amide:sc= -0.733 K(o=-0.73,f=-2.1!) USER MOD Single : A 526 THR OG1 : rot 44:sc= -1.78! USER MOD Single : A 530 THR OG1 : rot 180:sc= 0.00142 USER MOD Single : A 531 TYR OH : rot 180:sc= 0 USER MOD Single : A 532 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 535 MET CE :methyl -130:sc= -6.62! (180deg=-12.3!) USER MOD Single : A 536 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 MET CE :methyl 141:sc= -0.405 (180deg=-0.991) USER MOD Single : A 545 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 549 MET CE :methyl 161:sc= -7.19! (180deg=-8.39!) USER MOD Single : A 550 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 554 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.48) USER MOD Single : A 555 GLN : amide:sc= -0.571 K(o=-0.57,f=-1.9!) USER MOD Single : A 557 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 558 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 559 ASN : amide:sc= -0.574 K(o=-0.57,f=-2.8!) USER MOD Single : A 564 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.16) USER MOD Single : A 566 HIS : no HE2:sc= -4.89! C(o=-4.9!,f=-9.8!) USER MOD Single : A 567 MET CE :methyl -155:sc= -0.305 (180deg=-1.63!) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 569 ASN : amide:sc= -1.67 X(o=-1.7,f=-1.4) USER MOD Single : A 574 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 575 LYS NZ :NH3+ -130:sc= -0.27 (180deg=-0.402) USER MOD Single : A 577 GLN : amide:sc= -3.43 X(o=-3.4,f=-3.2!) USER MOD Single : A 578 THR OG1 : rot 75:sc= 0.962 USER MOD Single : A 587 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 519 60.604 -14.568 17.974 1.00 0.00 N ATOM 2 CA GLN A 519 61.684 -14.247 17.047 1.00 0.00 C ATOM 3 C GLN A 519 61.125 -13.973 15.646 1.00 0.00 C ATOM 4 O GLN A 519 60.976 -14.898 14.844 1.00 0.00 O ATOM 5 CB GLN A 519 62.681 -15.407 16.988 1.00 0.00 C ATOM 6 CG GLN A 519 63.966 -14.942 16.301 1.00 0.00 C ATOM 7 CD GLN A 519 64.957 -16.098 16.208 1.00 0.00 C ATOM 8 OE1 GLN A 519 64.939 -16.855 15.238 1.00 0.00 O ATOM 9 NE2 GLN A 519 65.823 -16.281 17.165 1.00 0.00 N ATOM 0 HA GLN A 519 62.193 -13.351 17.403 1.00 0.00 H new ATOM 0 HB2 GLN A 519 62.902 -15.762 17.995 1.00 0.00 H new ATOM 0 HB3 GLN A 519 62.248 -16.245 16.443 1.00 0.00 H new ATOM 0 HG2 GLN A 519 63.739 -14.566 15.303 1.00 0.00 H new ATOM 0 HG3 GLN A 519 64.408 -14.117 16.860 1.00 0.00 H new ATOM 0 HE21 GLN A 519 65.836 -15.652 17.968 1.00 0.00 H new ATOM 0 HE22 GLN A 519 66.488 -17.053 17.111 1.00 0.00 H new ATOM 18 N PRO A 520 60.795 -12.732 15.341 1.00 0.00 N ATOM 19 CA PRO A 520 60.229 -12.376 14.001 1.00 0.00 C ATOM 20 C PRO A 520 61.226 -12.638 12.872 1.00 0.00 C ATOM 21 O PRO A 520 60.835 -13.013 11.765 1.00 0.00 O ATOM 22 CB PRO A 520 59.901 -10.882 14.111 1.00 0.00 C ATOM 23 CG PRO A 520 60.745 -10.369 15.227 1.00 0.00 C ATOM 24 CD PRO A 520 60.934 -11.534 16.194 1.00 0.00 C ATOM 0 HA PRO A 520 59.356 -12.981 13.757 1.00 0.00 H new ATOM 0 HB2 PRO A 520 60.124 -10.362 13.179 1.00 0.00 H new ATOM 0 HB3 PRO A 520 58.842 -10.727 14.317 1.00 0.00 H new ATOM 0 HG2 PRO A 520 61.706 -10.013 14.855 1.00 0.00 H new ATOM 0 HG3 PRO A 520 60.263 -9.527 15.723 1.00 0.00 H new ATOM 0 HD2 PRO A 520 61.911 -11.498 16.676 1.00 0.00 H new ATOM 0 HD3 PRO A 520 60.187 -11.520 16.987 1.00 0.00 H new ATOM 32 N GLY A 521 62.511 -12.438 13.162 1.00 0.00 N ATOM 33 CA GLY A 521 63.559 -12.684 12.176 1.00 0.00 C ATOM 34 C GLY A 521 63.499 -11.659 11.046 1.00 0.00 C ATOM 35 O GLY A 521 63.500 -12.024 9.870 1.00 0.00 O ATOM 0 H GLY A 521 62.849 -12.108 14.066 1.00 0.00 H new ATOM 0 HA2 GLY A 521 64.535 -12.641 12.659 1.00 0.00 H new ATOM 0 HA3 GLY A 521 63.450 -13.688 11.767 1.00 0.00 H new ATOM 39 N THR A 522 63.446 -10.379 11.413 1.00 0.00 N ATOM 40 CA THR A 522 63.389 -9.308 10.421 1.00 0.00 C ATOM 41 C THR A 522 64.183 -8.094 10.894 1.00 0.00 C ATOM 42 O THR A 522 64.363 -7.890 12.096 1.00 0.00 O ATOM 43 CB THR A 522 61.933 -8.902 10.169 1.00 0.00 C ATOM 44 OG1 THR A 522 61.355 -8.443 11.383 1.00 0.00 O ATOM 45 CG2 THR A 522 61.146 -10.107 9.648 1.00 0.00 C ATOM 0 H THR A 522 63.441 -10.061 12.382 1.00 0.00 H new ATOM 0 HA THR A 522 63.828 -9.676 9.494 1.00 0.00 H new ATOM 0 HB THR A 522 61.901 -8.104 9.427 1.00 0.00 H new ATOM 0 HG1 THR A 522 60.424 -8.181 11.224 1.00 0.00 H new ATOM 0 HG21 THR A 522 60.111 -9.816 9.470 1.00 0.00 H new ATOM 0 HG22 THR A 522 61.590 -10.457 8.716 1.00 0.00 H new ATOM 0 HG23 THR A 522 61.175 -10.908 10.387 1.00 0.00 H new ATOM 53 N SER A 523 64.655 -7.291 9.940 1.00 0.00 N ATOM 54 CA SER A 523 65.425 -6.091 10.263 1.00 0.00 C ATOM 55 C SER A 523 64.936 -4.905 9.437 1.00 0.00 C ATOM 56 O SER A 523 64.418 -5.079 8.333 1.00 0.00 O ATOM 57 CB SER A 523 66.908 -6.334 9.984 1.00 0.00 C ATOM 58 OG SER A 523 67.342 -7.479 10.707 1.00 0.00 O ATOM 0 H SER A 523 64.518 -7.449 8.942 1.00 0.00 H new ATOM 0 HA SER A 523 65.287 -5.864 11.320 1.00 0.00 H new ATOM 0 HB2 SER A 523 67.069 -6.482 8.916 1.00 0.00 H new ATOM 0 HB3 SER A 523 67.492 -5.462 10.277 1.00 0.00 H new ATOM 0 HG SER A 523 68.164 -7.828 10.304 1.00 0.00 H new ATOM 64 N ASN A 524 65.105 -3.699 9.980 1.00 0.00 N ATOM 65 CA ASN A 524 64.662 -2.485 9.293 1.00 0.00 C ATOM 66 C ASN A 524 65.689 -1.363 9.458 1.00 0.00 C ATOM 67 O ASN A 524 65.330 -0.188 9.564 1.00 0.00 O ATOM 68 CB ASN A 524 63.299 -2.039 9.843 1.00 0.00 C ATOM 69 CG ASN A 524 63.364 -1.855 11.358 1.00 0.00 C ATOM 70 OD1 ASN A 524 64.261 -1.181 11.865 1.00 0.00 O ATOM 71 ND2 ASN A 524 62.460 -2.417 12.114 1.00 0.00 N ATOM 0 H ASN A 524 65.542 -3.537 10.887 1.00 0.00 H new ATOM 0 HA ASN A 524 64.564 -2.706 8.230 1.00 0.00 H new ATOM 0 HB2 ASN A 524 62.999 -1.104 9.370 1.00 0.00 H new ATOM 0 HB3 ASN A 524 62.540 -2.780 9.594 1.00 0.00 H new ATOM 0 HD21 ASN A 524 62.496 -2.298 13.126 1.00 0.00 H new ATOM 0 HD22 ASN A 524 61.718 -2.975 11.692 1.00 0.00 H new ATOM 78 N GLU A 525 66.972 -1.733 9.463 1.00 0.00 N ATOM 79 CA GLU A 525 68.047 -0.757 9.627 1.00 0.00 C ATOM 80 C GLU A 525 69.091 -0.918 8.525 1.00 0.00 C ATOM 81 O GLU A 525 69.139 -1.950 7.857 1.00 0.00 O ATOM 82 CB GLU A 525 68.714 -0.939 10.992 1.00 0.00 C ATOM 83 CG GLU A 525 67.683 -0.717 12.100 1.00 0.00 C ATOM 84 CD GLU A 525 68.356 -0.810 13.465 1.00 0.00 C ATOM 85 OE1 GLU A 525 68.643 -1.918 13.888 1.00 0.00 O ATOM 86 OE2 GLU A 525 68.574 0.228 14.068 1.00 0.00 O ATOM 0 H GLU A 525 67.289 -2.697 9.356 1.00 0.00 H new ATOM 0 HA GLU A 525 67.617 0.242 9.562 1.00 0.00 H new ATOM 0 HB2 GLU A 525 69.137 -1.940 11.071 1.00 0.00 H new ATOM 0 HB3 GLU A 525 69.539 -0.235 11.102 1.00 0.00 H new ATOM 0 HG2 GLU A 525 67.215 0.260 11.982 1.00 0.00 H new ATOM 0 HG3 GLU A 525 66.890 -1.461 12.025 1.00 0.00 H new ATOM 93 N THR A 526 69.946 0.100 8.367 1.00 0.00 N ATOM 94 CA THR A 526 70.987 0.114 7.333 1.00 0.00 C ATOM 95 C THR A 526 70.418 -0.237 5.950 1.00 0.00 C ATOM 96 O THR A 526 70.126 -1.400 5.672 1.00 0.00 O ATOM 97 CB THR A 526 72.126 -0.858 7.694 1.00 0.00 C ATOM 98 OG1 THR A 526 71.615 -1.953 8.439 1.00 0.00 O ATOM 99 CG2 THR A 526 73.179 -0.128 8.532 1.00 0.00 C ATOM 0 H THR A 526 69.935 0.936 8.952 1.00 0.00 H new ATOM 0 HA THR A 526 71.384 1.128 7.288 1.00 0.00 H new ATOM 0 HB THR A 526 72.578 -1.228 6.774 1.00 0.00 H new ATOM 0 HG1 THR A 526 70.783 -2.268 8.029 1.00 0.00 H new ATOM 0 HG21 THR A 526 73.984 -0.818 8.786 1.00 0.00 H new ATOM 0 HG22 THR A 526 73.584 0.707 7.960 1.00 0.00 H new ATOM 0 HG23 THR A 526 72.720 0.247 9.447 1.00 0.00 H new ATOM 107 N PRO A 527 70.312 0.733 5.060 1.00 0.00 N ATOM 108 CA PRO A 527 70.099 0.444 3.605 1.00 0.00 C ATOM 109 C PRO A 527 71.088 -0.599 3.081 1.00 0.00 C ATOM 110 O PRO A 527 70.779 -1.360 2.163 1.00 0.00 O ATOM 111 CB PRO A 527 70.322 1.797 2.929 1.00 0.00 C ATOM 112 CG PRO A 527 69.966 2.812 3.961 1.00 0.00 C ATOM 113 CD PRO A 527 70.280 2.187 5.321 1.00 0.00 C ATOM 0 HA PRO A 527 69.112 0.026 3.408 1.00 0.00 H new ATOM 0 HB2 PRO A 527 71.357 1.910 2.606 1.00 0.00 H new ATOM 0 HB3 PRO A 527 69.698 1.902 2.042 1.00 0.00 H new ATOM 0 HG2 PRO A 527 70.538 3.729 3.815 1.00 0.00 H new ATOM 0 HG3 PRO A 527 68.912 3.080 3.893 1.00 0.00 H new ATOM 0 HD2 PRO A 527 71.234 2.542 5.710 1.00 0.00 H new ATOM 0 HD3 PRO A 527 69.520 2.441 6.060 1.00 0.00 H new ATOM 121 N GLU A 528 72.270 -0.644 3.702 1.00 0.00 N ATOM 122 CA GLU A 528 73.250 -1.686 3.399 1.00 0.00 C ATOM 123 C GLU A 528 72.691 -3.067 3.731 1.00 0.00 C ATOM 124 O GLU A 528 72.937 -4.032 3.004 1.00 0.00 O ATOM 125 CB GLU A 528 74.534 -1.448 4.198 1.00 0.00 C ATOM 126 CG GLU A 528 75.177 -0.133 3.753 1.00 0.00 C ATOM 127 CD GLU A 528 76.498 0.082 4.488 1.00 0.00 C ATOM 128 OE1 GLU A 528 77.227 -0.882 4.656 1.00 0.00 O ATOM 129 OE2 GLU A 528 76.760 1.210 4.874 1.00 0.00 O ATOM 0 H GLU A 528 72.568 0.025 4.412 1.00 0.00 H new ATOM 0 HA GLU A 528 73.473 -1.645 2.333 1.00 0.00 H new ATOM 0 HB2 GLU A 528 74.310 -1.413 5.264 1.00 0.00 H new ATOM 0 HB3 GLU A 528 75.228 -2.274 4.045 1.00 0.00 H new ATOM 0 HG2 GLU A 528 75.350 -0.150 2.677 1.00 0.00 H new ATOM 0 HG3 GLU A 528 74.501 0.698 3.955 1.00 0.00 H new ATOM 136 N GLU A 529 71.896 -3.151 4.804 1.00 0.00 N ATOM 137 CA GLU A 529 71.277 -4.421 5.180 1.00 0.00 C ATOM 138 C GLU A 529 70.255 -4.845 4.126 1.00 0.00 C ATOM 139 O GLU A 529 70.137 -6.028 3.805 1.00 0.00 O ATOM 140 CB GLU A 529 70.591 -4.291 6.543 1.00 0.00 C ATOM 141 CG GLU A 529 70.174 -5.676 7.047 1.00 0.00 C ATOM 142 CD GLU A 529 69.384 -5.545 8.346 1.00 0.00 C ATOM 143 OE1 GLU A 529 68.553 -4.655 8.425 1.00 0.00 O ATOM 144 OE2 GLU A 529 69.623 -6.338 9.242 1.00 0.00 O ATOM 0 H GLU A 529 71.670 -2.367 5.416 1.00 0.00 H new ATOM 0 HA GLU A 529 72.056 -5.181 5.244 1.00 0.00 H new ATOM 0 HB2 GLU A 529 71.267 -3.822 7.258 1.00 0.00 H new ATOM 0 HB3 GLU A 529 69.717 -3.645 6.460 1.00 0.00 H new ATOM 0 HG2 GLU A 529 69.568 -6.179 6.293 1.00 0.00 H new ATOM 0 HG3 GLU A 529 71.057 -6.293 7.210 1.00 0.00 H new ATOM 151 N THR A 530 69.539 -3.867 3.567 1.00 0.00 N ATOM 152 CA THR A 530 68.545 -4.147 2.529 1.00 0.00 C ATOM 153 C THR A 530 69.192 -4.822 1.321 1.00 0.00 C ATOM 154 O THR A 530 68.742 -5.879 0.878 1.00 0.00 O ATOM 155 CB THR A 530 67.872 -2.845 2.087 1.00 0.00 C ATOM 156 OG1 THR A 530 67.484 -2.101 3.233 1.00 0.00 O ATOM 157 CG2 THR A 530 66.635 -3.165 1.244 1.00 0.00 C ATOM 0 H THR A 530 69.628 -2.881 3.813 1.00 0.00 H new ATOM 0 HA THR A 530 67.798 -4.823 2.946 1.00 0.00 H new ATOM 0 HB THR A 530 68.573 -2.260 1.492 1.00 0.00 H new ATOM 0 HG1 THR A 530 67.055 -1.266 2.951 1.00 0.00 H new ATOM 0 HG21 THR A 530 66.158 -2.236 0.931 1.00 0.00 H new ATOM 0 HG22 THR A 530 66.932 -3.735 0.364 1.00 0.00 H new ATOM 0 HG23 THR A 530 65.933 -3.752 1.836 1.00 0.00 H new ATOM 165 N TYR A 531 70.273 -4.227 0.814 1.00 0.00 N ATOM 166 CA TYR A 531 70.963 -4.768 -0.356 1.00 0.00 C ATOM 167 C TYR A 531 71.426 -6.210 -0.132 1.00 0.00 C ATOM 168 O TYR A 531 71.082 -7.096 -0.912 1.00 0.00 O ATOM 169 CB TYR A 531 72.169 -3.894 -0.707 1.00 0.00 C ATOM 170 CG TYR A 531 71.801 -2.478 -1.087 1.00 0.00 C ATOM 171 CD1 TYR A 531 70.834 -2.244 -2.097 1.00 0.00 C ATOM 172 CD2 TYR A 531 72.422 -1.385 -0.435 1.00 0.00 C ATOM 173 CE1 TYR A 531 70.490 -0.918 -2.453 1.00 0.00 C ATOM 174 CE2 TYR A 531 72.077 -0.058 -0.791 1.00 0.00 C ATOM 175 CZ TYR A 531 71.111 0.175 -1.800 1.00 0.00 C ATOM 176 OH TYR A 531 70.774 1.468 -2.146 1.00 0.00 O ATOM 0 H TYR A 531 70.687 -3.375 1.193 1.00 0.00 H new ATOM 0 HA TYR A 531 70.251 -4.767 -1.181 1.00 0.00 H new ATOM 0 HB2 TYR A 531 72.848 -3.868 0.145 1.00 0.00 H new ATOM 0 HB3 TYR A 531 72.712 -4.353 -1.533 1.00 0.00 H new ATOM 0 HD1 TYR A 531 70.360 -3.077 -2.595 1.00 0.00 H new ATOM 0 HD2 TYR A 531 73.159 -1.563 0.334 1.00 0.00 H new ATOM 0 HE1 TYR A 531 69.754 -0.739 -3.223 1.00 0.00 H new ATOM 0 HE2 TYR A 531 72.550 0.775 -0.293 1.00 0.00 H new ATOM 0 HH TYR A 531 71.291 2.098 -1.602 1.00 0.00 H new ATOM 186 N GLN A 532 72.183 -6.452 0.943 1.00 0.00 N ATOM 187 CA GLN A 532 72.773 -7.779 1.159 1.00 0.00 C ATOM 188 C GLN A 532 71.692 -8.864 1.263 1.00 0.00 C ATOM 189 O GLN A 532 71.811 -9.930 0.651 1.00 0.00 O ATOM 190 CB GLN A 532 73.674 -7.777 2.412 1.00 0.00 C ATOM 191 CG GLN A 532 72.842 -7.675 3.698 1.00 0.00 C ATOM 192 CD GLN A 532 73.763 -7.668 4.913 1.00 0.00 C ATOM 193 OE1 GLN A 532 74.319 -6.627 5.265 1.00 0.00 O ATOM 194 NE2 GLN A 532 73.958 -8.774 5.579 1.00 0.00 N ATOM 0 H GLN A 532 72.399 -5.763 1.664 1.00 0.00 H new ATOM 0 HA GLN A 532 73.391 -8.014 0.292 1.00 0.00 H new ATOM 0 HB2 GLN A 532 74.271 -8.688 2.434 1.00 0.00 H new ATOM 0 HB3 GLN A 532 74.371 -6.940 2.360 1.00 0.00 H new ATOM 0 HG2 GLN A 532 72.241 -6.766 3.681 1.00 0.00 H new ATOM 0 HG3 GLN A 532 72.149 -8.514 3.761 1.00 0.00 H new ATOM 0 HE21 GLN A 532 73.496 -9.635 5.285 1.00 0.00 H new ATOM 0 HE22 GLN A 532 74.572 -8.777 6.393 1.00 0.00 H new ATOM 203 N ARG A 533 70.601 -8.561 1.972 1.00 0.00 N ATOM 204 CA ARG A 533 69.517 -9.530 2.140 1.00 0.00 C ATOM 205 C ARG A 533 68.948 -9.926 0.780 1.00 0.00 C ATOM 206 O ARG A 533 68.902 -11.108 0.438 1.00 0.00 O ATOM 207 CB ARG A 533 68.407 -8.932 3.010 1.00 0.00 C ATOM 208 CG ARG A 533 67.428 -10.034 3.424 1.00 0.00 C ATOM 209 CD ARG A 533 66.290 -9.423 4.243 1.00 0.00 C ATOM 210 NE ARG A 533 65.406 -10.476 4.747 1.00 0.00 N ATOM 211 CZ ARG A 533 64.527 -11.112 3.959 1.00 0.00 C ATOM 212 NH1 ARG A 533 64.413 -10.818 2.685 1.00 0.00 N ATOM 213 NH2 ARG A 533 63.768 -12.043 4.470 1.00 0.00 N ATOM 0 H ARG A 533 70.446 -7.664 2.433 1.00 0.00 H new ATOM 0 HA ARG A 533 69.916 -10.418 2.630 1.00 0.00 H new ATOM 0 HB2 ARG A 533 68.838 -8.463 3.895 1.00 0.00 H new ATOM 0 HB3 ARG A 533 67.881 -8.152 2.460 1.00 0.00 H new ATOM 0 HG2 ARG A 533 67.028 -10.531 2.540 1.00 0.00 H new ATOM 0 HG3 ARG A 533 67.945 -10.794 4.010 1.00 0.00 H new ATOM 0 HD2 ARG A 533 66.698 -8.852 5.076 1.00 0.00 H new ATOM 0 HD3 ARG A 533 65.722 -8.726 3.626 1.00 0.00 H new ATOM 0 HE ARG A 533 65.461 -10.735 5.732 1.00 0.00 H new ATOM 0 HH11 ARG A 533 65.000 -10.092 2.275 1.00 0.00 H new ATOM 0 HH12 ARG A 533 63.737 -11.315 2.105 1.00 0.00 H new ATOM 0 HH21 ARG A 533 63.847 -12.280 5.459 1.00 0.00 H new ATOM 0 HH22 ARG A 533 63.096 -12.534 3.880 1.00 0.00 H new ATOM 227 N ALA A 534 68.645 -8.922 -0.042 1.00 0.00 N ATOM 228 CA ALA A 534 68.111 -9.167 -1.384 1.00 0.00 C ATOM 229 C ALA A 534 69.119 -9.935 -2.243 1.00 0.00 C ATOM 230 O ALA A 534 68.738 -10.751 -3.083 1.00 0.00 O ATOM 231 CB ALA A 534 67.784 -7.834 -2.062 1.00 0.00 C ATOM 0 H ALA A 534 68.759 -7.936 0.194 1.00 0.00 H new ATOM 0 HA ALA A 534 67.206 -9.767 -1.286 1.00 0.00 H new ATOM 0 HB1 ALA A 534 67.387 -8.021 -3.060 1.00 0.00 H new ATOM 0 HB2 ALA A 534 67.042 -7.298 -1.471 1.00 0.00 H new ATOM 0 HB3 ALA A 534 68.690 -7.233 -2.139 1.00 0.00 H new ATOM 237 N MET A 535 70.407 -9.665 -2.020 1.00 0.00 N ATOM 238 CA MET A 535 71.469 -10.283 -2.812 1.00 0.00 C ATOM 239 C MET A 535 71.517 -11.798 -2.599 1.00 0.00 C ATOM 240 O MET A 535 71.964 -12.536 -3.480 1.00 0.00 O ATOM 241 CB MET A 535 72.826 -9.663 -2.447 1.00 0.00 C ATOM 242 CG MET A 535 73.713 -9.579 -3.697 1.00 0.00 C ATOM 243 SD MET A 535 73.421 -8.008 -4.555 1.00 0.00 S ATOM 244 CE MET A 535 72.127 -8.586 -5.683 1.00 0.00 C ATOM 0 H MET A 535 70.738 -9.024 -1.299 1.00 0.00 H new ATOM 0 HA MET A 535 71.253 -10.096 -3.864 1.00 0.00 H new ATOM 0 HB2 MET A 535 72.680 -8.668 -2.026 1.00 0.00 H new ATOM 0 HB3 MET A 535 73.317 -10.264 -1.682 1.00 0.00 H new ATOM 0 HG2 MET A 535 74.763 -9.660 -3.415 1.00 0.00 H new ATOM 0 HG3 MET A 535 73.497 -10.414 -4.364 1.00 0.00 H new ATOM 0 HE1 MET A 535 72.372 -8.285 -6.702 1.00 0.00 H new ATOM 0 HE2 MET A 535 72.058 -9.673 -5.632 1.00 0.00 H new ATOM 0 HE3 MET A 535 71.171 -8.148 -5.395 1.00 0.00 H new ATOM 254 N LYS A 536 71.060 -12.260 -1.433 1.00 0.00 N ATOM 255 CA LYS A 536 70.975 -13.695 -1.173 1.00 0.00 C ATOM 256 C LYS A 536 69.861 -14.337 -2.007 1.00 0.00 C ATOM 257 O LYS A 536 69.846 -15.554 -2.195 1.00 0.00 O ATOM 258 CB LYS A 536 70.725 -13.951 0.314 1.00 0.00 C ATOM 259 CG LYS A 536 71.929 -13.467 1.126 1.00 0.00 C ATOM 260 CD LYS A 536 71.676 -13.717 2.614 1.00 0.00 C ATOM 261 CE LYS A 536 71.781 -15.214 2.907 1.00 0.00 C ATOM 262 NZ LYS A 536 72.057 -15.418 4.358 1.00 0.00 N ATOM 0 H LYS A 536 70.747 -11.668 -0.664 1.00 0.00 H new ATOM 0 HA LYS A 536 71.925 -14.147 -1.458 1.00 0.00 H new ATOM 0 HB2 LYS A 536 69.823 -13.431 0.637 1.00 0.00 H new ATOM 0 HB3 LYS A 536 70.560 -15.014 0.488 1.00 0.00 H new ATOM 0 HG2 LYS A 536 72.830 -13.990 0.807 1.00 0.00 H new ATOM 0 HG3 LYS A 536 72.097 -12.405 0.948 1.00 0.00 H new ATOM 0 HD2 LYS A 536 72.401 -13.167 3.214 1.00 0.00 H new ATOM 0 HD3 LYS A 536 70.688 -13.350 2.892 1.00 0.00 H new ATOM 0 HE2 LYS A 536 70.855 -15.716 2.628 1.00 0.00 H new ATOM 0 HE3 LYS A 536 72.577 -15.658 2.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 536 72.129 -16.436 4.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 536 72.952 -14.952 4.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 536 71.283 -15.008 4.919 1.00 0.00 H new ATOM 276 N ASP A 537 68.930 -13.517 -2.499 1.00 0.00 N ATOM 277 CA ASP A 537 67.890 -14.001 -3.400 1.00 0.00 C ATOM 278 C ASP A 537 68.443 -14.119 -4.828 1.00 0.00 C ATOM 279 O ASP A 537 68.843 -13.113 -5.417 1.00 0.00 O ATOM 280 CB ASP A 537 66.702 -13.033 -3.389 1.00 0.00 C ATOM 281 CG ASP A 537 65.432 -13.717 -3.903 1.00 0.00 C ATOM 282 OD1 ASP A 537 65.445 -14.928 -4.069 1.00 0.00 O ATOM 283 OD2 ASP A 537 64.458 -13.015 -4.123 1.00 0.00 O ATOM 0 H ASP A 537 68.877 -12.520 -2.288 1.00 0.00 H new ATOM 0 HA ASP A 537 67.560 -14.983 -3.062 1.00 0.00 H new ATOM 0 HB2 ASP A 537 66.537 -12.666 -2.376 1.00 0.00 H new ATOM 0 HB3 ASP A 537 66.929 -12.166 -4.009 1.00 0.00 H new ATOM 288 N PRO A 538 68.468 -15.310 -5.400 1.00 0.00 N ATOM 289 CA PRO A 538 69.227 -15.556 -6.673 1.00 0.00 C ATOM 290 C PRO A 538 68.791 -14.628 -7.808 1.00 0.00 C ATOM 291 O PRO A 538 69.613 -14.209 -8.626 1.00 0.00 O ATOM 292 CB PRO A 538 68.926 -17.020 -7.026 1.00 0.00 C ATOM 293 CG PRO A 538 68.422 -17.644 -5.770 1.00 0.00 C ATOM 294 CD PRO A 538 67.760 -16.531 -4.967 1.00 0.00 C ATOM 0 HA PRO A 538 70.291 -15.359 -6.539 1.00 0.00 H new ATOM 0 HB2 PRO A 538 68.183 -17.086 -7.821 1.00 0.00 H new ATOM 0 HB3 PRO A 538 69.822 -17.528 -7.383 1.00 0.00 H new ATOM 0 HG2 PRO A 538 67.710 -18.439 -5.991 1.00 0.00 H new ATOM 0 HG3 PRO A 538 69.239 -18.095 -5.207 1.00 0.00 H new ATOM 0 HD2 PRO A 538 66.692 -16.469 -5.176 1.00 0.00 H new ATOM 0 HD3 PRO A 538 67.866 -16.695 -3.895 1.00 0.00 H new ATOM 302 N GLU A 539 67.509 -14.267 -7.823 1.00 0.00 N ATOM 303 CA GLU A 539 66.968 -13.462 -8.916 1.00 0.00 C ATOM 304 C GLU A 539 67.545 -12.052 -8.874 1.00 0.00 C ATOM 305 O GLU A 539 67.910 -11.487 -9.906 1.00 0.00 O ATOM 306 CB GLU A 539 65.441 -13.400 -8.823 1.00 0.00 C ATOM 307 CG GLU A 539 64.860 -14.803 -9.016 1.00 0.00 C ATOM 308 CD GLU A 539 63.337 -14.741 -9.006 1.00 0.00 C ATOM 309 OE1 GLU A 539 62.776 -14.601 -7.931 1.00 0.00 O ATOM 310 OE2 GLU A 539 62.753 -14.835 -10.072 1.00 0.00 O ATOM 0 H GLU A 539 66.833 -14.515 -7.101 1.00 0.00 H new ATOM 0 HA GLU A 539 67.248 -13.930 -9.860 1.00 0.00 H new ATOM 0 HB2 GLU A 539 65.141 -13.001 -7.854 1.00 0.00 H new ATOM 0 HB3 GLU A 539 65.047 -12.724 -9.582 1.00 0.00 H new ATOM 0 HG2 GLU A 539 65.209 -15.224 -9.959 1.00 0.00 H new ATOM 0 HG3 GLU A 539 65.211 -15.463 -8.223 1.00 0.00 H new ATOM 317 N VAL A 540 67.695 -11.513 -7.664 1.00 0.00 N ATOM 318 CA VAL A 540 68.243 -10.168 -7.493 1.00 0.00 C ATOM 319 C VAL A 540 69.700 -10.129 -7.955 1.00 0.00 C ATOM 320 O VAL A 540 70.113 -9.202 -8.653 1.00 0.00 O ATOM 321 CB VAL A 540 68.149 -9.745 -6.018 1.00 0.00 C ATOM 322 CG1 VAL A 540 68.600 -8.291 -5.858 1.00 0.00 C ATOM 323 CG2 VAL A 540 66.701 -9.878 -5.534 1.00 0.00 C ATOM 0 H VAL A 540 67.447 -11.983 -6.794 1.00 0.00 H new ATOM 0 HA VAL A 540 67.663 -9.473 -8.100 1.00 0.00 H new ATOM 0 HB VAL A 540 68.797 -10.391 -5.425 1.00 0.00 H new ATOM 0 HG11 VAL A 540 68.530 -8.001 -4.810 1.00 0.00 H new ATOM 0 HG12 VAL A 540 69.632 -8.191 -6.193 1.00 0.00 H new ATOM 0 HG13 VAL A 540 67.960 -7.643 -6.457 1.00 0.00 H new ATOM 0 HG21 VAL A 540 66.638 -9.577 -4.488 1.00 0.00 H new ATOM 0 HG22 VAL A 540 66.056 -9.237 -6.135 1.00 0.00 H new ATOM 0 HG23 VAL A 540 66.378 -10.914 -5.634 1.00 0.00 H new ATOM 333 N ALA A 541 70.467 -11.151 -7.578 1.00 0.00 N ATOM 334 CA ALA A 541 71.878 -11.228 -7.962 1.00 0.00 C ATOM 335 C ALA A 541 72.021 -11.172 -9.483 1.00 0.00 C ATOM 336 O ALA A 541 72.847 -10.432 -10.019 1.00 0.00 O ATOM 337 CB ALA A 541 72.488 -12.532 -7.438 1.00 0.00 C ATOM 0 H ALA A 541 70.139 -11.933 -7.011 1.00 0.00 H new ATOM 0 HA ALA A 541 72.404 -10.379 -7.526 1.00 0.00 H new ATOM 0 HB1 ALA A 541 73.538 -12.584 -7.726 1.00 0.00 H new ATOM 0 HB2 ALA A 541 72.408 -12.560 -6.351 1.00 0.00 H new ATOM 0 HB3 ALA A 541 71.952 -13.381 -7.863 1.00 0.00 H new ATOM 343 N ALA A 542 71.153 -11.913 -10.166 1.00 0.00 N ATOM 344 CA ALA A 542 71.206 -12.002 -11.626 1.00 0.00 C ATOM 345 C ALA A 542 70.996 -10.637 -12.282 1.00 0.00 C ATOM 346 O ALA A 542 71.700 -10.288 -13.231 1.00 0.00 O ATOM 347 CB ALA A 542 70.142 -12.979 -12.131 1.00 0.00 C ATOM 0 H ALA A 542 70.407 -12.459 -9.736 1.00 0.00 H new ATOM 0 HA ALA A 542 72.198 -12.362 -11.898 1.00 0.00 H new ATOM 0 HB1 ALA A 542 70.189 -13.038 -13.218 1.00 0.00 H new ATOM 0 HB2 ALA A 542 70.323 -13.966 -11.705 1.00 0.00 H new ATOM 0 HB3 ALA A 542 69.155 -12.629 -11.829 1.00 0.00 H new ATOM 353 N ILE A 543 70.034 -9.867 -11.771 1.00 0.00 N ATOM 354 CA ILE A 543 69.702 -8.573 -12.374 1.00 0.00 C ATOM 355 C ILE A 543 70.855 -7.580 -12.210 1.00 0.00 C ATOM 356 O ILE A 543 71.234 -6.909 -13.170 1.00 0.00 O ATOM 357 CB ILE A 543 68.422 -8.001 -11.741 1.00 0.00 C ATOM 358 CG1 ILE A 543 67.281 -9.014 -11.906 1.00 0.00 C ATOM 359 CG2 ILE A 543 68.032 -6.679 -12.431 1.00 0.00 C ATOM 360 CD1 ILE A 543 66.077 -8.573 -11.070 1.00 0.00 C ATOM 0 H ILE A 543 69.477 -10.111 -10.952 1.00 0.00 H new ATOM 0 HA ILE A 543 69.533 -8.731 -13.439 1.00 0.00 H new ATOM 0 HB ILE A 543 68.602 -7.810 -10.683 1.00 0.00 H new ATOM 0 HG12 ILE A 543 66.999 -9.091 -12.956 1.00 0.00 H new ATOM 0 HG13 ILE A 543 67.612 -10.004 -11.591 1.00 0.00 H new ATOM 0 HG21 ILE A 543 67.125 -6.284 -11.974 1.00 0.00 H new ATOM 0 HG22 ILE A 543 68.840 -5.957 -12.316 1.00 0.00 H new ATOM 0 HG23 ILE A 543 67.855 -6.860 -13.491 1.00 0.00 H new ATOM 0 HD11 ILE A 543 65.268 -9.294 -11.189 1.00 0.00 H new ATOM 0 HD12 ILE A 543 66.364 -8.519 -10.020 1.00 0.00 H new ATOM 0 HD13 ILE A 543 65.741 -7.592 -11.405 1.00 0.00 H new ATOM 372 N MET A 544 71.403 -7.477 -10.998 1.00 0.00 N ATOM 373 CA MET A 544 72.471 -6.505 -10.734 1.00 0.00 C ATOM 374 C MET A 544 73.698 -6.775 -11.608 1.00 0.00 C ATOM 375 O MET A 544 74.440 -5.850 -11.945 1.00 0.00 O ATOM 376 CB MET A 544 72.869 -6.534 -9.256 1.00 0.00 C ATOM 377 CG MET A 544 71.831 -5.763 -8.438 1.00 0.00 C ATOM 378 SD MET A 544 72.438 -5.535 -6.748 1.00 0.00 S ATOM 379 CE MET A 544 70.938 -4.782 -6.070 1.00 0.00 C ATOM 0 H MET A 544 71.132 -8.043 -10.194 1.00 0.00 H new ATOM 0 HA MET A 544 72.086 -5.516 -10.981 1.00 0.00 H new ATOM 0 HB2 MET A 544 72.934 -7.564 -8.905 1.00 0.00 H new ATOM 0 HB3 MET A 544 73.856 -6.090 -9.124 1.00 0.00 H new ATOM 0 HG2 MET A 544 71.636 -4.795 -8.899 1.00 0.00 H new ATOM 0 HG3 MET A 544 70.886 -6.306 -8.426 1.00 0.00 H new ATOM 0 HE1 MET A 544 70.767 -5.157 -5.061 1.00 0.00 H new ATOM 0 HE2 MET A 544 71.056 -3.699 -6.040 1.00 0.00 H new ATOM 0 HE3 MET A 544 70.086 -5.036 -6.701 1.00 0.00 H new ATOM 389 N GLN A 545 73.906 -8.040 -11.966 1.00 0.00 N ATOM 390 CA GLN A 545 74.969 -8.397 -12.909 1.00 0.00 C ATOM 391 C GLN A 545 74.510 -8.276 -14.372 1.00 0.00 C ATOM 392 O GLN A 545 75.266 -8.603 -15.288 1.00 0.00 O ATOM 393 CB GLN A 545 75.427 -9.829 -12.646 1.00 0.00 C ATOM 394 CG GLN A 545 76.468 -9.842 -11.525 1.00 0.00 C ATOM 395 CD GLN A 545 76.976 -11.262 -11.299 1.00 0.00 C ATOM 396 OE1 GLN A 545 77.849 -11.734 -12.029 1.00 0.00 O ATOM 397 NE2 GLN A 545 76.479 -11.977 -10.327 1.00 0.00 N ATOM 0 H GLN A 545 73.360 -8.830 -11.623 1.00 0.00 H new ATOM 0 HA GLN A 545 75.791 -7.698 -12.755 1.00 0.00 H new ATOM 0 HB2 GLN A 545 74.574 -10.449 -12.370 1.00 0.00 H new ATOM 0 HB3 GLN A 545 75.851 -10.257 -13.554 1.00 0.00 H new ATOM 0 HG2 GLN A 545 77.300 -9.186 -11.783 1.00 0.00 H new ATOM 0 HG3 GLN A 545 76.029 -9.454 -10.606 1.00 0.00 H new ATOM 0 HE21 GLN A 545 75.756 -11.585 -9.723 1.00 0.00 H new ATOM 0 HE22 GLN A 545 76.813 -12.928 -10.171 1.00 0.00 H new ATOM 406 N ASP A 546 73.282 -7.808 -14.585 1.00 0.00 N ATOM 407 CA ASP A 546 72.715 -7.703 -15.930 1.00 0.00 C ATOM 408 C ASP A 546 72.251 -6.258 -16.184 1.00 0.00 C ATOM 409 O ASP A 546 71.504 -5.697 -15.383 1.00 0.00 O ATOM 410 CB ASP A 546 71.518 -8.662 -16.044 1.00 0.00 C ATOM 411 CG ASP A 546 71.343 -9.180 -17.475 1.00 0.00 C ATOM 412 OD1 ASP A 546 72.223 -8.961 -18.292 1.00 0.00 O ATOM 413 OD2 ASP A 546 70.321 -9.795 -17.733 1.00 0.00 O ATOM 0 H ASP A 546 72.658 -7.494 -13.842 1.00 0.00 H new ATOM 0 HA ASP A 546 73.469 -7.969 -16.671 1.00 0.00 H new ATOM 0 HB2 ASP A 546 71.660 -9.504 -15.367 1.00 0.00 H new ATOM 0 HB3 ASP A 546 70.609 -8.149 -15.729 1.00 0.00 H new ATOM 418 N PRO A 547 72.663 -5.655 -17.278 1.00 0.00 N ATOM 419 CA PRO A 547 72.615 -4.167 -17.432 1.00 0.00 C ATOM 420 C PRO A 547 71.195 -3.615 -17.618 1.00 0.00 C ATOM 421 O PRO A 547 70.976 -2.409 -17.492 1.00 0.00 O ATOM 422 CB PRO A 547 73.470 -3.915 -18.669 1.00 0.00 C ATOM 423 CG PRO A 547 73.283 -5.125 -19.516 1.00 0.00 C ATOM 424 CD PRO A 547 73.016 -6.294 -18.563 1.00 0.00 C ATOM 0 HA PRO A 547 72.974 -3.660 -16.536 1.00 0.00 H new ATOM 0 HB2 PRO A 547 73.152 -3.013 -19.192 1.00 0.00 H new ATOM 0 HB3 PRO A 547 74.518 -3.777 -18.404 1.00 0.00 H new ATOM 0 HG2 PRO A 547 72.449 -4.990 -20.205 1.00 0.00 H new ATOM 0 HG3 PRO A 547 74.170 -5.314 -20.121 1.00 0.00 H new ATOM 0 HD2 PRO A 547 72.206 -6.925 -18.927 1.00 0.00 H new ATOM 0 HD3 PRO A 547 73.895 -6.931 -18.461 1.00 0.00 H new ATOM 432 N VAL A 548 70.230 -4.497 -17.901 1.00 0.00 N ATOM 433 CA VAL A 548 68.911 -4.058 -18.370 1.00 0.00 C ATOM 434 C VAL A 548 68.259 -3.106 -17.366 1.00 0.00 C ATOM 435 O VAL A 548 67.947 -1.962 -17.701 1.00 0.00 O ATOM 436 CB VAL A 548 68.002 -5.279 -18.596 1.00 0.00 C ATOM 437 CG1 VAL A 548 66.610 -4.834 -19.070 1.00 0.00 C ATOM 438 CG2 VAL A 548 68.629 -6.185 -19.657 1.00 0.00 C ATOM 0 H VAL A 548 70.335 -5.508 -17.815 1.00 0.00 H new ATOM 0 HA VAL A 548 69.045 -3.524 -19.311 1.00 0.00 H new ATOM 0 HB VAL A 548 67.898 -5.819 -17.655 1.00 0.00 H new ATOM 0 HG11 VAL A 548 65.981 -5.711 -19.225 1.00 0.00 H new ATOM 0 HG12 VAL A 548 66.157 -4.191 -18.315 1.00 0.00 H new ATOM 0 HG13 VAL A 548 66.703 -4.284 -20.007 1.00 0.00 H new ATOM 0 HG21 VAL A 548 67.988 -7.052 -19.820 1.00 0.00 H new ATOM 0 HG22 VAL A 548 68.736 -5.632 -20.590 1.00 0.00 H new ATOM 0 HG23 VAL A 548 69.610 -6.518 -19.318 1.00 0.00 H new ATOM 448 N MET A 549 68.119 -3.556 -16.126 1.00 0.00 N ATOM 449 CA MET A 549 67.325 -2.804 -15.157 1.00 0.00 C ATOM 450 C MET A 549 68.012 -1.495 -14.778 1.00 0.00 C ATOM 451 O MET A 549 67.342 -0.505 -14.484 1.00 0.00 O ATOM 452 CB MET A 549 67.042 -3.637 -13.902 1.00 0.00 C ATOM 453 CG MET A 549 65.732 -4.408 -14.100 1.00 0.00 C ATOM 454 SD MET A 549 65.215 -5.160 -12.537 1.00 0.00 S ATOM 455 CE MET A 549 64.904 -3.621 -11.644 1.00 0.00 C ATOM 0 H MET A 549 68.533 -4.418 -15.771 1.00 0.00 H new ATOM 0 HA MET A 549 66.373 -2.568 -15.632 1.00 0.00 H new ATOM 0 HB2 MET A 549 67.863 -4.330 -13.717 1.00 0.00 H new ATOM 0 HB3 MET A 549 66.969 -2.989 -13.029 1.00 0.00 H new ATOM 0 HG2 MET A 549 64.956 -3.735 -14.464 1.00 0.00 H new ATOM 0 HG3 MET A 549 65.866 -5.180 -14.858 1.00 0.00 H new ATOM 0 HE1 MET A 549 64.265 -3.822 -10.784 1.00 0.00 H new ATOM 0 HE2 MET A 549 65.850 -3.201 -11.303 1.00 0.00 H new ATOM 0 HE3 MET A 549 64.409 -2.910 -12.306 1.00 0.00 H new ATOM 465 N GLN A 550 69.346 -1.479 -14.819 1.00 0.00 N ATOM 466 CA GLN A 550 70.096 -0.249 -14.555 1.00 0.00 C ATOM 467 C GLN A 550 69.716 0.841 -15.560 1.00 0.00 C ATOM 468 O GLN A 550 69.451 1.982 -15.181 1.00 0.00 O ATOM 469 CB GLN A 550 71.599 -0.523 -14.648 1.00 0.00 C ATOM 470 CG GLN A 550 72.007 -1.508 -13.552 1.00 0.00 C ATOM 471 CD GLN A 550 73.515 -1.737 -13.589 1.00 0.00 C ATOM 472 OE1 GLN A 550 74.279 -0.812 -13.866 1.00 0.00 O ATOM 473 NE2 GLN A 550 73.992 -2.922 -13.325 1.00 0.00 N ATOM 0 H GLN A 550 69.923 -2.293 -15.030 1.00 0.00 H new ATOM 0 HA GLN A 550 69.848 0.094 -13.551 1.00 0.00 H new ATOM 0 HB2 GLN A 550 71.845 -0.931 -15.628 1.00 0.00 H new ATOM 0 HB3 GLN A 550 72.156 0.408 -14.541 1.00 0.00 H new ATOM 0 HG2 GLN A 550 71.714 -1.121 -12.576 1.00 0.00 H new ATOM 0 HG3 GLN A 550 71.484 -2.454 -13.689 1.00 0.00 H new ATOM 0 HE21 GLN A 550 73.358 -3.687 -13.096 1.00 0.00 H new ATOM 0 HE22 GLN A 550 74.999 -3.083 -13.348 1.00 0.00 H new ATOM 482 N SER A 551 69.654 0.465 -16.838 1.00 0.00 N ATOM 483 CA SER A 551 69.291 1.409 -17.896 1.00 0.00 C ATOM 484 C SER A 551 67.869 1.940 -17.706 1.00 0.00 C ATOM 485 O SER A 551 67.618 3.128 -17.903 1.00 0.00 O ATOM 486 CB SER A 551 69.406 0.735 -19.265 1.00 0.00 C ATOM 487 OG SER A 551 69.215 1.707 -20.284 1.00 0.00 O ATOM 0 H SER A 551 69.849 -0.481 -17.165 1.00 0.00 H new ATOM 0 HA SER A 551 69.982 2.250 -17.842 1.00 0.00 H new ATOM 0 HB2 SER A 551 70.385 0.267 -19.372 1.00 0.00 H new ATOM 0 HB3 SER A 551 68.662 -0.056 -19.357 1.00 0.00 H new ATOM 0 HG SER A 551 69.290 1.279 -21.162 1.00 0.00 H new ATOM 493 N ILE A 552 66.947 1.065 -17.299 1.00 0.00 N ATOM 494 CA ILE A 552 65.546 1.462 -17.118 1.00 0.00 C ATOM 495 C ILE A 552 65.429 2.537 -16.033 1.00 0.00 C ATOM 496 O ILE A 552 64.761 3.552 -16.224 1.00 0.00 O ATOM 497 CB ILE A 552 64.685 0.242 -16.741 1.00 0.00 C ATOM 498 CG1 ILE A 552 64.886 -0.869 -17.779 1.00 0.00 C ATOM 499 CG2 ILE A 552 63.200 0.639 -16.713 1.00 0.00 C ATOM 500 CD1 ILE A 552 64.234 -2.163 -17.284 1.00 0.00 C ATOM 0 H ILE A 552 67.141 0.086 -17.090 1.00 0.00 H new ATOM 0 HA ILE A 552 65.183 1.872 -18.061 1.00 0.00 H new ATOM 0 HB ILE A 552 64.986 -0.114 -15.756 1.00 0.00 H new ATOM 0 HG12 ILE A 552 64.449 -0.572 -18.733 1.00 0.00 H new ATOM 0 HG13 ILE A 552 65.950 -1.030 -17.952 1.00 0.00 H new ATOM 0 HG21 ILE A 552 62.596 -0.228 -16.446 1.00 0.00 H new ATOM 0 HG22 ILE A 552 63.048 1.428 -15.976 1.00 0.00 H new ATOM 0 HG23 ILE A 552 62.901 1.000 -17.697 1.00 0.00 H new ATOM 0 HD11 ILE A 552 64.379 -2.950 -18.024 1.00 0.00 H new ATOM 0 HD12 ILE A 552 64.691 -2.463 -16.341 1.00 0.00 H new ATOM 0 HD13 ILE A 552 63.167 -1.998 -17.134 1.00 0.00 H new ATOM 512 N LEU A 553 66.112 2.320 -14.909 1.00 0.00 N ATOM 513 CA LEU A 553 66.074 3.273 -13.796 1.00 0.00 C ATOM 514 C LEU A 553 66.609 4.641 -14.222 1.00 0.00 C ATOM 515 O LEU A 553 65.983 5.672 -13.965 1.00 0.00 O ATOM 516 CB LEU A 553 66.907 2.744 -12.624 1.00 0.00 C ATOM 517 CG LEU A 553 66.316 1.422 -12.128 1.00 0.00 C ATOM 518 CD1 LEU A 553 67.281 0.773 -11.134 1.00 0.00 C ATOM 519 CD2 LEU A 553 64.977 1.687 -11.432 1.00 0.00 C ATOM 0 H LEU A 553 66.695 1.499 -14.744 1.00 0.00 H new ATOM 0 HA LEU A 553 65.035 3.387 -13.488 1.00 0.00 H new ATOM 0 HB2 LEU A 553 67.941 2.597 -12.937 1.00 0.00 H new ATOM 0 HB3 LEU A 553 66.920 3.474 -11.815 1.00 0.00 H new ATOM 0 HG LEU A 553 66.160 0.756 -12.977 1.00 0.00 H new ATOM 0 HD11 LEU A 553 66.861 -0.168 -10.780 1.00 0.00 H new ATOM 0 HD12 LEU A 553 68.235 0.583 -11.625 1.00 0.00 H new ATOM 0 HD13 LEU A 553 67.436 1.442 -10.287 1.00 0.00 H new ATOM 0 HD21 LEU A 553 64.557 0.745 -11.079 1.00 0.00 H new ATOM 0 HD22 LEU A 553 65.133 2.354 -10.584 1.00 0.00 H new ATOM 0 HD23 LEU A 553 64.286 2.151 -12.136 1.00 0.00 H new ATOM 531 N GLN A 554 67.748 4.642 -14.918 1.00 0.00 N ATOM 532 CA GLN A 554 68.341 5.891 -15.404 1.00 0.00 C ATOM 533 C GLN A 554 67.346 6.660 -16.274 1.00 0.00 C ATOM 534 O GLN A 554 67.041 7.822 -16.004 1.00 0.00 O ATOM 535 CB GLN A 554 69.606 5.592 -16.214 1.00 0.00 C ATOM 536 CG GLN A 554 70.653 4.936 -15.311 1.00 0.00 C ATOM 537 CD GLN A 554 71.200 5.955 -14.315 1.00 0.00 C ATOM 538 OE1 GLN A 554 71.560 7.067 -14.699 1.00 0.00 O ATOM 539 NE2 GLN A 554 71.283 5.638 -13.052 1.00 0.00 N ATOM 0 H GLN A 554 68.274 3.801 -15.156 1.00 0.00 H new ATOM 0 HA GLN A 554 68.599 6.504 -14.541 1.00 0.00 H new ATOM 0 HB2 GLN A 554 69.368 4.933 -17.049 1.00 0.00 H new ATOM 0 HB3 GLN A 554 70.004 6.514 -16.639 1.00 0.00 H new ATOM 0 HG2 GLN A 554 70.209 4.096 -14.777 1.00 0.00 H new ATOM 0 HG3 GLN A 554 71.466 4.535 -15.916 1.00 0.00 H new ATOM 0 HE21 GLN A 554 70.984 4.715 -12.737 1.00 0.00 H new ATOM 0 HE22 GLN A 554 71.647 6.313 -12.380 1.00 0.00 H new ATOM 548 N GLN A 555 66.739 5.957 -17.229 1.00 0.00 N ATOM 549 CA GLN A 555 65.778 6.576 -18.143 1.00 0.00 C ATOM 550 C GLN A 555 64.597 7.174 -17.377 1.00 0.00 C ATOM 551 O GLN A 555 64.072 8.224 -17.753 1.00 0.00 O ATOM 552 CB GLN A 555 65.266 5.533 -19.140 1.00 0.00 C ATOM 553 CG GLN A 555 66.418 5.071 -20.033 1.00 0.00 C ATOM 554 CD GLN A 555 66.792 6.176 -21.017 1.00 0.00 C ATOM 555 OE1 GLN A 555 67.460 7.140 -20.644 1.00 0.00 O ATOM 556 NE2 GLN A 555 66.399 6.091 -22.259 1.00 0.00 N ATOM 0 H GLN A 555 66.894 4.962 -17.390 1.00 0.00 H new ATOM 0 HA GLN A 555 66.285 7.380 -18.677 1.00 0.00 H new ATOM 0 HB2 GLN A 555 64.842 4.682 -18.607 1.00 0.00 H new ATOM 0 HB3 GLN A 555 64.468 5.958 -19.749 1.00 0.00 H new ATOM 0 HG2 GLN A 555 67.281 4.810 -19.421 1.00 0.00 H new ATOM 0 HG3 GLN A 555 66.129 4.171 -20.576 1.00 0.00 H new ATOM 0 HE21 GLN A 555 65.845 5.291 -22.565 1.00 0.00 H new ATOM 0 HE22 GLN A 555 66.645 6.825 -22.923 1.00 0.00 H new ATOM 565 N ALA A 556 64.185 6.498 -16.302 1.00 0.00 N ATOM 566 CA ALA A 556 63.071 6.970 -15.480 1.00 0.00 C ATOM 567 C ALA A 556 63.390 8.318 -14.835 1.00 0.00 C ATOM 568 O ALA A 556 62.505 9.161 -14.682 1.00 0.00 O ATOM 569 CB ALA A 556 62.755 5.947 -14.387 1.00 0.00 C ATOM 0 H ALA A 556 64.605 5.625 -15.982 1.00 0.00 H new ATOM 0 HA ALA A 556 62.206 7.094 -16.131 1.00 0.00 H new ATOM 0 HB1 ALA A 556 61.924 6.308 -13.780 1.00 0.00 H new ATOM 0 HB2 ALA A 556 62.483 4.996 -14.846 1.00 0.00 H new ATOM 0 HB3 ALA A 556 63.632 5.807 -13.755 1.00 0.00 H new ATOM 575 N GLN A 557 64.655 8.515 -14.460 1.00 0.00 N ATOM 576 CA GLN A 557 65.074 9.772 -13.839 1.00 0.00 C ATOM 577 C GLN A 557 64.976 10.916 -14.844 1.00 0.00 C ATOM 578 O GLN A 557 64.506 12.007 -14.516 1.00 0.00 O ATOM 579 CB GLN A 557 66.517 9.655 -13.343 1.00 0.00 C ATOM 580 CG GLN A 557 66.595 8.592 -12.245 1.00 0.00 C ATOM 581 CD GLN A 557 68.016 8.511 -11.696 1.00 0.00 C ATOM 582 OE1 GLN A 557 68.697 9.529 -11.578 1.00 0.00 O ATOM 583 NE2 GLN A 557 68.506 7.351 -11.350 1.00 0.00 N ATOM 0 H GLN A 557 65.400 7.828 -14.574 1.00 0.00 H new ATOM 0 HA GLN A 557 64.415 9.978 -12.995 1.00 0.00 H new ATOM 0 HB2 GLN A 557 67.176 9.389 -14.169 1.00 0.00 H new ATOM 0 HB3 GLN A 557 66.860 10.616 -12.959 1.00 0.00 H new ATOM 0 HG2 GLN A 557 65.900 8.836 -11.442 1.00 0.00 H new ATOM 0 HG3 GLN A 557 66.295 7.623 -12.644 1.00 0.00 H new ATOM 0 HE21 GLN A 557 67.940 6.508 -11.449 1.00 0.00 H new ATOM 0 HE22 GLN A 557 69.455 7.288 -10.981 1.00 0.00 H new ATOM 592 N GLN A 558 65.427 10.652 -16.070 1.00 0.00 N ATOM 593 CA GLN A 558 65.334 11.637 -17.146 1.00 0.00 C ATOM 594 C GLN A 558 63.876 11.870 -17.541 1.00 0.00 C ATOM 595 O GLN A 558 63.492 12.989 -17.886 1.00 0.00 O ATOM 596 CB GLN A 558 66.123 11.158 -18.366 1.00 0.00 C ATOM 597 CG GLN A 558 67.608 11.067 -18.010 1.00 0.00 C ATOM 598 CD GLN A 558 68.416 10.656 -19.237 1.00 0.00 C ATOM 599 OE1 GLN A 558 68.100 11.062 -20.356 1.00 0.00 O ATOM 600 NE2 GLN A 558 69.447 9.867 -19.094 1.00 0.00 N ATOM 0 H GLN A 558 65.858 9.769 -16.342 1.00 0.00 H new ATOM 0 HA GLN A 558 65.755 12.576 -16.786 1.00 0.00 H new ATOM 0 HB2 GLN A 558 65.756 10.184 -18.691 1.00 0.00 H new ATOM 0 HB3 GLN A 558 65.979 11.847 -19.199 1.00 0.00 H new ATOM 0 HG2 GLN A 558 67.961 12.029 -17.638 1.00 0.00 H new ATOM 0 HG3 GLN A 558 67.754 10.342 -17.209 1.00 0.00 H new ATOM 0 HE21 GLN A 558 69.708 9.531 -18.167 1.00 0.00 H new ATOM 0 HE22 GLN A 558 69.991 9.586 -19.910 1.00 0.00 H new ATOM 609 N ASN A 559 63.072 10.808 -17.487 1.00 0.00 N ATOM 610 CA ASN A 559 61.658 10.906 -17.839 1.00 0.00 C ATOM 611 C ASN A 559 60.877 9.730 -17.241 1.00 0.00 C ATOM 612 O ASN A 559 61.206 8.573 -17.506 1.00 0.00 O ATOM 613 CB ASN A 559 61.501 10.904 -19.361 1.00 0.00 C ATOM 614 CG ASN A 559 60.190 11.582 -19.751 1.00 0.00 C ATOM 615 OD1 ASN A 559 59.120 10.989 -19.619 1.00 0.00 O ATOM 616 ND2 ASN A 559 60.212 12.797 -20.228 1.00 0.00 N ATOM 0 H ASN A 559 63.375 9.876 -17.204 1.00 0.00 H new ATOM 0 HA ASN A 559 61.261 11.837 -17.434 1.00 0.00 H new ATOM 0 HB2 ASN A 559 62.340 11.424 -19.822 1.00 0.00 H new ATOM 0 HB3 ASN A 559 61.516 9.880 -19.735 1.00 0.00 H new ATOM 0 HD21 ASN A 559 59.341 13.257 -20.492 1.00 0.00 H new ATOM 0 HD22 ASN A 559 61.100 13.286 -20.336 1.00 0.00 H new ATOM 623 N PRO A 560 59.828 9.995 -16.488 1.00 0.00 N ATOM 624 CA PRO A 560 59.162 8.933 -15.664 1.00 0.00 C ATOM 625 C PRO A 560 58.462 7.865 -16.511 1.00 0.00 C ATOM 626 O PRO A 560 58.112 6.798 -16.002 1.00 0.00 O ATOM 627 CB PRO A 560 58.149 9.706 -14.817 1.00 0.00 C ATOM 628 CG PRO A 560 57.830 10.928 -15.607 1.00 0.00 C ATOM 629 CD PRO A 560 59.089 11.273 -16.401 1.00 0.00 C ATOM 0 HA PRO A 560 59.889 8.377 -15.073 1.00 0.00 H new ATOM 0 HB2 PRO A 560 57.254 9.111 -14.633 1.00 0.00 H new ATOM 0 HB3 PRO A 560 58.566 9.964 -13.843 1.00 0.00 H new ATOM 0 HG2 PRO A 560 56.987 10.749 -16.275 1.00 0.00 H new ATOM 0 HG3 PRO A 560 57.548 11.751 -14.951 1.00 0.00 H new ATOM 0 HD2 PRO A 560 58.842 11.658 -17.390 1.00 0.00 H new ATOM 0 HD3 PRO A 560 59.678 12.040 -15.899 1.00 0.00 H new ATOM 637 N ALA A 561 58.261 8.152 -17.800 1.00 0.00 N ATOM 638 CA ALA A 561 57.542 7.231 -18.680 1.00 0.00 C ATOM 639 C ALA A 561 58.376 5.985 -19.000 1.00 0.00 C ATOM 640 O ALA A 561 57.825 4.938 -19.348 1.00 0.00 O ATOM 641 CB ALA A 561 57.177 7.942 -19.985 1.00 0.00 C ATOM 0 H ALA A 561 58.583 9.007 -18.253 1.00 0.00 H new ATOM 0 HA ALA A 561 56.639 6.912 -18.159 1.00 0.00 H new ATOM 0 HB1 ALA A 561 56.642 7.252 -20.638 1.00 0.00 H new ATOM 0 HB2 ALA A 561 56.543 8.801 -19.766 1.00 0.00 H new ATOM 0 HB3 ALA A 561 58.086 8.280 -20.482 1.00 0.00 H new ATOM 647 N ALA A 562 59.701 6.089 -18.858 1.00 0.00 N ATOM 648 CA ALA A 562 60.601 5.051 -19.364 1.00 0.00 C ATOM 649 C ALA A 562 60.366 3.718 -18.655 1.00 0.00 C ATOM 650 O ALA A 562 60.128 2.694 -19.302 1.00 0.00 O ATOM 651 CB ALA A 562 62.055 5.481 -19.169 1.00 0.00 C ATOM 0 H ALA A 562 60.169 6.872 -18.402 1.00 0.00 H new ATOM 0 HA ALA A 562 60.394 4.917 -20.426 1.00 0.00 H new ATOM 0 HB1 ALA A 562 62.718 4.703 -19.548 1.00 0.00 H new ATOM 0 HB2 ALA A 562 62.236 6.409 -19.712 1.00 0.00 H new ATOM 0 HB3 ALA A 562 62.249 5.638 -18.108 1.00 0.00 H new ATOM 657 N LEU A 563 60.386 3.735 -17.324 1.00 0.00 N ATOM 658 CA LEU A 563 60.225 2.496 -16.567 1.00 0.00 C ATOM 659 C LEU A 563 58.810 1.937 -16.723 1.00 0.00 C ATOM 660 O LEU A 563 58.608 0.725 -16.658 1.00 0.00 O ATOM 661 CB LEU A 563 60.593 2.682 -15.079 1.00 0.00 C ATOM 662 CG LEU A 563 59.933 3.923 -14.450 1.00 0.00 C ATOM 663 CD1 LEU A 563 58.420 3.719 -14.291 1.00 0.00 C ATOM 664 CD2 LEU A 563 60.567 4.165 -13.076 1.00 0.00 C ATOM 0 H LEU A 563 60.509 4.574 -16.757 1.00 0.00 H new ATOM 0 HA LEU A 563 60.922 1.767 -16.982 1.00 0.00 H new ATOM 0 HB2 LEU A 563 60.292 1.795 -14.522 1.00 0.00 H new ATOM 0 HB3 LEU A 563 61.676 2.765 -14.985 1.00 0.00 H new ATOM 0 HG LEU A 563 60.091 4.783 -15.101 1.00 0.00 H new ATOM 0 HD11 LEU A 563 57.978 4.610 -13.845 1.00 0.00 H new ATOM 0 HD12 LEU A 563 57.972 3.542 -15.269 1.00 0.00 H new ATOM 0 HD13 LEU A 563 58.234 2.860 -13.646 1.00 0.00 H new ATOM 0 HD21 LEU A 563 60.112 5.041 -12.614 1.00 0.00 H new ATOM 0 HD22 LEU A 563 60.403 3.294 -12.441 1.00 0.00 H new ATOM 0 HD23 LEU A 563 61.638 4.332 -13.194 1.00 0.00 H new ATOM 676 N GLN A 564 57.831 2.820 -16.950 1.00 0.00 N ATOM 677 CA GLN A 564 56.442 2.387 -17.120 1.00 0.00 C ATOM 678 C GLN A 564 56.309 1.445 -18.316 1.00 0.00 C ATOM 679 O GLN A 564 55.925 0.285 -18.158 1.00 0.00 O ATOM 680 CB GLN A 564 55.537 3.606 -17.325 1.00 0.00 C ATOM 681 CG GLN A 564 54.071 3.190 -17.176 1.00 0.00 C ATOM 682 CD GLN A 564 53.751 2.930 -15.707 1.00 0.00 C ATOM 683 OE1 GLN A 564 53.812 3.845 -14.886 1.00 0.00 O ATOM 684 NE2 GLN A 564 53.411 1.729 -15.326 1.00 0.00 N ATOM 0 H GLN A 564 57.973 3.828 -17.019 1.00 0.00 H new ATOM 0 HA GLN A 564 56.138 1.853 -16.220 1.00 0.00 H new ATOM 0 HB2 GLN A 564 55.782 4.379 -16.597 1.00 0.00 H new ATOM 0 HB3 GLN A 564 55.705 4.034 -18.313 1.00 0.00 H new ATOM 0 HG2 GLN A 564 53.420 3.973 -17.566 1.00 0.00 H new ATOM 0 HG3 GLN A 564 53.877 2.293 -17.764 1.00 0.00 H new ATOM 0 HE21 GLN A 564 53.361 0.972 -16.008 1.00 0.00 H new ATOM 0 HE22 GLN A 564 53.195 1.547 -14.346 1.00 0.00 H new ATOM 693 N GLU A 565 56.795 1.887 -19.476 1.00 0.00 N ATOM 694 CA GLU A 565 56.696 1.077 -20.693 1.00 0.00 C ATOM 695 C GLU A 565 57.473 -0.234 -20.537 1.00 0.00 C ATOM 696 O GLU A 565 57.141 -1.242 -21.162 1.00 0.00 O ATOM 697 CB GLU A 565 57.227 1.859 -21.901 1.00 0.00 C ATOM 698 CG GLU A 565 58.667 2.317 -21.649 1.00 0.00 C ATOM 699 CD GLU A 565 59.318 2.736 -22.963 1.00 0.00 C ATOM 700 OE1 GLU A 565 59.214 3.902 -23.307 1.00 0.00 O ATOM 701 OE2 GLU A 565 59.908 1.885 -23.607 1.00 0.00 O ATOM 0 H GLU A 565 57.255 2.789 -19.600 1.00 0.00 H new ATOM 0 HA GLU A 565 55.645 0.841 -20.858 1.00 0.00 H new ATOM 0 HB2 GLU A 565 57.188 1.234 -22.793 1.00 0.00 H new ATOM 0 HB3 GLU A 565 56.591 2.724 -22.090 1.00 0.00 H new ATOM 0 HG2 GLU A 565 58.675 3.151 -20.947 1.00 0.00 H new ATOM 0 HG3 GLU A 565 59.239 1.510 -21.191 1.00 0.00 H new ATOM 708 N HIS A 566 58.511 -0.203 -19.701 1.00 0.00 N ATOM 709 CA HIS A 566 59.276 -1.408 -19.388 1.00 0.00 C ATOM 710 C HIS A 566 58.428 -2.410 -18.601 1.00 0.00 C ATOM 711 O HIS A 566 58.433 -3.603 -18.902 1.00 0.00 O ATOM 712 CB HIS A 566 60.524 -1.035 -18.583 1.00 0.00 C ATOM 713 CG HIS A 566 61.677 -0.605 -19.448 1.00 0.00 C ATOM 714 ND1 HIS A 566 62.055 0.723 -19.568 1.00 0.00 N ATOM 715 CD2 HIS A 566 62.533 -1.312 -20.255 1.00 0.00 C ATOM 716 CE1 HIS A 566 63.095 0.774 -20.420 1.00 0.00 C ATOM 717 NE2 HIS A 566 63.428 -0.439 -20.869 1.00 0.00 N ATOM 0 H HIS A 566 58.840 0.640 -19.231 1.00 0.00 H new ATOM 0 HA HIS A 566 59.574 -1.878 -20.325 1.00 0.00 H new ATOM 0 HB2 HIS A 566 60.276 -0.230 -17.892 1.00 0.00 H new ATOM 0 HB3 HIS A 566 60.829 -1.890 -17.980 1.00 0.00 H new ATOM 0 HD1 HIS A 566 61.623 1.517 -19.096 1.00 0.00 H new ATOM 0 HD2 HIS A 566 62.515 -2.383 -20.393 1.00 0.00 H new ATOM 0 HE1 HIS A 566 63.599 1.685 -20.706 1.00 0.00 H new ATOM 725 N MET A 567 57.682 -1.917 -17.611 1.00 0.00 N ATOM 726 CA MET A 567 56.859 -2.784 -16.764 1.00 0.00 C ATOM 727 C MET A 567 55.770 -3.486 -17.583 1.00 0.00 C ATOM 728 O MET A 567 55.362 -4.601 -17.254 1.00 0.00 O ATOM 729 CB MET A 567 56.206 -1.953 -15.652 1.00 0.00 C ATOM 730 CG MET A 567 55.599 -2.883 -14.599 1.00 0.00 C ATOM 731 SD MET A 567 54.778 -1.894 -13.323 1.00 0.00 S ATOM 732 CE MET A 567 56.251 -1.033 -12.720 1.00 0.00 C ATOM 0 H MET A 567 57.630 -0.926 -17.376 1.00 0.00 H new ATOM 0 HA MET A 567 57.506 -3.545 -16.327 1.00 0.00 H new ATOM 0 HB2 MET A 567 56.947 -1.300 -15.190 1.00 0.00 H new ATOM 0 HB3 MET A 567 55.432 -1.310 -16.072 1.00 0.00 H new ATOM 0 HG2 MET A 567 54.884 -3.561 -15.065 1.00 0.00 H new ATOM 0 HG3 MET A 567 56.378 -3.500 -14.151 1.00 0.00 H new ATOM 0 HE1 MET A 567 56.093 -0.721 -11.688 1.00 0.00 H new ATOM 0 HE2 MET A 567 57.110 -1.703 -12.769 1.00 0.00 H new ATOM 0 HE3 MET A 567 56.439 -0.156 -13.340 1.00 0.00 H new ATOM 742 N LYS A 568 55.313 -2.831 -18.652 1.00 0.00 N ATOM 743 CA LYS A 568 54.285 -3.415 -19.512 1.00 0.00 C ATOM 744 C LYS A 568 54.841 -4.627 -20.261 1.00 0.00 C ATOM 745 O LYS A 568 54.127 -5.600 -20.505 1.00 0.00 O ATOM 746 CB LYS A 568 53.784 -2.373 -20.515 1.00 0.00 C ATOM 747 CG LYS A 568 53.078 -1.241 -19.766 1.00 0.00 C ATOM 748 CD LYS A 568 52.560 -0.209 -20.770 1.00 0.00 C ATOM 749 CE LYS A 568 51.355 -0.782 -21.516 1.00 0.00 C ATOM 750 NZ LYS A 568 50.567 0.331 -22.118 1.00 0.00 N ATOM 0 H LYS A 568 55.635 -1.907 -18.940 1.00 0.00 H new ATOM 0 HA LYS A 568 53.454 -3.739 -18.886 1.00 0.00 H new ATOM 0 HB2 LYS A 568 54.620 -1.976 -21.091 1.00 0.00 H new ATOM 0 HB3 LYS A 568 53.099 -2.836 -21.225 1.00 0.00 H new ATOM 0 HG2 LYS A 568 52.251 -1.640 -19.179 1.00 0.00 H new ATOM 0 HG3 LYS A 568 53.767 -0.769 -19.066 1.00 0.00 H new ATOM 0 HD2 LYS A 568 52.278 0.708 -20.252 1.00 0.00 H new ATOM 0 HD3 LYS A 568 53.347 0.053 -21.477 1.00 0.00 H new ATOM 0 HE2 LYS A 568 51.689 -1.468 -22.295 1.00 0.00 H new ATOM 0 HE3 LYS A 568 50.730 -1.356 -20.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 49.747 -0.059 -22.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 50.237 0.969 -21.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 51.166 0.860 -22.783 1.00 0.00 H new ATOM 764 N ASN A 569 56.122 -4.553 -20.624 1.00 0.00 N ATOM 765 CA ASN A 569 56.800 -5.669 -21.286 1.00 0.00 C ATOM 766 C ASN A 569 56.949 -6.854 -20.320 1.00 0.00 C ATOM 767 O ASN A 569 57.291 -6.657 -19.152 1.00 0.00 O ATOM 768 CB ASN A 569 58.185 -5.215 -21.766 1.00 0.00 C ATOM 769 CG ASN A 569 58.595 -5.988 -23.016 1.00 0.00 C ATOM 770 OD1 ASN A 569 59.652 -6.620 -23.037 1.00 0.00 O ATOM 771 ND2 ASN A 569 57.819 -5.975 -24.065 1.00 0.00 N ATOM 0 H ASN A 569 56.710 -3.734 -20.471 1.00 0.00 H new ATOM 0 HA ASN A 569 56.203 -5.988 -22.141 1.00 0.00 H new ATOM 0 HB2 ASN A 569 58.170 -4.146 -21.980 1.00 0.00 H new ATOM 0 HB3 ASN A 569 58.920 -5.372 -20.976 1.00 0.00 H new ATOM 0 HD21 ASN A 569 58.087 -6.489 -24.904 1.00 0.00 H new ATOM 0 HD22 ASN A 569 56.944 -5.451 -24.046 1.00 0.00 H new ATOM 778 N PRO A 570 56.711 -8.071 -20.775 1.00 0.00 N ATOM 779 CA PRO A 570 56.621 -9.250 -19.856 1.00 0.00 C ATOM 780 C PRO A 570 57.976 -9.637 -19.258 1.00 0.00 C ATOM 781 O PRO A 570 58.079 -9.894 -18.057 1.00 0.00 O ATOM 782 CB PRO A 570 56.072 -10.370 -20.742 1.00 0.00 C ATOM 783 CG PRO A 570 56.473 -10.009 -22.130 1.00 0.00 C ATOM 784 CD PRO A 570 56.533 -8.483 -22.184 1.00 0.00 C ATOM 0 HA PRO A 570 55.990 -9.037 -18.993 1.00 0.00 H new ATOM 0 HB2 PRO A 570 56.484 -11.337 -20.453 1.00 0.00 H new ATOM 0 HB3 PRO A 570 54.988 -10.446 -20.653 1.00 0.00 H new ATOM 0 HG2 PRO A 570 57.441 -10.444 -22.379 1.00 0.00 H new ATOM 0 HG3 PRO A 570 55.755 -10.394 -22.854 1.00 0.00 H new ATOM 0 HD2 PRO A 570 57.360 -8.140 -22.806 1.00 0.00 H new ATOM 0 HD3 PRO A 570 55.620 -8.064 -22.608 1.00 0.00 H new ATOM 792 N GLU A 571 59.020 -9.635 -20.088 1.00 0.00 N ATOM 793 CA GLU A 571 60.342 -10.065 -19.635 1.00 0.00 C ATOM 794 C GLU A 571 60.893 -9.071 -18.617 1.00 0.00 C ATOM 795 O GLU A 571 61.421 -9.458 -17.568 1.00 0.00 O ATOM 796 CB GLU A 571 61.300 -10.177 -20.826 1.00 0.00 C ATOM 797 CG GLU A 571 62.585 -10.888 -20.391 1.00 0.00 C ATOM 798 CD GLU A 571 63.597 -10.886 -21.532 1.00 0.00 C ATOM 799 OE1 GLU A 571 63.725 -9.862 -22.185 1.00 0.00 O ATOM 800 OE2 GLU A 571 64.229 -11.908 -21.738 1.00 0.00 O ATOM 0 H GLU A 571 58.977 -9.344 -21.065 1.00 0.00 H new ATOM 0 HA GLU A 571 60.250 -11.044 -19.164 1.00 0.00 H new ATOM 0 HB2 GLU A 571 60.824 -10.729 -21.637 1.00 0.00 H new ATOM 0 HB3 GLU A 571 61.535 -9.185 -21.211 1.00 0.00 H new ATOM 0 HG2 GLU A 571 63.008 -10.390 -19.519 1.00 0.00 H new ATOM 0 HG3 GLU A 571 62.361 -11.913 -20.095 1.00 0.00 H new ATOM 807 N VAL A 572 60.676 -7.787 -18.884 1.00 0.00 N ATOM 808 CA VAL A 572 61.107 -6.753 -17.958 1.00 0.00 C ATOM 809 C VAL A 572 60.201 -6.756 -16.728 1.00 0.00 C ATOM 810 O VAL A 572 60.667 -6.535 -15.619 1.00 0.00 O ATOM 811 CB VAL A 572 61.087 -5.379 -18.640 1.00 0.00 C ATOM 812 CG1 VAL A 572 61.579 -4.301 -17.668 1.00 0.00 C ATOM 813 CG2 VAL A 572 62.012 -5.405 -19.860 1.00 0.00 C ATOM 0 H VAL A 572 60.210 -7.443 -19.724 1.00 0.00 H new ATOM 0 HA VAL A 572 62.130 -6.960 -17.645 1.00 0.00 H new ATOM 0 HB VAL A 572 60.066 -5.151 -18.947 1.00 0.00 H new ATOM 0 HG11 VAL A 572 61.561 -3.330 -18.162 1.00 0.00 H new ATOM 0 HG12 VAL A 572 60.929 -4.275 -16.794 1.00 0.00 H new ATOM 0 HG13 VAL A 572 62.598 -4.530 -17.356 1.00 0.00 H new ATOM 0 HG21 VAL A 572 62.000 -4.430 -20.347 1.00 0.00 H new ATOM 0 HG22 VAL A 572 63.028 -5.639 -19.541 1.00 0.00 H new ATOM 0 HG23 VAL A 572 61.668 -6.165 -20.561 1.00 0.00 H new ATOM 823 N PHE A 573 58.919 -7.088 -16.919 1.00 0.00 N ATOM 824 CA PHE A 573 57.961 -7.112 -15.807 1.00 0.00 C ATOM 825 C PHE A 573 58.476 -7.988 -14.663 1.00 0.00 C ATOM 826 O PHE A 573 58.467 -7.573 -13.504 1.00 0.00 O ATOM 827 CB PHE A 573 56.612 -7.649 -16.302 1.00 0.00 C ATOM 828 CG PHE A 573 55.528 -7.664 -15.245 1.00 0.00 C ATOM 829 CD1 PHE A 573 54.978 -6.447 -14.776 1.00 0.00 C ATOM 830 CD2 PHE A 573 55.060 -8.897 -14.731 1.00 0.00 C ATOM 831 CE1 PHE A 573 53.960 -6.462 -13.792 1.00 0.00 C ATOM 832 CE2 PHE A 573 54.043 -8.914 -13.747 1.00 0.00 C ATOM 833 CZ PHE A 573 53.492 -7.696 -13.277 1.00 0.00 C ATOM 0 H PHE A 573 58.523 -7.342 -17.824 1.00 0.00 H new ATOM 0 HA PHE A 573 57.838 -6.095 -15.434 1.00 0.00 H new ATOM 0 HB2 PHE A 573 56.277 -7.041 -17.142 1.00 0.00 H new ATOM 0 HB3 PHE A 573 56.752 -8.662 -16.678 1.00 0.00 H new ATOM 0 HD1 PHE A 573 55.335 -5.506 -15.169 1.00 0.00 H new ATOM 0 HD2 PHE A 573 55.479 -9.825 -15.090 1.00 0.00 H new ATOM 0 HE1 PHE A 573 53.541 -5.533 -13.434 1.00 0.00 H new ATOM 0 HE2 PHE A 573 53.687 -9.855 -13.354 1.00 0.00 H new ATOM 0 HZ PHE A 573 52.716 -7.708 -12.526 1.00 0.00 H new ATOM 843 N LYS A 574 58.981 -9.175 -15.007 1.00 0.00 N ATOM 844 CA LYS A 574 59.571 -10.070 -14.008 1.00 0.00 C ATOM 845 C LYS A 574 60.758 -9.401 -13.307 1.00 0.00 C ATOM 846 O LYS A 574 60.814 -9.346 -12.078 1.00 0.00 O ATOM 847 CB LYS A 574 60.040 -11.362 -14.683 1.00 0.00 C ATOM 848 CG LYS A 574 60.365 -12.412 -13.616 1.00 0.00 C ATOM 849 CD LYS A 574 60.891 -13.680 -14.291 1.00 0.00 C ATOM 850 CE LYS A 574 61.072 -14.778 -13.242 1.00 0.00 C ATOM 851 NZ LYS A 574 61.216 -16.097 -13.924 1.00 0.00 N ATOM 0 H LYS A 574 58.994 -9.537 -15.961 1.00 0.00 H new ATOM 0 HA LYS A 574 58.810 -10.298 -13.262 1.00 0.00 H new ATOM 0 HB2 LYS A 574 59.265 -11.737 -15.352 1.00 0.00 H new ATOM 0 HB3 LYS A 574 60.921 -11.166 -15.294 1.00 0.00 H new ATOM 0 HG2 LYS A 574 61.109 -12.022 -12.921 1.00 0.00 H new ATOM 0 HG3 LYS A 574 59.473 -12.641 -13.033 1.00 0.00 H new ATOM 0 HD2 LYS A 574 60.195 -14.010 -15.062 1.00 0.00 H new ATOM 0 HD3 LYS A 574 61.840 -13.475 -14.786 1.00 0.00 H new ATOM 0 HE2 LYS A 574 61.953 -14.573 -12.633 1.00 0.00 H new ATOM 0 HE3 LYS A 574 60.216 -14.797 -12.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 574 61.339 -16.845 -13.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 574 60.363 -16.292 -14.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 574 62.046 -16.075 -14.550 1.00 0.00 H new ATOM 865 N LYS A 575 61.667 -8.831 -14.099 1.00 0.00 N ATOM 866 CA LYS A 575 62.901 -8.255 -13.552 1.00 0.00 C ATOM 867 C LYS A 575 62.606 -7.073 -12.621 1.00 0.00 C ATOM 868 O LYS A 575 63.076 -7.032 -11.478 1.00 0.00 O ATOM 869 CB LYS A 575 63.802 -7.789 -14.695 1.00 0.00 C ATOM 870 CG LYS A 575 64.496 -8.997 -15.327 1.00 0.00 C ATOM 871 CD LYS A 575 65.473 -8.520 -16.404 1.00 0.00 C ATOM 872 CE LYS A 575 66.093 -9.731 -17.104 1.00 0.00 C ATOM 873 NZ LYS A 575 65.088 -10.346 -18.017 1.00 0.00 N ATOM 0 H LYS A 575 61.576 -8.755 -15.112 1.00 0.00 H new ATOM 0 HA LYS A 575 63.403 -9.028 -12.971 1.00 0.00 H new ATOM 0 HB2 LYS A 575 63.212 -7.262 -15.445 1.00 0.00 H new ATOM 0 HB3 LYS A 575 64.545 -7.084 -14.322 1.00 0.00 H new ATOM 0 HG2 LYS A 575 65.029 -9.564 -14.564 1.00 0.00 H new ATOM 0 HG3 LYS A 575 63.756 -9.667 -15.764 1.00 0.00 H new ATOM 0 HD2 LYS A 575 64.954 -7.894 -17.129 1.00 0.00 H new ATOM 0 HD3 LYS A 575 66.254 -7.907 -15.955 1.00 0.00 H new ATOM 0 HE2 LYS A 575 66.974 -9.426 -17.668 1.00 0.00 H new ATOM 0 HE3 LYS A 575 66.424 -10.461 -16.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 65.039 -11.370 -17.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 64.155 -9.920 -17.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 65.367 -10.178 -19.005 1.00 0.00 H new ATOM 887 N ILE A 576 61.804 -6.126 -13.107 1.00 0.00 N ATOM 888 CA ILE A 576 61.476 -4.922 -12.334 1.00 0.00 C ATOM 889 C ILE A 576 60.857 -5.313 -10.982 1.00 0.00 C ATOM 890 O ILE A 576 61.307 -4.860 -9.925 1.00 0.00 O ATOM 891 CB ILE A 576 60.493 -4.032 -13.128 1.00 0.00 C ATOM 892 CG1 ILE A 576 61.083 -3.675 -14.512 1.00 0.00 C ATOM 893 CG2 ILE A 576 60.192 -2.744 -12.345 1.00 0.00 C ATOM 894 CD1 ILE A 576 62.313 -2.768 -14.385 1.00 0.00 C ATOM 0 H ILE A 576 61.369 -6.166 -14.029 1.00 0.00 H new ATOM 0 HA ILE A 576 62.393 -4.361 -12.153 1.00 0.00 H new ATOM 0 HB ILE A 576 59.567 -4.588 -13.272 1.00 0.00 H new ATOM 0 HG12 ILE A 576 61.357 -4.589 -15.038 1.00 0.00 H new ATOM 0 HG13 ILE A 576 60.323 -3.177 -15.114 1.00 0.00 H new ATOM 0 HG21 ILE A 576 59.498 -2.126 -12.915 1.00 0.00 H new ATOM 0 HG22 ILE A 576 59.746 -2.998 -11.384 1.00 0.00 H new ATOM 0 HG23 ILE A 576 61.118 -2.193 -12.181 1.00 0.00 H new ATOM 0 HD11 ILE A 576 62.700 -2.539 -15.378 1.00 0.00 H new ATOM 0 HD12 ILE A 576 62.032 -1.843 -13.882 1.00 0.00 H new ATOM 0 HD13 ILE A 576 63.082 -3.277 -13.805 1.00 0.00 H new ATOM 906 N GLN A 577 59.865 -6.205 -11.023 1.00 0.00 N ATOM 907 CA GLN A 577 59.199 -6.664 -9.801 1.00 0.00 C ATOM 908 C GLN A 577 60.188 -7.306 -8.826 1.00 0.00 C ATOM 909 O GLN A 577 60.038 -7.178 -7.613 1.00 0.00 O ATOM 910 CB GLN A 577 58.105 -7.677 -10.149 1.00 0.00 C ATOM 911 CG GLN A 577 56.949 -6.962 -10.850 1.00 0.00 C ATOM 912 CD GLN A 577 55.797 -7.934 -11.074 1.00 0.00 C ATOM 913 OE1 GLN A 577 55.977 -8.976 -11.705 1.00 0.00 O ATOM 914 NE2 GLN A 577 54.618 -7.655 -10.590 1.00 0.00 N ATOM 0 H GLN A 577 59.507 -6.622 -11.882 1.00 0.00 H new ATOM 0 HA GLN A 577 58.760 -5.791 -9.319 1.00 0.00 H new ATOM 0 HB2 GLN A 577 58.509 -8.457 -10.795 1.00 0.00 H new ATOM 0 HB3 GLN A 577 57.747 -8.167 -9.243 1.00 0.00 H new ATOM 0 HG2 GLN A 577 56.613 -6.119 -10.247 1.00 0.00 H new ATOM 0 HG3 GLN A 577 57.286 -6.557 -11.804 1.00 0.00 H new ATOM 0 HE21 GLN A 577 54.472 -6.791 -10.068 1.00 0.00 H new ATOM 0 HE22 GLN A 577 53.842 -8.301 -10.734 1.00 0.00 H new ATOM 923 N THR A 578 61.200 -7.992 -9.365 1.00 0.00 N ATOM 924 CA THR A 578 62.158 -8.721 -8.528 1.00 0.00 C ATOM 925 C THR A 578 62.826 -7.794 -7.507 1.00 0.00 C ATOM 926 O THR A 578 62.797 -8.068 -6.306 1.00 0.00 O ATOM 927 CB THR A 578 63.232 -9.375 -9.407 1.00 0.00 C ATOM 928 OG1 THR A 578 62.606 -10.098 -10.455 1.00 0.00 O ATOM 929 CG2 THR A 578 64.088 -10.334 -8.569 1.00 0.00 C ATOM 0 H THR A 578 61.377 -8.058 -10.367 1.00 0.00 H new ATOM 0 HA THR A 578 61.609 -9.490 -7.985 1.00 0.00 H new ATOM 0 HB THR A 578 63.872 -8.598 -9.824 1.00 0.00 H new ATOM 0 HG1 THR A 578 62.273 -9.472 -11.131 1.00 0.00 H new ATOM 0 HG21 THR A 578 64.847 -10.793 -9.203 1.00 0.00 H new ATOM 0 HG22 THR A 578 64.573 -9.781 -7.765 1.00 0.00 H new ATOM 0 HG23 THR A 578 63.453 -11.111 -8.143 1.00 0.00 H new ATOM 937 N LEU A 579 63.370 -6.671 -7.976 1.00 0.00 N ATOM 938 CA LEU A 579 64.079 -5.761 -7.072 1.00 0.00 C ATOM 939 C LEU A 579 63.115 -5.069 -6.111 1.00 0.00 C ATOM 940 O LEU A 579 63.483 -4.764 -4.976 1.00 0.00 O ATOM 941 CB LEU A 579 64.878 -4.703 -7.849 1.00 0.00 C ATOM 942 CG LEU A 579 65.886 -5.364 -8.812 1.00 0.00 C ATOM 943 CD1 LEU A 579 66.824 -4.290 -9.372 1.00 0.00 C ATOM 944 CD2 LEU A 579 66.732 -6.420 -8.086 1.00 0.00 C ATOM 0 H LEU A 579 63.337 -6.373 -8.951 1.00 0.00 H new ATOM 0 HA LEU A 579 64.775 -6.370 -6.495 1.00 0.00 H new ATOM 0 HB2 LEU A 579 64.194 -4.068 -8.413 1.00 0.00 H new ATOM 0 HB3 LEU A 579 65.409 -4.057 -7.149 1.00 0.00 H new ATOM 0 HG LEU A 579 65.327 -5.848 -9.613 1.00 0.00 H new ATOM 0 HD11 LEU A 579 67.539 -4.751 -10.053 1.00 0.00 H new ATOM 0 HD12 LEU A 579 66.241 -3.542 -9.909 1.00 0.00 H new ATOM 0 HD13 LEU A 579 67.360 -3.812 -8.552 1.00 0.00 H new ATOM 0 HD21 LEU A 579 67.434 -6.870 -8.788 1.00 0.00 H new ATOM 0 HD22 LEU A 579 67.284 -5.948 -7.273 1.00 0.00 H new ATOM 0 HD23 LEU A 579 66.079 -7.193 -7.680 1.00 0.00 H new ATOM 956 N ILE A 580 61.882 -4.820 -6.562 1.00 0.00 N ATOM 957 CA ILE A 580 60.887 -4.162 -5.711 1.00 0.00 C ATOM 958 C ILE A 580 60.521 -5.060 -4.523 1.00 0.00 C ATOM 959 O ILE A 580 60.551 -4.622 -3.373 1.00 0.00 O ATOM 960 CB ILE A 580 59.628 -3.831 -6.533 1.00 0.00 C ATOM 961 CG1 ILE A 580 60.015 -2.944 -7.723 1.00 0.00 C ATOM 962 CG2 ILE A 580 58.616 -3.080 -5.658 1.00 0.00 C ATOM 963 CD1 ILE A 580 58.827 -2.816 -8.679 1.00 0.00 C ATOM 0 H ILE A 580 61.552 -5.060 -7.497 1.00 0.00 H new ATOM 0 HA ILE A 580 61.314 -3.235 -5.327 1.00 0.00 H new ATOM 0 HB ILE A 580 59.181 -4.759 -6.890 1.00 0.00 H new ATOM 0 HG12 ILE A 580 60.318 -1.958 -7.371 1.00 0.00 H new ATOM 0 HG13 ILE A 580 60.870 -3.373 -8.246 1.00 0.00 H new ATOM 0 HG21 ILE A 580 57.728 -2.849 -6.246 1.00 0.00 H new ATOM 0 HG22 ILE A 580 58.337 -3.703 -4.808 1.00 0.00 H new ATOM 0 HG23 ILE A 580 59.063 -2.154 -5.297 1.00 0.00 H new ATOM 0 HD11 ILE A 580 59.106 -2.185 -9.523 1.00 0.00 H new ATOM 0 HD12 ILE A 580 58.544 -3.804 -9.042 1.00 0.00 H new ATOM 0 HD13 ILE A 580 57.984 -2.367 -8.154 1.00 0.00 H new ATOM 975 N ALA A 581 60.178 -6.315 -4.817 1.00 0.00 N ATOM 976 CA ALA A 581 59.822 -7.281 -3.775 1.00 0.00 C ATOM 977 C ALA A 581 60.982 -7.495 -2.803 1.00 0.00 C ATOM 978 O ALA A 581 60.769 -7.737 -1.613 1.00 0.00 O ATOM 979 CB ALA A 581 59.440 -8.619 -4.411 1.00 0.00 C ATOM 0 H ALA A 581 60.139 -6.687 -5.766 1.00 0.00 H new ATOM 0 HA ALA A 581 58.973 -6.880 -3.221 1.00 0.00 H new ATOM 0 HB1 ALA A 581 59.177 -9.331 -3.629 1.00 0.00 H new ATOM 0 HB2 ALA A 581 58.587 -8.476 -5.074 1.00 0.00 H new ATOM 0 HB3 ALA A 581 60.284 -9.004 -4.983 1.00 0.00 H new ATOM 985 N ALA A 582 62.206 -7.407 -3.321 1.00 0.00 N ATOM 986 CA ALA A 582 63.398 -7.526 -2.483 1.00 0.00 C ATOM 987 C ALA A 582 63.628 -6.264 -1.635 1.00 0.00 C ATOM 988 O ALA A 582 64.524 -6.244 -0.789 1.00 0.00 O ATOM 989 CB ALA A 582 64.626 -7.785 -3.359 1.00 0.00 C ATOM 0 H ALA A 582 62.398 -7.255 -4.311 1.00 0.00 H new ATOM 0 HA ALA A 582 63.242 -8.364 -1.804 1.00 0.00 H new ATOM 0 HB1 ALA A 582 65.511 -7.873 -2.728 1.00 0.00 H new ATOM 0 HB2 ALA A 582 64.486 -8.710 -3.918 1.00 0.00 H new ATOM 0 HB3 ALA A 582 64.757 -6.957 -4.055 1.00 0.00 H new ATOM 995 N GLY A 583 62.824 -5.217 -1.861 1.00 0.00 N ATOM 996 CA GLY A 583 62.915 -4.001 -1.056 1.00 0.00 C ATOM 997 C GLY A 583 64.149 -3.171 -1.405 1.00 0.00 C ATOM 998 O GLY A 583 64.636 -2.401 -0.576 1.00 0.00 O ATOM 0 H GLY A 583 62.110 -5.191 -2.589 1.00 0.00 H new ATOM 0 HA2 GLY A 583 62.019 -3.399 -1.207 1.00 0.00 H new ATOM 0 HA3 GLY A 583 62.945 -4.268 0.000 1.00 0.00 H new ATOM 1002 N ILE A 584 64.644 -3.316 -2.637 1.00 0.00 N ATOM 1003 CA ILE A 584 65.789 -2.526 -3.085 1.00 0.00 C ATOM 1004 C ILE A 584 65.316 -1.184 -3.639 1.00 0.00 C ATOM 1005 O ILE A 584 65.620 -0.131 -3.075 1.00 0.00 O ATOM 1006 CB ILE A 584 66.585 -3.287 -4.157 1.00 0.00 C ATOM 1007 CG1 ILE A 584 66.945 -4.682 -3.631 1.00 0.00 C ATOM 1008 CG2 ILE A 584 67.879 -2.524 -4.477 1.00 0.00 C ATOM 1009 CD1 ILE A 584 67.553 -5.531 -4.750 1.00 0.00 C ATOM 0 H ILE A 584 64.275 -3.964 -3.332 1.00 0.00 H new ATOM 0 HA ILE A 584 66.441 -2.348 -2.230 1.00 0.00 H new ATOM 0 HB ILE A 584 65.979 -3.376 -5.059 1.00 0.00 H new ATOM 0 HG12 ILE A 584 67.652 -4.596 -2.806 1.00 0.00 H new ATOM 0 HG13 ILE A 584 66.054 -5.171 -3.238 1.00 0.00 H new ATOM 0 HG21 ILE A 584 68.442 -3.065 -5.237 1.00 0.00 H new ATOM 0 HG22 ILE A 584 67.633 -1.529 -4.848 1.00 0.00 H new ATOM 0 HG23 ILE A 584 68.482 -2.435 -3.573 1.00 0.00 H new ATOM 0 HD11 ILE A 584 67.804 -6.518 -4.362 1.00 0.00 H new ATOM 0 HD12 ILE A 584 66.833 -5.632 -5.562 1.00 0.00 H new ATOM 0 HD13 ILE A 584 68.456 -5.048 -5.124 1.00 0.00 H new ATOM 1021 N ILE A 585 64.573 -1.229 -4.743 1.00 0.00 N ATOM 1022 CA ILE A 585 64.104 -0.005 -5.390 1.00 0.00 C ATOM 1023 C ILE A 585 62.745 0.413 -4.829 1.00 0.00 C ATOM 1024 O ILE A 585 61.840 -0.407 -4.675 1.00 0.00 O ATOM 1025 CB ILE A 585 64.004 -0.204 -6.909 1.00 0.00 C ATOM 1026 CG1 ILE A 585 65.325 -0.767 -7.450 1.00 0.00 C ATOM 1027 CG2 ILE A 585 63.721 1.139 -7.590 1.00 0.00 C ATOM 1028 CD1 ILE A 585 65.141 -1.195 -8.908 1.00 0.00 C ATOM 0 H ILE A 585 64.285 -2.091 -5.205 1.00 0.00 H new ATOM 0 HA ILE A 585 64.826 0.785 -5.185 1.00 0.00 H new ATOM 0 HB ILE A 585 63.194 -0.902 -7.119 1.00 0.00 H new ATOM 0 HG12 ILE A 585 66.110 -0.014 -7.378 1.00 0.00 H new ATOM 0 HG13 ILE A 585 65.643 -1.618 -6.848 1.00 0.00 H new ATOM 0 HG21 ILE A 585 63.651 0.993 -8.668 1.00 0.00 H new ATOM 0 HG22 ILE A 585 62.781 1.545 -7.217 1.00 0.00 H new ATOM 0 HG23 ILE A 585 64.530 1.836 -7.370 1.00 0.00 H new ATOM 0 HD11 ILE A 585 66.080 -1.595 -9.291 1.00 0.00 H new ATOM 0 HD12 ILE A 585 64.369 -1.962 -8.967 1.00 0.00 H new ATOM 0 HD13 ILE A 585 64.843 -0.333 -9.505 1.00 0.00 H new ATOM 1040 N ARG A 586 62.626 1.706 -4.528 1.00 0.00 N ATOM 1041 CA ARG A 586 61.384 2.260 -3.997 1.00 0.00 C ATOM 1042 C ARG A 586 60.587 2.950 -5.100 1.00 0.00 C ATOM 1043 O ARG A 586 61.162 3.573 -5.994 1.00 0.00 O ATOM 1044 CB ARG A 586 61.695 3.267 -2.887 1.00 0.00 C ATOM 1045 CG ARG A 586 62.413 2.557 -1.736 1.00 0.00 C ATOM 1046 CD ARG A 586 61.422 1.660 -0.991 1.00 0.00 C ATOM 1047 NE ARG A 586 62.054 1.082 0.197 1.00 0.00 N ATOM 1048 CZ ARG A 586 61.345 0.506 1.180 1.00 0.00 C ATOM 1049 NH1 ARG A 586 60.036 0.430 1.123 1.00 0.00 N ATOM 1050 NH2 ARG A 586 61.970 0.010 2.212 1.00 0.00 N ATOM 0 H ARG A 586 63.375 2.388 -4.643 1.00 0.00 H new ATOM 0 HA ARG A 586 60.789 1.442 -3.592 1.00 0.00 H new ATOM 0 HB2 ARG A 586 62.318 4.072 -3.276 1.00 0.00 H new ATOM 0 HB3 ARG A 586 60.773 3.723 -2.527 1.00 0.00 H new ATOM 0 HG2 ARG A 586 63.240 1.961 -2.122 1.00 0.00 H new ATOM 0 HG3 ARG A 586 62.841 3.291 -1.052 1.00 0.00 H new ATOM 0 HD2 ARG A 586 60.545 2.238 -0.700 1.00 0.00 H new ATOM 0 HD3 ARG A 586 61.075 0.864 -1.650 1.00 0.00 H new ATOM 0 HE ARG A 586 63.070 1.119 0.280 1.00 0.00 H new ATOM 0 HH11 ARG A 586 59.537 0.813 0.320 1.00 0.00 H new ATOM 0 HH12 ARG A 586 59.517 -0.012 1.882 1.00 0.00 H new ATOM 0 HH21 ARG A 586 62.987 0.062 2.266 1.00 0.00 H new ATOM 0 HH22 ARG A 586 61.441 -0.430 2.965 1.00 0.00 H new ATOM 1064 N THR A 587 59.261 2.832 -5.030 1.00 0.00 N ATOM 1065 CA THR A 587 58.385 3.459 -6.019 1.00 0.00 C ATOM 1066 C THR A 587 57.572 4.581 -5.377 1.00 0.00 C ATOM 1067 O THR A 587 57.518 4.693 -4.152 1.00 0.00 O ATOM 1068 CB THR A 587 57.433 2.420 -6.620 1.00 0.00 C ATOM 1069 OG1 THR A 587 56.599 1.893 -5.597 1.00 0.00 O ATOM 1070 CG2 THR A 587 58.241 1.289 -7.262 1.00 0.00 C ATOM 0 H THR A 587 58.772 2.311 -4.302 1.00 0.00 H new ATOM 0 HA THR A 587 59.008 3.877 -6.810 1.00 0.00 H new ATOM 0 HB THR A 587 56.815 2.894 -7.382 1.00 0.00 H new ATOM 0 HG1 THR A 587 55.989 1.230 -5.982 1.00 0.00 H new ATOM 0 HG21 THR A 587 57.560 0.552 -7.688 1.00 0.00 H new ATOM 0 HG22 THR A 587 58.875 1.696 -8.050 1.00 0.00 H new ATOM 0 HG23 THR A 587 58.864 0.812 -6.505 1.00 0.00 H new ATOM 1078 N GLY A 588 56.944 5.405 -6.213 1.00 0.00 N ATOM 1079 CA GLY A 588 56.149 6.526 -5.720 1.00 0.00 C ATOM 1080 C GLY A 588 55.717 7.435 -6.868 1.00 0.00 C ATOM 1081 O GLY A 588 56.010 7.158 -8.032 1.00 0.00 O ATOM 0 H GLY A 588 56.970 5.318 -7.229 1.00 0.00 H new ATOM 0 HA2 GLY A 588 55.269 6.151 -5.197 1.00 0.00 H new ATOM 0 HA3 GLY A 588 56.730 7.098 -4.997 1.00 0.00 H new ATOM 1085 N ARG A 589 55.018 8.518 -6.531 1.00 0.00 N ATOM 1086 CA ARG A 589 54.553 9.466 -7.540 1.00 0.00 C ATOM 1087 C ARG A 589 54.477 10.873 -6.956 1.00 0.00 C ATOM 1088 O ARG A 589 53.887 11.025 -5.899 1.00 0.00 O ATOM 1089 CB ARG A 589 53.172 9.050 -8.053 1.00 0.00 C ATOM 1090 CG ARG A 589 53.277 7.707 -8.780 1.00 0.00 C ATOM 1091 CD ARG A 589 51.938 7.380 -9.442 1.00 0.00 C ATOM 1092 NE ARG A 589 51.945 6.007 -9.951 1.00 0.00 N ATOM 1093 CZ ARG A 589 51.025 5.559 -10.819 1.00 0.00 C ATOM 1094 NH1 ARG A 589 50.064 6.338 -11.259 1.00 0.00 N ATOM 1095 NH2 ARG A 589 51.086 4.323 -11.233 1.00 0.00 N ATOM 1096 OXT ARG A 589 55.010 11.778 -7.576 1.00 0.00 O ATOM 0 H ARG A 589 54.763 8.759 -5.573 1.00 0.00 H new ATOM 0 HA ARG A 589 55.263 9.464 -8.367 1.00 0.00 H new ATOM 0 HB2 ARG A 589 52.473 8.971 -7.221 1.00 0.00 H new ATOM 0 HB3 ARG A 589 52.779 9.811 -8.728 1.00 0.00 H new ATOM 0 HG2 ARG A 589 54.066 7.749 -9.531 1.00 0.00 H new ATOM 0 HG3 ARG A 589 53.549 6.920 -8.076 1.00 0.00 H new ATOM 0 HD2 ARG A 589 51.129 7.504 -8.722 1.00 0.00 H new ATOM 0 HD3 ARG A 589 51.748 8.077 -10.258 1.00 0.00 H new ATOM 0 HE ARG A 589 52.675 5.369 -9.635 1.00 0.00 H new ATOM 0 HH11 ARG A 589 50.006 7.305 -10.941 1.00 0.00 H new ATOM 0 HH12 ARG A 589 49.376 5.976 -11.919 1.00 0.00 H new ATOM 0 HH21 ARG A 589 51.828 3.709 -10.897 1.00 0.00 H new ATOM 0 HH22 ARG A 589 50.392 3.971 -11.893 1.00 0.00 H new TER 1110 ARG A 589