USER MOD reduce.3.24.130724 H: found=0, std=0, add=586, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 586 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 522 MET CE :methyl 177:sc=-0.00698 (180deg=-0.0334) USER MOD Single : A 524 LYS NZ :NH3+ -164:sc= 1.25 (180deg=0.811) USER MOD Single : A 526 GLN : amide:sc= 0.925 K(o=0.92,f=-0.35) USER MOD Single : A 528 GLN : amide:sc= 0.781 K(o=0.78,f=0) USER MOD Single : A 529 HIS : no HD1:sc= -0.0163 X(o=-0.016,f=-0.016) USER MOD Single : A 531 TYR OH : rot -163:sc= 1.25 USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot 180:sc= 0 USER MOD Single : A 536 THR OG1 : rot -29:sc= 0.0298 USER MOD Single : A 540 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 542 LYS NZ :NH3+ 174:sc= 1.11 (180deg=1.07) USER MOD Single : A 558 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 564 MET CE :methyl 173:sc= -0.924 (180deg=-1.03) USER MOD Single : A 567 LYS NZ :NH3+ -153:sc= 0.00869 (180deg=0) USER MOD Single : A 569 SER OG : rot 180:sc= 0 USER MOD Single : A 572 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 573 GLN : amide:sc= -0.0744 K(o=-0.074,f=-1) USER MOD Single : A 574 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 575 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 579 LYS NZ :NH3+ 177:sc= 1.01 (180deg=0.991) USER MOD Single : A 580 CYS SG : rot 89:sc= -0.746 USER MOD Single : A 587 ASN : amide:sc= 1.1 K(o=1.1,f=-5.9!) USER MOD Single : A 589 THR OG1 : rot 140:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 517 27.683 15.361 27.523 1.00 0.00 N ATOM 66 CA LEU A 517 27.584 16.749 27.975 1.00 0.00 C ATOM 67 C LEU A 517 26.117 17.174 28.149 1.00 0.00 C ATOM 68 O LEU A 517 25.215 16.535 27.594 1.00 0.00 O ATOM 69 CB LEU A 517 28.328 17.632 26.956 1.00 0.00 C ATOM 70 CG LEU A 517 29.860 17.611 27.106 1.00 0.00 C ATOM 71 CD1 LEU A 517 30.425 18.755 26.285 1.00 0.00 C ATOM 72 CD2 LEU A 517 30.380 17.852 28.523 1.00 0.00 C ATOM 0 HA LEU A 517 28.046 16.862 28.956 1.00 0.00 H new ATOM 0 HB2 LEU A 517 28.068 17.305 25.949 1.00 0.00 H new ATOM 0 HB3 LEU A 517 27.978 18.659 27.058 1.00 0.00 H new ATOM 0 HG LEU A 517 30.165 16.612 26.795 1.00 0.00 H new ATOM 0 HD11 LEU A 517 31.511 18.764 26.373 1.00 0.00 H new ATOM 0 HD12 LEU A 517 30.147 18.624 25.239 1.00 0.00 H new ATOM 0 HD13 LEU A 517 30.023 19.699 26.652 1.00 0.00 H new ATOM 0 HD21 LEU A 517 31.469 17.817 28.522 1.00 0.00 H new ATOM 0 HD22 LEU A 517 30.048 18.830 28.871 1.00 0.00 H new ATOM 0 HD23 LEU A 517 29.993 17.080 29.189 1.00 0.00 H new ATOM 84 N PRO A 518 25.855 18.242 28.920 1.00 0.00 N ATOM 85 CA PRO A 518 24.501 18.664 29.258 1.00 0.00 C ATOM 86 C PRO A 518 23.692 19.116 28.034 1.00 0.00 C ATOM 87 O PRO A 518 24.269 19.465 26.995 1.00 0.00 O ATOM 88 CB PRO A 518 24.656 19.760 30.316 1.00 0.00 C ATOM 89 CG PRO A 518 26.070 20.292 30.095 1.00 0.00 C ATOM 90 CD PRO A 518 26.836 19.090 29.571 1.00 0.00 C ATOM 0 HA PRO A 518 23.919 17.830 29.649 1.00 0.00 H new ATOM 0 HB2 PRO A 518 23.910 20.545 30.189 1.00 0.00 H new ATOM 0 HB3 PRO A 518 24.532 19.362 31.323 1.00 0.00 H new ATOM 0 HG2 PRO A 518 26.080 21.115 29.380 1.00 0.00 H new ATOM 0 HG3 PRO A 518 26.504 20.669 31.021 1.00 0.00 H new ATOM 0 HD2 PRO A 518 27.612 19.397 28.870 1.00 0.00 H new ATOM 0 HD3 PRO A 518 27.332 18.559 30.384 1.00 0.00 H new ATOM 98 N PRO A 519 22.351 19.121 28.137 1.00 0.00 N ATOM 99 CA PRO A 519 21.485 19.584 27.061 1.00 0.00 C ATOM 100 C PRO A 519 21.751 21.068 26.779 1.00 0.00 C ATOM 101 O PRO A 519 21.902 21.882 27.696 1.00 0.00 O ATOM 102 CB PRO A 519 20.057 19.303 27.539 1.00 0.00 C ATOM 103 CG PRO A 519 20.173 19.382 29.060 1.00 0.00 C ATOM 104 CD PRO A 519 21.565 18.812 29.325 1.00 0.00 C ATOM 0 HA PRO A 519 21.664 19.075 26.114 1.00 0.00 H new ATOM 0 HB2 PRO A 519 19.351 20.037 27.151 1.00 0.00 H new ATOM 0 HB3 PRO A 519 19.709 18.323 27.213 1.00 0.00 H new ATOM 0 HG2 PRO A 519 20.081 20.407 29.420 1.00 0.00 H new ATOM 0 HG3 PRO A 519 19.397 18.799 29.555 1.00 0.00 H new ATOM 0 HD2 PRO A 519 22.008 19.259 30.215 1.00 0.00 H new ATOM 0 HD3 PRO A 519 21.521 17.736 29.497 1.00 0.00 H new ATOM 112 N GLY A 520 21.844 21.418 25.499 1.00 0.00 N ATOM 113 CA GLY A 520 22.098 22.777 25.027 1.00 0.00 C ATOM 114 C GLY A 520 23.553 23.242 25.130 1.00 0.00 C ATOM 115 O GLY A 520 23.825 24.354 24.677 1.00 0.00 O ATOM 0 H GLY A 520 21.742 20.745 24.739 1.00 0.00 H new ATOM 0 HA2 GLY A 520 21.784 22.847 23.986 1.00 0.00 H new ATOM 0 HA3 GLY A 520 21.472 23.465 25.596 1.00 0.00 H new ATOM 119 N PHE A 521 24.474 22.441 25.697 1.00 0.00 N ATOM 120 CA PHE A 521 25.875 22.796 25.914 1.00 0.00 C ATOM 121 C PHE A 521 26.547 23.691 24.855 1.00 0.00 C ATOM 122 O PHE A 521 26.547 23.352 23.668 1.00 0.00 O ATOM 123 CB PHE A 521 26.674 21.521 26.207 1.00 0.00 C ATOM 124 CG PHE A 521 28.171 21.715 26.207 1.00 0.00 C ATOM 125 CD1 PHE A 521 28.824 22.000 27.418 1.00 0.00 C ATOM 126 CD2 PHE A 521 28.901 21.644 25.004 1.00 0.00 C ATOM 127 CE1 PHE A 521 30.213 22.204 27.426 1.00 0.00 C ATOM 128 CE2 PHE A 521 30.289 21.848 25.013 1.00 0.00 C ATOM 129 CZ PHE A 521 30.945 22.100 26.228 1.00 0.00 C ATOM 0 H PHE A 521 24.249 21.501 26.024 1.00 0.00 H new ATOM 0 HA PHE A 521 25.877 23.459 26.779 1.00 0.00 H new ATOM 0 HB2 PHE A 521 26.370 21.130 27.178 1.00 0.00 H new ATOM 0 HB3 PHE A 521 26.417 20.766 25.464 1.00 0.00 H new ATOM 0 HD1 PHE A 521 28.261 22.062 28.337 1.00 0.00 H new ATOM 0 HD2 PHE A 521 28.392 21.433 24.075 1.00 0.00 H new ATOM 0 HE1 PHE A 521 30.719 22.440 28.350 1.00 0.00 H new ATOM 0 HE2 PHE A 521 30.849 21.811 24.091 1.00 0.00 H new ATOM 0 HZ PHE A 521 32.019 22.215 26.244 1.00 0.00 H new ATOM 139 N MET A 522 27.122 24.823 25.276 1.00 0.00 N ATOM 140 CA MET A 522 27.757 25.780 24.362 1.00 0.00 C ATOM 141 C MET A 522 29.261 25.544 24.231 1.00 0.00 C ATOM 142 O MET A 522 29.784 25.501 23.117 1.00 0.00 O ATOM 143 CB MET A 522 27.498 27.227 24.811 1.00 0.00 C ATOM 144 CG MET A 522 26.009 27.529 24.958 1.00 0.00 C ATOM 145 SD MET A 522 25.553 29.281 24.872 1.00 0.00 S ATOM 146 CE MET A 522 26.312 29.904 26.392 1.00 0.00 C ATOM 0 H MET A 522 27.161 25.101 26.257 1.00 0.00 H new ATOM 0 HA MET A 522 27.305 25.621 23.383 1.00 0.00 H new ATOM 0 HB2 MET A 522 27.998 27.405 25.763 1.00 0.00 H new ATOM 0 HB3 MET A 522 27.936 27.914 24.087 1.00 0.00 H new ATOM 0 HG2 MET A 522 25.469 26.993 24.178 1.00 0.00 H new ATOM 0 HG3 MET A 522 25.668 27.130 25.913 1.00 0.00 H new ATOM 0 HE1 MET A 522 26.165 30.982 26.457 1.00 0.00 H new ATOM 0 HE2 MET A 522 25.849 29.422 27.254 1.00 0.00 H new ATOM 0 HE3 MET A 522 27.379 29.683 26.383 1.00 0.00 H new ATOM 156 N PHE A 523 29.948 25.462 25.371 1.00 0.00 N ATOM 157 CA PHE A 523 31.403 25.402 25.537 1.00 0.00 C ATOM 158 C PHE A 523 31.816 25.095 26.968 1.00 0.00 C ATOM 159 O PHE A 523 30.995 25.176 27.874 1.00 0.00 O ATOM 160 CB PHE A 523 32.089 26.679 25.024 1.00 0.00 C ATOM 161 CG PHE A 523 31.493 28.004 25.471 1.00 0.00 C ATOM 162 CD1 PHE A 523 30.512 28.651 24.694 1.00 0.00 C ATOM 163 CD2 PHE A 523 31.955 28.613 26.650 1.00 0.00 C ATOM 164 CE1 PHE A 523 30.002 29.900 25.091 1.00 0.00 C ATOM 165 CE2 PHE A 523 31.443 29.861 27.048 1.00 0.00 C ATOM 166 CZ PHE A 523 30.473 30.509 26.265 1.00 0.00 C ATOM 0 H PHE A 523 29.467 25.434 26.270 1.00 0.00 H new ATOM 0 HA PHE A 523 31.745 24.569 24.922 1.00 0.00 H new ATOM 0 HB2 PHE A 523 33.133 26.653 25.337 1.00 0.00 H new ATOM 0 HB3 PHE A 523 32.082 26.654 23.934 1.00 0.00 H new ATOM 0 HD1 PHE A 523 30.150 28.186 23.789 1.00 0.00 H new ATOM 0 HD2 PHE A 523 32.705 28.122 27.252 1.00 0.00 H new ATOM 0 HE1 PHE A 523 29.248 30.391 24.493 1.00 0.00 H new ATOM 0 HE2 PHE A 523 31.797 30.323 27.958 1.00 0.00 H new ATOM 0 HZ PHE A 523 30.091 31.473 26.566 1.00 0.00 H new ATOM 176 N LYS A 524 33.078 24.757 27.210 1.00 0.00 N ATOM 177 CA LYS A 524 33.617 24.728 28.572 1.00 0.00 C ATOM 178 C LYS A 524 34.359 26.030 28.898 1.00 0.00 C ATOM 179 O LYS A 524 34.826 26.746 28.010 1.00 0.00 O ATOM 180 CB LYS A 524 34.514 23.506 28.748 1.00 0.00 C ATOM 181 CG LYS A 524 33.789 22.167 28.620 1.00 0.00 C ATOM 182 CD LYS A 524 34.663 20.989 29.060 1.00 0.00 C ATOM 183 CE LYS A 524 34.081 19.677 28.532 1.00 0.00 C ATOM 184 NZ LYS A 524 35.068 18.573 28.566 1.00 0.00 N ATOM 0 H LYS A 524 33.748 24.499 26.485 1.00 0.00 H new ATOM 0 HA LYS A 524 32.791 24.648 29.278 1.00 0.00 H new ATOM 0 HB2 LYS A 524 35.311 23.546 28.006 1.00 0.00 H new ATOM 0 HB3 LYS A 524 34.988 23.556 29.728 1.00 0.00 H new ATOM 0 HG2 LYS A 524 32.881 22.189 29.223 1.00 0.00 H new ATOM 0 HG3 LYS A 524 33.480 22.021 27.585 1.00 0.00 H new ATOM 0 HD2 LYS A 524 35.679 21.121 28.688 1.00 0.00 H new ATOM 0 HD3 LYS A 524 34.724 20.957 30.148 1.00 0.00 H new ATOM 0 HE2 LYS A 524 33.210 19.402 29.127 1.00 0.00 H new ATOM 0 HE3 LYS A 524 33.735 19.821 27.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 34.737 17.792 27.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 35.985 18.916 28.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 35.177 18.234 29.543 1.00 0.00 H new ATOM 198 N VAL A 525 34.532 26.294 30.186 1.00 0.00 N ATOM 199 CA VAL A 525 35.429 27.315 30.754 1.00 0.00 C ATOM 200 C VAL A 525 36.202 26.692 31.922 1.00 0.00 C ATOM 201 O VAL A 525 35.738 25.707 32.491 1.00 0.00 O ATOM 202 CB VAL A 525 34.668 28.579 31.203 1.00 0.00 C ATOM 203 CG1 VAL A 525 33.912 29.241 30.050 1.00 0.00 C ATOM 204 CG2 VAL A 525 33.674 28.219 32.306 1.00 0.00 C ATOM 0 H VAL A 525 34.028 25.780 30.908 1.00 0.00 H new ATOM 0 HA VAL A 525 36.123 27.640 29.979 1.00 0.00 H new ATOM 0 HB VAL A 525 35.410 29.288 31.571 1.00 0.00 H new ATOM 0 HG11 VAL A 525 33.392 30.126 30.416 1.00 0.00 H new ATOM 0 HG12 VAL A 525 34.617 29.531 29.271 1.00 0.00 H new ATOM 0 HG13 VAL A 525 33.187 28.538 29.640 1.00 0.00 H new ATOM 0 HG21 VAL A 525 33.139 29.115 32.620 1.00 0.00 H new ATOM 0 HG22 VAL A 525 32.962 27.485 31.929 1.00 0.00 H new ATOM 0 HG23 VAL A 525 34.211 27.800 33.157 1.00 0.00 H new ATOM 214 N GLN A 526 37.352 27.245 32.314 1.00 0.00 N ATOM 215 CA GLN A 526 38.091 26.791 33.504 1.00 0.00 C ATOM 216 C GLN A 526 38.376 27.937 34.487 1.00 0.00 C ATOM 217 O GLN A 526 38.865 28.991 34.078 1.00 0.00 O ATOM 218 CB GLN A 526 39.363 26.037 33.080 1.00 0.00 C ATOM 219 CG GLN A 526 39.979 25.258 34.258 1.00 0.00 C ATOM 220 CD GLN A 526 40.935 24.141 33.838 1.00 0.00 C ATOM 221 OE1 GLN A 526 41.324 23.979 32.687 1.00 0.00 O ATOM 222 NE2 GLN A 526 41.345 23.315 34.768 1.00 0.00 N ATOM 0 H GLN A 526 37.799 28.017 31.821 1.00 0.00 H new ATOM 0 HA GLN A 526 37.459 26.093 34.053 1.00 0.00 H new ATOM 0 HB2 GLN A 526 39.125 25.346 32.271 1.00 0.00 H new ATOM 0 HB3 GLN A 526 40.094 26.745 32.690 1.00 0.00 H new ATOM 0 HG2 GLN A 526 40.514 25.957 34.901 1.00 0.00 H new ATOM 0 HG3 GLN A 526 39.175 24.828 34.855 1.00 0.00 H new ATOM 0 HE21 GLN A 526 41.031 23.435 35.731 1.00 0.00 H new ATOM 0 HE22 GLN A 526 41.978 22.552 34.529 1.00 0.00 H new ATOM 231 N ALA A 527 38.067 27.752 35.777 1.00 0.00 N ATOM 232 CA ALA A 527 38.233 28.766 36.825 1.00 0.00 C ATOM 233 C ALA A 527 39.710 29.111 37.041 1.00 0.00 C ATOM 234 O ALA A 527 40.519 28.271 37.432 1.00 0.00 O ATOM 235 CB ALA A 527 37.531 28.307 38.119 1.00 0.00 C ATOM 0 H ALA A 527 37.686 26.873 36.128 1.00 0.00 H new ATOM 0 HA ALA A 527 37.754 29.690 36.503 1.00 0.00 H new ATOM 0 HB1 ALA A 527 37.659 29.065 38.891 1.00 0.00 H new ATOM 0 HB2 ALA A 527 36.468 28.163 37.925 1.00 0.00 H new ATOM 0 HB3 ALA A 527 37.969 27.368 38.457 1.00 0.00 H new ATOM 241 N GLN A 528 40.062 30.369 36.796 1.00 0.00 N ATOM 242 CA GLN A 528 41.391 30.903 37.079 1.00 0.00 C ATOM 243 C GLN A 528 41.543 31.278 38.566 1.00 0.00 C ATOM 244 O GLN A 528 42.641 31.174 39.108 1.00 0.00 O ATOM 245 CB GLN A 528 41.665 32.124 36.185 1.00 0.00 C ATOM 246 CG GLN A 528 41.411 31.934 34.686 1.00 0.00 C ATOM 247 CD GLN A 528 42.246 30.811 34.088 1.00 0.00 C ATOM 248 OE1 GLN A 528 43.463 30.884 33.989 1.00 0.00 O ATOM 249 NE2 GLN A 528 41.629 29.714 33.732 1.00 0.00 N ATOM 0 H GLN A 528 39.425 31.055 36.391 1.00 0.00 H new ATOM 0 HA GLN A 528 42.124 30.126 36.860 1.00 0.00 H new ATOM 0 HB2 GLN A 528 41.047 32.951 36.535 1.00 0.00 H new ATOM 0 HB3 GLN A 528 42.704 32.423 36.321 1.00 0.00 H new ATOM 0 HG2 GLN A 528 40.354 31.721 34.525 1.00 0.00 H new ATOM 0 HG3 GLN A 528 41.632 32.864 34.163 1.00 0.00 H new ATOM 0 HE21 GLN A 528 40.614 29.650 33.813 1.00 0.00 H new ATOM 0 HE22 GLN A 528 42.163 28.922 33.373 1.00 0.00 H new ATOM 258 N HIS A 529 40.443 31.654 39.228 1.00 0.00 N ATOM 259 CA HIS A 529 40.388 32.088 40.629 1.00 0.00 C ATOM 260 C HIS A 529 39.184 31.463 41.362 1.00 0.00 C ATOM 261 O HIS A 529 38.236 31.005 40.726 1.00 0.00 O ATOM 262 CB HIS A 529 40.357 33.624 40.675 1.00 0.00 C ATOM 263 CG HIS A 529 41.585 34.268 40.076 1.00 0.00 C ATOM 264 ND1 HIS A 529 42.811 34.404 40.683 1.00 0.00 N ATOM 265 CD2 HIS A 529 41.694 34.820 38.828 1.00 0.00 C ATOM 266 CE1 HIS A 529 43.640 35.019 39.826 1.00 0.00 C ATOM 267 NE2 HIS A 529 43.001 35.303 38.673 1.00 0.00 N ATOM 0 H HIS A 529 39.526 31.665 38.782 1.00 0.00 H new ATOM 0 HA HIS A 529 41.278 31.740 41.153 1.00 0.00 H new ATOM 0 HB2 HIS A 529 39.474 33.978 40.143 1.00 0.00 H new ATOM 0 HB3 HIS A 529 40.255 33.947 41.711 1.00 0.00 H new ATOM 0 HD2 HIS A 529 40.908 34.874 38.089 1.00 0.00 H new ATOM 0 HE1 HIS A 529 44.674 35.254 40.031 1.00 0.00 H new ATOM 0 HE2 HIS A 529 43.389 35.773 37.855 1.00 0.00 H new ATOM 275 N ASP A 530 39.219 31.425 42.697 1.00 0.00 N ATOM 276 CA ASP A 530 38.149 30.889 43.550 1.00 0.00 C ATOM 277 C ASP A 530 36.976 31.854 43.838 1.00 0.00 C ATOM 278 O ASP A 530 37.190 33.038 44.129 1.00 0.00 O ATOM 279 CB ASP A 530 38.685 30.134 44.791 1.00 0.00 C ATOM 280 CG ASP A 530 39.886 30.728 45.563 1.00 0.00 C ATOM 281 OD1 ASP A 530 40.373 30.050 46.500 1.00 0.00 O ATOM 282 OD2 ASP A 530 40.393 31.832 45.245 1.00 0.00 O ATOM 0 H ASP A 530 40.014 31.776 43.231 1.00 0.00 H new ATOM 0 HA ASP A 530 37.671 30.129 42.932 1.00 0.00 H new ATOM 0 HB2 ASP A 530 37.860 30.029 45.495 1.00 0.00 H new ATOM 0 HB3 ASP A 530 38.962 29.129 44.472 1.00 0.00 H new ATOM 287 N TYR A 531 35.740 31.347 43.762 1.00 0.00 N ATOM 288 CA TYR A 531 34.488 32.086 43.966 1.00 0.00 C ATOM 289 C TYR A 531 33.431 31.276 44.749 1.00 0.00 C ATOM 290 O TYR A 531 33.104 30.151 44.371 1.00 0.00 O ATOM 291 CB TYR A 531 33.939 32.530 42.599 1.00 0.00 C ATOM 292 CG TYR A 531 32.640 33.320 42.709 1.00 0.00 C ATOM 293 CD1 TYR A 531 32.691 34.702 42.978 1.00 0.00 C ATOM 294 CD2 TYR A 531 31.385 32.675 42.637 1.00 0.00 C ATOM 295 CE1 TYR A 531 31.504 35.429 43.198 1.00 0.00 C ATOM 296 CE2 TYR A 531 30.194 33.400 42.857 1.00 0.00 C ATOM 297 CZ TYR A 531 30.251 34.781 43.156 1.00 0.00 C ATOM 298 OH TYR A 531 29.117 35.499 43.402 1.00 0.00 O ATOM 0 H TYR A 531 35.578 30.363 43.546 1.00 0.00 H new ATOM 0 HA TYR A 531 34.710 32.958 44.580 1.00 0.00 H new ATOM 0 HB2 TYR A 531 34.688 33.140 42.093 1.00 0.00 H new ATOM 0 HB3 TYR A 531 33.772 31.650 41.977 1.00 0.00 H new ATOM 0 HD1 TYR A 531 33.645 35.207 43.016 1.00 0.00 H new ATOM 0 HD2 TYR A 531 31.337 31.620 42.412 1.00 0.00 H new ATOM 0 HE1 TYR A 531 31.554 36.489 43.400 1.00 0.00 H new ATOM 0 HE2 TYR A 531 29.239 32.900 42.797 1.00 0.00 H new ATOM 0 HH TYR A 531 28.381 34.887 43.610 1.00 0.00 H new ATOM 308 N THR A 532 32.855 31.848 45.814 1.00 0.00 N ATOM 309 CA THR A 532 31.762 31.246 46.610 1.00 0.00 C ATOM 310 C THR A 532 30.386 31.856 46.338 1.00 0.00 C ATOM 311 O THR A 532 30.265 33.079 46.266 1.00 0.00 O ATOM 312 CB THR A 532 32.076 31.175 48.117 1.00 0.00 C ATOM 313 OG1 THR A 532 33.430 30.837 48.347 1.00 0.00 O ATOM 314 CG2 THR A 532 31.228 30.155 48.870 1.00 0.00 C ATOM 0 H THR A 532 33.138 32.765 46.160 1.00 0.00 H new ATOM 0 HA THR A 532 31.704 30.217 46.255 1.00 0.00 H new ATOM 0 HB THR A 532 31.847 32.173 48.490 1.00 0.00 H new ATOM 0 HG1 THR A 532 33.599 30.801 49.312 1.00 0.00 H new ATOM 0 HG21 THR A 532 31.504 30.160 49.925 1.00 0.00 H new ATOM 0 HG22 THR A 532 30.174 30.413 48.769 1.00 0.00 H new ATOM 0 HG23 THR A 532 31.400 29.162 48.455 1.00 0.00 H new ATOM 322 N ALA A 533 29.348 31.026 46.196 1.00 0.00 N ATOM 323 CA ALA A 533 28.013 31.468 45.798 1.00 0.00 C ATOM 324 C ALA A 533 27.273 32.222 46.920 1.00 0.00 C ATOM 325 O ALA A 533 27.092 31.709 48.030 1.00 0.00 O ATOM 326 CB ALA A 533 27.220 30.246 45.321 1.00 0.00 C ATOM 0 H ALA A 533 29.414 30.021 46.356 1.00 0.00 H new ATOM 0 HA ALA A 533 28.112 32.188 44.985 1.00 0.00 H new ATOM 0 HB1 ALA A 533 26.220 30.556 45.019 1.00 0.00 H new ATOM 0 HB2 ALA A 533 27.730 29.790 44.472 1.00 0.00 H new ATOM 0 HB3 ALA A 533 27.146 29.521 46.132 1.00 0.00 H new ATOM 332 N THR A 534 26.797 33.423 46.594 1.00 0.00 N ATOM 333 CA THR A 534 26.011 34.346 47.441 1.00 0.00 C ATOM 334 C THR A 534 24.483 34.198 47.363 1.00 0.00 C ATOM 335 O THR A 534 23.733 34.874 48.074 1.00 0.00 O ATOM 336 CB THR A 534 26.448 35.813 47.235 1.00 0.00 C ATOM 337 OG1 THR A 534 25.807 36.375 46.105 1.00 0.00 O ATOM 338 CG2 THR A 534 27.952 36.020 47.047 1.00 0.00 C ATOM 0 H THR A 534 26.957 33.813 45.665 1.00 0.00 H new ATOM 0 HA THR A 534 26.252 34.038 48.458 1.00 0.00 H new ATOM 0 HB THR A 534 26.157 36.305 48.163 1.00 0.00 H new ATOM 0 HG1 THR A 534 26.096 37.305 45.993 1.00 0.00 H new ATOM 0 HG21 THR A 534 28.159 37.081 46.910 1.00 0.00 H new ATOM 0 HG22 THR A 534 28.482 35.658 47.928 1.00 0.00 H new ATOM 0 HG23 THR A 534 28.288 35.469 46.169 1.00 0.00 H new ATOM 346 N ASP A 535 24.002 33.311 46.491 1.00 0.00 N ATOM 347 CA ASP A 535 22.590 33.164 46.120 1.00 0.00 C ATOM 348 C ASP A 535 22.343 31.685 45.779 1.00 0.00 C ATOM 349 O ASP A 535 23.268 30.953 45.404 1.00 0.00 O ATOM 350 CB ASP A 535 22.347 34.020 44.862 1.00 0.00 C ATOM 351 CG ASP A 535 20.882 34.374 44.595 1.00 0.00 C ATOM 352 OD1 ASP A 535 20.654 35.279 43.754 1.00 0.00 O ATOM 353 OD2 ASP A 535 19.981 33.755 45.198 1.00 0.00 O ATOM 0 H ASP A 535 24.606 32.649 46.004 1.00 0.00 H new ATOM 0 HA ASP A 535 21.928 33.479 46.927 1.00 0.00 H new ATOM 0 HB2 ASP A 535 22.918 34.944 44.954 1.00 0.00 H new ATOM 0 HB3 ASP A 535 22.740 33.487 43.996 1.00 0.00 H new ATOM 358 N THR A 536 21.084 31.253 45.826 1.00 0.00 N ATOM 359 CA THR A 536 20.675 29.938 45.311 1.00 0.00 C ATOM 360 C THR A 536 20.781 29.775 43.792 1.00 0.00 C ATOM 361 O THR A 536 20.871 28.653 43.290 1.00 0.00 O ATOM 362 CB THR A 536 19.314 29.500 45.878 1.00 0.00 C ATOM 363 OG1 THR A 536 19.203 28.096 45.801 1.00 0.00 O ATOM 364 CG2 THR A 536 18.131 30.099 45.120 1.00 0.00 C ATOM 0 H THR A 536 20.318 31.799 46.220 1.00 0.00 H new ATOM 0 HA THR A 536 21.421 29.240 45.690 1.00 0.00 H new ATOM 0 HB THR A 536 19.279 29.857 46.907 1.00 0.00 H new ATOM 0 HG1 THR A 536 19.727 27.768 45.040 1.00 0.00 H new ATOM 0 HG21 THR A 536 17.199 29.753 45.567 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.177 31.187 45.174 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.171 29.786 44.077 1.00 0.00 H new ATOM 372 N ASP A 537 20.804 30.887 43.048 1.00 0.00 N ATOM 373 CA ASP A 537 20.955 30.878 41.584 1.00 0.00 C ATOM 374 C ASP A 537 22.451 30.755 41.195 1.00 0.00 C ATOM 375 O ASP A 537 22.753 30.375 40.062 1.00 0.00 O ATOM 376 CB ASP A 537 20.385 32.201 41.028 1.00 0.00 C ATOM 377 CG ASP A 537 19.956 32.109 39.554 1.00 0.00 C ATOM 378 OD1 ASP A 537 19.461 31.031 39.132 1.00 0.00 O ATOM 379 OD2 ASP A 537 20.043 33.130 38.830 1.00 0.00 O ATOM 0 H ASP A 537 20.718 31.823 43.444 1.00 0.00 H new ATOM 0 HA ASP A 537 20.419 30.026 41.167 1.00 0.00 H new ATOM 0 HB2 ASP A 537 19.527 32.500 41.630 1.00 0.00 H new ATOM 0 HB3 ASP A 537 21.136 32.984 41.132 1.00 0.00 H new ATOM 384 N GLU A 538 23.395 31.082 42.089 1.00 0.00 N ATOM 385 CA GLU A 538 24.834 31.136 41.818 1.00 0.00 C ATOM 386 C GLU A 538 25.556 29.770 41.880 1.00 0.00 C ATOM 387 O GLU A 538 25.130 28.836 42.569 1.00 0.00 O ATOM 388 CB GLU A 538 25.484 32.185 42.742 1.00 0.00 C ATOM 389 CG GLU A 538 25.265 33.621 42.236 1.00 0.00 C ATOM 390 CD GLU A 538 25.870 34.711 43.135 1.00 0.00 C ATOM 391 OE1 GLU A 538 26.731 34.421 43.998 1.00 0.00 O ATOM 392 OE2 GLU A 538 25.482 35.893 42.981 1.00 0.00 O ATOM 0 H GLU A 538 23.167 31.324 43.053 1.00 0.00 H new ATOM 0 HA GLU A 538 24.952 31.439 40.778 1.00 0.00 H new ATOM 0 HB2 GLU A 538 25.070 32.088 43.746 1.00 0.00 H new ATOM 0 HB3 GLU A 538 26.553 31.987 42.817 1.00 0.00 H new ATOM 0 HG2 GLU A 538 25.694 33.711 41.238 1.00 0.00 H new ATOM 0 HG3 GLU A 538 24.194 33.800 42.140 1.00 0.00 H new ATOM 399 N LEU A 539 26.659 29.668 41.133 1.00 0.00 N ATOM 400 CA LEU A 539 27.580 28.529 41.044 1.00 0.00 C ATOM 401 C LEU A 539 28.810 28.765 41.940 1.00 0.00 C ATOM 402 O LEU A 539 29.361 29.865 41.966 1.00 0.00 O ATOM 403 CB LEU A 539 28.021 28.364 39.569 1.00 0.00 C ATOM 404 CG LEU A 539 28.055 26.925 39.024 1.00 0.00 C ATOM 405 CD1 LEU A 539 28.585 26.923 37.603 1.00 0.00 C ATOM 406 CD2 LEU A 539 28.962 25.979 39.794 1.00 0.00 C ATOM 0 H LEU A 539 26.954 30.436 40.530 1.00 0.00 H new ATOM 0 HA LEU A 539 27.078 27.624 41.385 1.00 0.00 H new ATOM 0 HB2 LEU A 539 27.349 28.951 38.943 1.00 0.00 H new ATOM 0 HB3 LEU A 539 29.016 28.795 39.459 1.00 0.00 H new ATOM 0 HG LEU A 539 27.025 26.578 39.109 1.00 0.00 H new ATOM 0 HD11 LEU A 539 28.606 25.901 37.224 1.00 0.00 H new ATOM 0 HD12 LEU A 539 27.937 27.531 36.972 1.00 0.00 H new ATOM 0 HD13 LEU A 539 29.594 27.336 37.590 1.00 0.00 H new ATOM 0 HD21 LEU A 539 28.924 24.989 39.340 1.00 0.00 H new ATOM 0 HD22 LEU A 539 29.986 26.352 39.765 1.00 0.00 H new ATOM 0 HD23 LEU A 539 28.628 25.917 40.830 1.00 0.00 H new ATOM 418 N GLN A 540 29.273 27.731 42.640 1.00 0.00 N ATOM 419 CA GLN A 540 30.523 27.753 43.405 1.00 0.00 C ATOM 420 C GLN A 540 31.706 27.266 42.547 1.00 0.00 C ATOM 421 O GLN A 540 31.625 26.190 41.955 1.00 0.00 O ATOM 422 CB GLN A 540 30.325 26.838 44.615 1.00 0.00 C ATOM 423 CG GLN A 540 31.380 27.077 45.707 1.00 0.00 C ATOM 424 CD GLN A 540 31.379 25.985 46.770 1.00 0.00 C ATOM 425 OE1 GLN A 540 32.269 25.150 46.831 1.00 0.00 O ATOM 426 NE2 GLN A 540 30.335 25.863 47.555 1.00 0.00 N ATOM 0 H GLN A 540 28.783 26.838 42.694 1.00 0.00 H new ATOM 0 HA GLN A 540 30.757 28.770 43.720 1.00 0.00 H new ATOM 0 HB2 GLN A 540 29.331 27.001 45.032 1.00 0.00 H new ATOM 0 HB3 GLN A 540 30.369 25.798 44.292 1.00 0.00 H new ATOM 0 HG2 GLN A 540 32.367 27.131 45.248 1.00 0.00 H new ATOM 0 HG3 GLN A 540 31.195 28.041 46.181 1.00 0.00 H new ATOM 0 HE21 GLN A 540 29.584 26.552 47.516 1.00 0.00 H new ATOM 0 HE22 GLN A 540 30.274 25.079 48.205 1.00 0.00 H new ATOM 435 N LEU A 541 32.822 28.002 42.517 1.00 0.00 N ATOM 436 CA LEU A 541 34.011 27.696 41.708 1.00 0.00 C ATOM 437 C LEU A 541 35.301 27.702 42.544 1.00 0.00 C ATOM 438 O LEU A 541 35.505 28.578 43.385 1.00 0.00 O ATOM 439 CB LEU A 541 34.118 28.702 40.536 1.00 0.00 C ATOM 440 CG LEU A 541 32.980 28.666 39.496 1.00 0.00 C ATOM 441 CD1 LEU A 541 33.280 29.661 38.377 1.00 0.00 C ATOM 442 CD2 LEU A 541 32.817 27.283 38.870 1.00 0.00 C ATOM 0 H LEU A 541 32.928 28.852 43.070 1.00 0.00 H new ATOM 0 HA LEU A 541 33.894 26.687 41.313 1.00 0.00 H new ATOM 0 HB2 LEU A 541 34.168 29.708 40.953 1.00 0.00 H new ATOM 0 HB3 LEU A 541 35.060 28.524 40.018 1.00 0.00 H new ATOM 0 HG LEU A 541 32.058 28.923 40.018 1.00 0.00 H new ATOM 0 HD11 LEU A 541 32.476 29.635 37.642 1.00 0.00 H new ATOM 0 HD12 LEU A 541 33.359 30.665 38.794 1.00 0.00 H new ATOM 0 HD13 LEU A 541 34.220 29.394 37.895 1.00 0.00 H new ATOM 0 HD21 LEU A 541 32.004 27.306 38.144 1.00 0.00 H new ATOM 0 HD22 LEU A 541 33.743 26.999 38.370 1.00 0.00 H new ATOM 0 HD23 LEU A 541 32.588 26.556 39.649 1.00 0.00 H new ATOM 454 N LYS A 542 36.203 26.756 42.281 1.00 0.00 N ATOM 455 CA LYS A 542 37.571 26.681 42.824 1.00 0.00 C ATOM 456 C LYS A 542 38.586 26.951 41.714 1.00 0.00 C ATOM 457 O LYS A 542 38.354 26.540 40.583 1.00 0.00 O ATOM 458 CB LYS A 542 37.720 25.295 43.486 1.00 0.00 C ATOM 459 CG LYS A 542 39.033 24.985 44.221 1.00 0.00 C ATOM 460 CD LYS A 542 40.112 24.422 43.288 1.00 0.00 C ATOM 461 CE LYS A 542 41.473 24.288 43.978 1.00 0.00 C ATOM 462 NZ LYS A 542 42.518 23.924 42.993 1.00 0.00 N ATOM 0 H LYS A 542 35.995 25.980 41.653 1.00 0.00 H new ATOM 0 HA LYS A 542 37.761 27.443 43.580 1.00 0.00 H new ATOM 0 HB2 LYS A 542 36.903 25.175 44.197 1.00 0.00 H new ATOM 0 HB3 LYS A 542 37.583 24.539 42.713 1.00 0.00 H new ATOM 0 HG2 LYS A 542 39.404 25.895 44.693 1.00 0.00 H new ATOM 0 HG3 LYS A 542 38.838 24.269 45.019 1.00 0.00 H new ATOM 0 HD2 LYS A 542 39.797 23.445 42.921 1.00 0.00 H new ATOM 0 HD3 LYS A 542 40.211 25.072 42.419 1.00 0.00 H new ATOM 0 HE2 LYS A 542 41.735 25.227 44.465 1.00 0.00 H new ATOM 0 HE3 LYS A 542 41.419 23.529 44.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 542 43.450 23.936 43.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 542 42.328 22.971 42.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 542 42.511 24.609 42.210 1.00 0.00 H new ATOM 476 N ALA A 543 39.718 27.595 42.013 1.00 0.00 N ATOM 477 CA ALA A 543 40.792 27.871 41.048 1.00 0.00 C ATOM 478 C ALA A 543 41.371 26.580 40.421 1.00 0.00 C ATOM 479 O ALA A 543 42.250 25.918 40.983 1.00 0.00 O ATOM 480 CB ALA A 543 41.866 28.704 41.759 1.00 0.00 C ATOM 0 H ALA A 543 39.920 27.946 42.949 1.00 0.00 H new ATOM 0 HA ALA A 543 40.388 28.434 40.207 1.00 0.00 H new ATOM 0 HB1 ALA A 543 42.676 28.923 41.064 1.00 0.00 H new ATOM 0 HB2 ALA A 543 41.428 29.638 42.112 1.00 0.00 H new ATOM 0 HB3 ALA A 543 42.258 28.144 42.608 1.00 0.00 H new ATOM 486 N GLY A 544 40.838 26.208 39.257 1.00 0.00 N ATOM 487 CA GLY A 544 41.110 24.967 38.532 1.00 0.00 C ATOM 488 C GLY A 544 39.863 24.214 38.059 1.00 0.00 C ATOM 489 O GLY A 544 39.999 23.274 37.278 1.00 0.00 O ATOM 0 H GLY A 544 40.166 26.799 38.767 1.00 0.00 H new ATOM 0 HA2 GLY A 544 41.729 25.197 37.665 1.00 0.00 H new ATOM 0 HA3 GLY A 544 41.694 24.308 39.174 1.00 0.00 H new ATOM 493 N ASP A 545 38.653 24.609 38.470 1.00 0.00 N ATOM 494 CA ASP A 545 37.417 23.924 38.088 1.00 0.00 C ATOM 495 C ASP A 545 37.027 24.105 36.624 1.00 0.00 C ATOM 496 O ASP A 545 36.812 25.239 36.192 1.00 0.00 O ATOM 497 CB ASP A 545 36.246 24.327 39.000 1.00 0.00 C ATOM 498 CG ASP A 545 36.233 23.670 40.380 1.00 0.00 C ATOM 499 OD1 ASP A 545 35.517 24.200 41.256 1.00 0.00 O ATOM 500 OD2 ASP A 545 36.856 22.601 40.594 1.00 0.00 O ATOM 0 H ASP A 545 38.505 25.414 39.078 1.00 0.00 H new ATOM 0 HA ASP A 545 37.633 22.864 38.220 1.00 0.00 H new ATOM 0 HB2 ASP A 545 36.266 25.409 39.132 1.00 0.00 H new ATOM 0 HB3 ASP A 545 35.312 24.085 38.492 1.00 0.00 H new ATOM 505 N VAL A 546 36.880 23.015 35.867 1.00 0.00 N ATOM 506 CA VAL A 546 36.170 23.068 34.584 1.00 0.00 C ATOM 507 C VAL A 546 34.667 23.231 34.809 1.00 0.00 C ATOM 508 O VAL A 546 34.087 22.557 35.666 1.00 0.00 O ATOM 509 CB VAL A 546 36.505 21.903 33.626 1.00 0.00 C ATOM 510 CG1 VAL A 546 36.072 22.245 32.199 1.00 0.00 C ATOM 511 CG2 VAL A 546 38.007 21.585 33.589 1.00 0.00 C ATOM 0 H VAL A 546 37.239 22.093 36.116 1.00 0.00 H new ATOM 0 HA VAL A 546 36.536 23.953 34.064 1.00 0.00 H new ATOM 0 HB VAL A 546 35.966 21.035 34.005 1.00 0.00 H new ATOM 0 HG11 VAL A 546 36.315 21.414 31.536 1.00 0.00 H new ATOM 0 HG12 VAL A 546 34.997 22.424 32.178 1.00 0.00 H new ATOM 0 HG13 VAL A 546 36.595 23.141 31.865 1.00 0.00 H new ATOM 0 HG21 VAL A 546 38.187 20.759 32.901 1.00 0.00 H new ATOM 0 HG22 VAL A 546 38.557 22.464 33.253 1.00 0.00 H new ATOM 0 HG23 VAL A 546 38.344 21.306 34.587 1.00 0.00 H new ATOM 521 N VAL A 547 34.036 24.115 34.039 1.00 0.00 N ATOM 522 CA VAL A 547 32.598 24.400 34.028 1.00 0.00 C ATOM 523 C VAL A 547 32.035 24.245 32.632 1.00 0.00 C ATOM 524 O VAL A 547 32.519 24.854 31.680 1.00 0.00 O ATOM 525 CB VAL A 547 32.201 25.758 34.661 1.00 0.00 C ATOM 526 CG1 VAL A 547 30.800 25.698 35.264 1.00 0.00 C ATOM 527 CG2 VAL A 547 33.181 26.260 35.721 1.00 0.00 C ATOM 0 H VAL A 547 34.543 24.687 33.364 1.00 0.00 H new ATOM 0 HA VAL A 547 32.144 23.654 34.680 1.00 0.00 H new ATOM 0 HB VAL A 547 32.226 26.470 33.836 1.00 0.00 H new ATOM 0 HG11 VAL A 547 30.550 26.665 35.700 1.00 0.00 H new ATOM 0 HG12 VAL A 547 30.078 25.454 34.484 1.00 0.00 H new ATOM 0 HG13 VAL A 547 30.770 24.932 36.039 1.00 0.00 H new ATOM 0 HG21 VAL A 547 32.833 27.215 36.115 1.00 0.00 H new ATOM 0 HG22 VAL A 547 33.244 25.534 36.531 1.00 0.00 H new ATOM 0 HG23 VAL A 547 34.166 26.390 35.273 1.00 0.00 H new ATOM 537 N LEU A 548 31.028 23.396 32.500 1.00 0.00 N ATOM 538 CA LEU A 548 30.329 23.149 31.255 1.00 0.00 C ATOM 539 C LEU A 548 29.295 24.269 31.056 1.00 0.00 C ATOM 540 O LEU A 548 28.228 24.239 31.675 1.00 0.00 O ATOM 541 CB LEU A 548 29.676 21.757 31.322 1.00 0.00 C ATOM 542 CG LEU A 548 30.546 20.568 31.775 1.00 0.00 C ATOM 543 CD1 LEU A 548 29.695 19.326 31.993 1.00 0.00 C ATOM 544 CD2 LEU A 548 31.629 20.215 30.773 1.00 0.00 C ATOM 0 H LEU A 548 30.667 22.846 33.279 1.00 0.00 H new ATOM 0 HA LEU A 548 31.007 23.155 30.402 1.00 0.00 H new ATOM 0 HB2 LEU A 548 28.822 21.821 31.996 1.00 0.00 H new ATOM 0 HB3 LEU A 548 29.283 21.525 30.332 1.00 0.00 H new ATOM 0 HG LEU A 548 31.016 20.887 32.705 1.00 0.00 H new ATOM 0 HD11 LEU A 548 30.331 18.500 32.312 1.00 0.00 H new ATOM 0 HD12 LEU A 548 28.948 19.527 32.761 1.00 0.00 H new ATOM 0 HD13 LEU A 548 29.195 19.060 31.062 1.00 0.00 H new ATOM 0 HD21 LEU A 548 32.209 19.371 31.146 1.00 0.00 H new ATOM 0 HD22 LEU A 548 31.171 19.947 29.821 1.00 0.00 H new ATOM 0 HD23 LEU A 548 32.287 21.073 30.631 1.00 0.00 H new ATOM 556 N VAL A 549 29.618 25.282 30.250 1.00 0.00 N ATOM 557 CA VAL A 549 28.666 26.363 29.903 1.00 0.00 C ATOM 558 C VAL A 549 27.424 25.889 29.132 1.00 0.00 C ATOM 559 O VAL A 549 27.524 25.186 28.121 1.00 0.00 O ATOM 560 CB VAL A 549 29.360 27.512 29.151 1.00 0.00 C ATOM 561 CG1 VAL A 549 28.513 28.780 29.075 1.00 0.00 C ATOM 562 CG2 VAL A 549 30.689 27.858 29.827 1.00 0.00 C ATOM 0 H VAL A 549 30.536 25.385 29.818 1.00 0.00 H new ATOM 0 HA VAL A 549 28.304 26.733 30.862 1.00 0.00 H new ATOM 0 HB VAL A 549 29.519 27.154 28.134 1.00 0.00 H new ATOM 0 HG11 VAL A 549 29.060 29.551 28.532 1.00 0.00 H new ATOM 0 HG12 VAL A 549 27.580 28.563 28.555 1.00 0.00 H new ATOM 0 HG13 VAL A 549 28.294 29.132 30.083 1.00 0.00 H new ATOM 0 HG21 VAL A 549 31.171 28.672 29.286 1.00 0.00 H new ATOM 0 HG22 VAL A 549 30.504 28.165 30.856 1.00 0.00 H new ATOM 0 HG23 VAL A 549 31.339 26.983 29.820 1.00 0.00 H new ATOM 572 N ILE A 550 26.244 26.328 29.576 1.00 0.00 N ATOM 573 CA ILE A 550 24.930 26.067 28.971 1.00 0.00 C ATOM 574 C ILE A 550 24.180 27.395 28.718 1.00 0.00 C ATOM 575 O ILE A 550 24.423 28.384 29.412 1.00 0.00 O ATOM 576 CB ILE A 550 24.096 25.114 29.862 1.00 0.00 C ATOM 577 CG1 ILE A 550 23.649 25.804 31.173 1.00 0.00 C ATOM 578 CG2 ILE A 550 24.851 23.797 30.119 1.00 0.00 C ATOM 579 CD1 ILE A 550 22.882 24.907 32.153 1.00 0.00 C ATOM 0 H ILE A 550 26.173 26.907 30.413 1.00 0.00 H new ATOM 0 HA ILE A 550 25.082 25.575 28.010 1.00 0.00 H new ATOM 0 HB ILE A 550 23.184 24.860 29.321 1.00 0.00 H new ATOM 0 HG12 ILE A 550 24.532 26.196 31.678 1.00 0.00 H new ATOM 0 HG13 ILE A 550 23.021 26.658 30.920 1.00 0.00 H new ATOM 0 HG21 ILE A 550 24.243 23.146 30.747 1.00 0.00 H new ATOM 0 HG22 ILE A 550 25.051 23.301 29.169 1.00 0.00 H new ATOM 0 HG23 ILE A 550 25.794 24.010 30.623 1.00 0.00 H new ATOM 0 HD11 ILE A 550 22.613 25.482 33.039 1.00 0.00 H new ATOM 0 HD12 ILE A 550 21.977 24.535 31.673 1.00 0.00 H new ATOM 0 HD13 ILE A 550 23.510 24.065 32.444 1.00 0.00 H new ATOM 591 N PRO A 551 23.249 27.432 27.750 1.00 0.00 N ATOM 592 CA PRO A 551 22.436 28.604 27.448 1.00 0.00 C ATOM 593 C PRO A 551 21.328 28.811 28.486 1.00 0.00 C ATOM 594 O PRO A 551 20.683 27.854 28.942 1.00 0.00 O ATOM 595 CB PRO A 551 21.864 28.336 26.057 1.00 0.00 C ATOM 596 CG PRO A 551 21.711 26.817 26.028 1.00 0.00 C ATOM 597 CD PRO A 551 22.916 26.350 26.843 1.00 0.00 C ATOM 0 HA PRO A 551 23.023 29.522 27.476 1.00 0.00 H new ATOM 0 HB2 PRO A 551 20.908 28.840 25.911 1.00 0.00 H new ATOM 0 HB3 PRO A 551 22.533 28.688 25.272 1.00 0.00 H new ATOM 0 HG2 PRO A 551 20.770 26.495 26.474 1.00 0.00 H new ATOM 0 HG3 PRO A 551 21.732 26.426 25.011 1.00 0.00 H new ATOM 0 HD2 PRO A 551 22.681 25.440 27.395 1.00 0.00 H new ATOM 0 HD3 PRO A 551 23.758 26.118 26.191 1.00 0.00 H new ATOM 605 N PHE A 552 21.063 30.076 28.810 1.00 0.00 N ATOM 606 CA PHE A 552 20.026 30.469 29.758 1.00 0.00 C ATOM 607 C PHE A 552 18.593 30.059 29.381 1.00 0.00 C ATOM 608 O PHE A 552 18.220 30.007 28.205 1.00 0.00 O ATOM 609 CB PHE A 552 20.098 31.964 30.111 1.00 0.00 C ATOM 610 CG PHE A 552 21.241 32.401 31.016 1.00 0.00 C ATOM 611 CD1 PHE A 552 22.550 32.521 30.506 1.00 0.00 C ATOM 612 CD2 PHE A 552 20.985 32.784 32.346 1.00 0.00 C ATOM 613 CE1 PHE A 552 23.588 33.015 31.316 1.00 0.00 C ATOM 614 CE2 PHE A 552 22.021 33.289 33.152 1.00 0.00 C ATOM 615 CZ PHE A 552 23.325 33.405 32.640 1.00 0.00 C ATOM 0 H PHE A 552 21.571 30.867 28.414 1.00 0.00 H new ATOM 0 HA PHE A 552 20.259 29.885 30.648 1.00 0.00 H new ATOM 0 HB2 PHE A 552 20.165 32.530 29.182 1.00 0.00 H new ATOM 0 HB3 PHE A 552 19.160 32.246 30.589 1.00 0.00 H new ATOM 0 HD1 PHE A 552 22.757 32.232 29.486 1.00 0.00 H new ATOM 0 HD2 PHE A 552 19.988 32.690 32.750 1.00 0.00 H new ATOM 0 HE1 PHE A 552 24.589 33.095 30.920 1.00 0.00 H new ATOM 0 HE2 PHE A 552 21.814 33.589 34.169 1.00 0.00 H new ATOM 0 HZ PHE A 552 24.120 33.792 33.261 1.00 0.00 H new ATOM 700 N GLN A 558 19.073 36.287 32.524 1.00 0.00 N ATOM 701 CA GLN A 558 20.517 36.448 32.358 1.00 0.00 C ATOM 702 C GLN A 558 21.016 37.802 32.872 1.00 0.00 C ATOM 703 O GLN A 558 20.581 38.869 32.426 1.00 0.00 O ATOM 704 CB GLN A 558 20.931 36.193 30.893 1.00 0.00 C ATOM 705 CG GLN A 558 22.413 36.520 30.626 1.00 0.00 C ATOM 706 CD GLN A 558 22.901 36.063 29.255 1.00 0.00 C ATOM 707 OE1 GLN A 558 22.216 36.172 28.238 1.00 0.00 O ATOM 708 NE2 GLN A 558 24.123 35.586 29.165 1.00 0.00 N ATOM 0 HA GLN A 558 21.004 35.695 32.977 1.00 0.00 H new ATOM 0 HB2 GLN A 558 20.743 35.149 30.644 1.00 0.00 H new ATOM 0 HB3 GLN A 558 20.306 36.795 30.234 1.00 0.00 H new ATOM 0 HG2 GLN A 558 22.561 37.596 30.715 1.00 0.00 H new ATOM 0 HG3 GLN A 558 23.025 36.050 31.396 1.00 0.00 H new ATOM 0 HE21 GLN A 558 24.697 35.493 30.003 1.00 0.00 H new ATOM 0 HE22 GLN A 558 24.497 35.309 28.257 1.00 0.00 H new ATOM 717 N ASP A 559 21.993 37.725 33.768 1.00 0.00 N ATOM 718 CA ASP A 559 22.695 38.863 34.347 1.00 0.00 C ATOM 719 C ASP A 559 23.813 39.321 33.380 1.00 0.00 C ATOM 720 O ASP A 559 24.449 38.505 32.699 1.00 0.00 O ATOM 721 CB ASP A 559 23.181 38.443 35.749 1.00 0.00 C ATOM 722 CG ASP A 559 22.049 37.948 36.662 1.00 0.00 C ATOM 723 OD1 ASP A 559 20.963 38.564 36.657 1.00 0.00 O ATOM 724 OD2 ASP A 559 22.208 36.946 37.402 1.00 0.00 O ATOM 0 H ASP A 559 22.331 36.831 34.125 1.00 0.00 H new ATOM 0 HA ASP A 559 22.055 39.735 34.477 1.00 0.00 H new ATOM 0 HB2 ASP A 559 23.927 37.654 35.646 1.00 0.00 H new ATOM 0 HB3 ASP A 559 23.676 39.290 36.223 1.00 0.00 H new ATOM 729 N GLU A 560 24.036 40.629 33.256 1.00 0.00 N ATOM 730 CA GLU A 560 25.010 41.201 32.314 1.00 0.00 C ATOM 731 C GLU A 560 26.442 41.035 32.851 1.00 0.00 C ATOM 732 O GLU A 560 26.738 41.435 33.979 1.00 0.00 O ATOM 733 CB GLU A 560 24.649 42.666 32.003 1.00 0.00 C ATOM 734 CG GLU A 560 25.634 43.326 31.023 1.00 0.00 C ATOM 735 CD GLU A 560 25.287 44.780 30.662 1.00 0.00 C ATOM 736 OE1 GLU A 560 26.119 45.429 29.980 1.00 0.00 O ATOM 737 OE2 GLU A 560 24.208 45.301 31.046 1.00 0.00 O ATOM 0 H GLU A 560 23.544 41.331 33.809 1.00 0.00 H new ATOM 0 HA GLU A 560 24.969 40.657 31.370 1.00 0.00 H new ATOM 0 HB2 GLU A 560 23.644 42.707 31.584 1.00 0.00 H new ATOM 0 HB3 GLU A 560 24.630 43.236 32.932 1.00 0.00 H new ATOM 0 HG2 GLU A 560 26.633 43.300 31.458 1.00 0.00 H new ATOM 0 HG3 GLU A 560 25.669 42.735 30.108 1.00 0.00 H new ATOM 744 N GLY A 561 27.331 40.437 32.052 1.00 0.00 N ATOM 745 CA GLY A 561 28.682 40.048 32.468 1.00 0.00 C ATOM 746 C GLY A 561 28.778 38.682 33.167 1.00 0.00 C ATOM 747 O GLY A 561 29.849 38.350 33.681 1.00 0.00 O ATOM 0 H GLY A 561 27.128 40.205 31.080 1.00 0.00 H new ATOM 0 HA2 GLY A 561 29.327 40.036 31.590 1.00 0.00 H new ATOM 0 HA3 GLY A 561 29.073 40.812 33.140 1.00 0.00 H new ATOM 751 N TRP A 562 27.691 37.901 33.199 1.00 0.00 N ATOM 752 CA TRP A 562 27.605 36.576 33.829 1.00 0.00 C ATOM 753 C TRP A 562 27.438 35.417 32.830 1.00 0.00 C ATOM 754 O TRP A 562 26.898 35.598 31.732 1.00 0.00 O ATOM 755 CB TRP A 562 26.471 36.593 34.864 1.00 0.00 C ATOM 756 CG TRP A 562 26.727 37.377 36.114 1.00 0.00 C ATOM 757 CD1 TRP A 562 26.804 38.723 36.212 1.00 0.00 C ATOM 758 CD2 TRP A 562 27.132 36.872 37.418 1.00 0.00 C ATOM 759 NE1 TRP A 562 27.190 39.073 37.488 1.00 0.00 N ATOM 760 CE2 TRP A 562 27.446 37.970 38.266 1.00 0.00 C ATOM 761 CE3 TRP A 562 27.236 35.588 37.975 1.00 0.00 C ATOM 762 CZ2 TRP A 562 27.885 37.802 39.586 1.00 0.00 C ATOM 763 CZ3 TRP A 562 27.675 35.401 39.296 1.00 0.00 C ATOM 764 CH2 TRP A 562 28.006 36.503 40.102 1.00 0.00 C ATOM 0 H TRP A 562 26.811 38.186 32.769 1.00 0.00 H new ATOM 0 HA TRP A 562 28.560 36.383 34.318 1.00 0.00 H new ATOM 0 HB2 TRP A 562 25.577 36.993 34.386 1.00 0.00 H new ATOM 0 HB3 TRP A 562 26.248 35.564 35.145 1.00 0.00 H new ATOM 0 HD1 TRP A 562 26.595 39.418 35.412 1.00 0.00 H new ATOM 0 HE1 TRP A 562 27.275 40.035 37.815 1.00 0.00 H new ATOM 0 HE3 TRP A 562 26.974 34.728 37.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 28.127 38.659 40.197 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 27.759 34.401 39.696 1.00 0.00 H new ATOM 0 HH2 TRP A 562 28.352 36.351 41.114 1.00 0.00 H new ATOM 775 N LEU A 563 27.836 34.205 33.229 1.00 0.00 N ATOM 776 CA LEU A 563 27.600 32.962 32.475 1.00 0.00 C ATOM 777 C LEU A 563 26.858 31.936 33.339 1.00 0.00 C ATOM 778 O LEU A 563 26.888 32.026 34.562 1.00 0.00 O ATOM 779 CB LEU A 563 28.935 32.382 31.963 1.00 0.00 C ATOM 780 CG LEU A 563 29.412 32.905 30.595 1.00 0.00 C ATOM 781 CD1 LEU A 563 30.723 32.203 30.229 1.00 0.00 C ATOM 782 CD2 LEU A 563 28.416 32.624 29.465 1.00 0.00 C ATOM 0 H LEU A 563 28.342 34.054 34.102 1.00 0.00 H new ATOM 0 HA LEU A 563 26.973 33.195 31.614 1.00 0.00 H new ATOM 0 HB2 LEU A 563 29.708 32.593 32.701 1.00 0.00 H new ATOM 0 HB3 LEU A 563 28.839 31.298 31.903 1.00 0.00 H new ATOM 0 HG LEU A 563 29.526 33.985 30.692 1.00 0.00 H new ATOM 0 HD11 LEU A 563 31.072 32.565 29.262 1.00 0.00 H new ATOM 0 HD12 LEU A 563 31.475 32.417 30.989 1.00 0.00 H new ATOM 0 HD13 LEU A 563 30.557 31.127 30.176 1.00 0.00 H new ATOM 0 HD21 LEU A 563 28.809 33.017 28.527 1.00 0.00 H new ATOM 0 HD22 LEU A 563 28.264 31.549 29.373 1.00 0.00 H new ATOM 0 HD23 LEU A 563 27.465 33.107 29.690 1.00 0.00 H new ATOM 794 N MET A 564 26.207 30.956 32.702 1.00 0.00 N ATOM 795 CA MET A 564 25.567 29.808 33.353 1.00 0.00 C ATOM 796 C MET A 564 26.198 28.488 32.903 1.00 0.00 C ATOM 797 O MET A 564 26.568 28.316 31.744 1.00 0.00 O ATOM 798 CB MET A 564 24.050 29.843 33.092 1.00 0.00 C ATOM 799 CG MET A 564 23.290 28.670 33.732 1.00 0.00 C ATOM 800 SD MET A 564 21.477 28.780 33.706 1.00 0.00 S ATOM 801 CE MET A 564 21.227 30.146 34.868 1.00 0.00 C ATOM 0 H MET A 564 26.108 30.940 31.687 1.00 0.00 H new ATOM 0 HA MET A 564 25.729 29.875 34.429 1.00 0.00 H new ATOM 0 HB2 MET A 564 23.645 30.780 33.475 1.00 0.00 H new ATOM 0 HB3 MET A 564 23.874 29.836 32.016 1.00 0.00 H new ATOM 0 HG2 MET A 564 23.585 27.752 33.223 1.00 0.00 H new ATOM 0 HG3 MET A 564 23.613 28.577 34.769 1.00 0.00 H new ATOM 0 HE1 MET A 564 20.174 30.429 34.876 1.00 0.00 H new ATOM 0 HE2 MET A 564 21.526 29.832 35.868 1.00 0.00 H new ATOM 0 HE3 MET A 564 21.830 31.000 34.560 1.00 0.00 H new ATOM 811 N GLY A 565 26.312 27.537 33.824 1.00 0.00 N ATOM 812 CA GLY A 565 26.852 26.211 33.569 1.00 0.00 C ATOM 813 C GLY A 565 26.718 25.279 34.769 1.00 0.00 C ATOM 814 O GLY A 565 26.030 25.577 35.749 1.00 0.00 O ATOM 0 H GLY A 565 26.023 27.673 34.793 1.00 0.00 H new ATOM 0 HA2 GLY A 565 26.337 25.772 32.714 1.00 0.00 H new ATOM 0 HA3 GLY A 565 27.904 26.298 33.298 1.00 0.00 H new ATOM 818 N VAL A 566 27.419 24.153 34.683 1.00 0.00 N ATOM 819 CA VAL A 566 27.580 23.167 35.760 1.00 0.00 C ATOM 820 C VAL A 566 29.039 22.728 35.829 1.00 0.00 C ATOM 821 O VAL A 566 29.693 22.607 34.793 1.00 0.00 O ATOM 822 CB VAL A 566 26.601 21.993 35.550 1.00 0.00 C ATOM 823 CG1 VAL A 566 26.890 21.223 34.254 1.00 0.00 C ATOM 824 CG2 VAL A 566 26.612 21.004 36.720 1.00 0.00 C ATOM 0 H VAL A 566 27.912 23.887 33.831 1.00 0.00 H new ATOM 0 HA VAL A 566 27.331 23.609 36.725 1.00 0.00 H new ATOM 0 HB VAL A 566 25.615 22.452 35.484 1.00 0.00 H new ATOM 0 HG11 VAL A 566 26.176 20.406 34.149 1.00 0.00 H new ATOM 0 HG12 VAL A 566 26.798 21.897 33.402 1.00 0.00 H new ATOM 0 HG13 VAL A 566 27.901 20.818 34.289 1.00 0.00 H new ATOM 0 HG21 VAL A 566 25.906 20.198 36.521 1.00 0.00 H new ATOM 0 HG22 VAL A 566 27.613 20.589 36.836 1.00 0.00 H new ATOM 0 HG23 VAL A 566 26.325 21.521 37.636 1.00 0.00 H new ATOM 834 N LYS A 567 29.588 22.512 37.025 1.00 0.00 N ATOM 835 CA LYS A 567 30.950 21.985 37.179 1.00 0.00 C ATOM 836 C LYS A 567 31.092 20.638 36.485 1.00 0.00 C ATOM 837 O LYS A 567 30.251 19.758 36.649 1.00 0.00 O ATOM 838 CB LYS A 567 31.335 21.890 38.661 1.00 0.00 C ATOM 839 CG LYS A 567 32.031 23.185 39.104 1.00 0.00 C ATOM 840 CD LYS A 567 32.416 23.166 40.584 1.00 0.00 C ATOM 841 CE LYS A 567 31.177 23.238 41.477 1.00 0.00 C ATOM 842 NZ LYS A 567 31.547 23.237 42.909 1.00 0.00 N ATOM 0 H LYS A 567 29.110 22.694 37.907 1.00 0.00 H new ATOM 0 HA LYS A 567 31.639 22.680 36.700 1.00 0.00 H new ATOM 0 HB2 LYS A 567 30.445 21.720 39.267 1.00 0.00 H new ATOM 0 HB3 LYS A 567 31.997 21.038 38.820 1.00 0.00 H new ATOM 0 HG2 LYS A 567 32.926 23.337 38.501 1.00 0.00 H new ATOM 0 HG3 LYS A 567 31.371 24.032 38.914 1.00 0.00 H new ATOM 0 HD2 LYS A 567 32.975 22.257 40.806 1.00 0.00 H new ATOM 0 HD3 LYS A 567 33.075 24.007 40.802 1.00 0.00 H new ATOM 0 HE2 LYS A 567 30.611 24.141 41.246 1.00 0.00 H new ATOM 0 HE3 LYS A 567 30.525 22.390 41.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 30.767 22.837 43.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 32.403 22.662 43.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 31.732 24.212 43.221 1.00 0.00 H new ATOM 856 N GLU A 568 32.180 20.453 35.746 1.00 0.00 N ATOM 857 CA GLU A 568 32.440 19.179 35.086 1.00 0.00 C ATOM 858 C GLU A 568 32.530 18.037 36.097 1.00 0.00 C ATOM 859 O GLU A 568 31.941 17.000 35.836 1.00 0.00 O ATOM 860 CB GLU A 568 33.689 19.257 34.206 1.00 0.00 C ATOM 861 CG GLU A 568 33.992 17.924 33.502 1.00 0.00 C ATOM 862 CD GLU A 568 34.990 18.133 32.365 1.00 0.00 C ATOM 863 OE1 GLU A 568 36.133 18.554 32.650 1.00 0.00 O ATOM 864 OE2 GLU A 568 34.681 17.810 31.198 1.00 0.00 O ATOM 0 H GLU A 568 32.893 21.165 35.589 1.00 0.00 H new ATOM 0 HA GLU A 568 31.595 18.964 34.432 1.00 0.00 H new ATOM 0 HB2 GLU A 568 33.555 20.038 33.458 1.00 0.00 H new ATOM 0 HB3 GLU A 568 34.544 19.545 34.818 1.00 0.00 H new ATOM 0 HG2 GLU A 568 34.395 17.210 34.220 1.00 0.00 H new ATOM 0 HG3 GLU A 568 33.070 17.495 33.110 1.00 0.00 H new ATOM 871 N SER A 569 33.144 18.223 37.275 1.00 0.00 N ATOM 872 CA SER A 569 33.229 17.137 38.268 1.00 0.00 C ATOM 873 C SER A 569 31.842 16.803 38.850 1.00 0.00 C ATOM 874 O SER A 569 31.503 15.634 39.024 1.00 0.00 O ATOM 875 CB SER A 569 34.240 17.511 39.357 1.00 0.00 C ATOM 876 OG SER A 569 34.630 16.382 40.118 1.00 0.00 O ATOM 0 H SER A 569 33.582 19.098 37.562 1.00 0.00 H new ATOM 0 HA SER A 569 33.582 16.231 37.776 1.00 0.00 H new ATOM 0 HB2 SER A 569 35.120 17.962 38.898 1.00 0.00 H new ATOM 0 HB3 SER A 569 33.804 18.262 40.016 1.00 0.00 H new ATOM 0 HG SER A 569 35.276 16.656 40.802 1.00 0.00 H new ATOM 882 N ASP A 570 30.979 17.813 39.027 1.00 0.00 N ATOM 883 CA ASP A 570 29.566 17.657 39.408 1.00 0.00 C ATOM 884 C ASP A 570 28.679 16.941 38.365 1.00 0.00 C ATOM 885 O ASP A 570 27.752 16.199 38.705 1.00 0.00 O ATOM 886 CB ASP A 570 28.979 19.033 39.779 1.00 0.00 C ATOM 887 CG ASP A 570 29.395 19.615 41.136 1.00 0.00 C ATOM 888 OD1 ASP A 570 30.098 18.957 41.942 1.00 0.00 O ATOM 889 OD2 ASP A 570 29.014 20.778 41.398 1.00 0.00 O ATOM 0 H ASP A 570 31.251 18.789 38.906 1.00 0.00 H new ATOM 0 HA ASP A 570 29.560 16.991 40.271 1.00 0.00 H new ATOM 0 HB2 ASP A 570 29.261 19.744 39.003 1.00 0.00 H new ATOM 0 HB3 ASP A 570 27.892 18.956 39.761 1.00 0.00 H new ATOM 894 N TRP A 571 28.977 17.138 37.079 1.00 0.00 N ATOM 895 CA TRP A 571 28.315 16.475 35.948 1.00 0.00 C ATOM 896 C TRP A 571 28.894 15.079 35.637 1.00 0.00 C ATOM 897 O TRP A 571 28.154 14.165 35.274 1.00 0.00 O ATOM 898 CB TRP A 571 28.358 17.442 34.756 1.00 0.00 C ATOM 899 CG TRP A 571 27.781 16.943 33.466 1.00 0.00 C ATOM 900 CD1 TRP A 571 28.476 16.319 32.490 1.00 0.00 C ATOM 901 CD2 TRP A 571 26.375 16.815 33.086 1.00 0.00 C ATOM 902 NE1 TRP A 571 27.619 15.862 31.511 1.00 0.00 N ATOM 903 CE2 TRP A 571 26.307 16.134 31.833 1.00 0.00 C ATOM 904 CE3 TRP A 571 25.152 17.223 33.664 1.00 0.00 C ATOM 905 CZ2 TRP A 571 25.090 15.858 31.198 1.00 0.00 C ATOM 906 CZ3 TRP A 571 23.924 16.959 33.025 1.00 0.00 C ATOM 907 CH2 TRP A 571 23.889 16.262 31.805 1.00 0.00 C ATOM 0 H TRP A 571 29.709 17.784 36.784 1.00 0.00 H new ATOM 0 HA TRP A 571 27.277 16.260 36.201 1.00 0.00 H new ATOM 0 HB2 TRP A 571 27.828 18.352 35.037 1.00 0.00 H new ATOM 0 HB3 TRP A 571 29.397 17.719 34.580 1.00 0.00 H new ATOM 0 HD1 TRP A 571 29.549 16.196 32.478 1.00 0.00 H new ATOM 0 HE1 TRP A 571 27.917 15.385 30.660 1.00 0.00 H new ATOM 0 HE3 TRP A 571 25.158 17.745 34.610 1.00 0.00 H new ATOM 0 HZ2 TRP A 571 25.075 15.340 30.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 571 23.002 17.295 33.476 1.00 0.00 H new ATOM 0 HH2 TRP A 571 22.942 16.038 31.336 1.00 0.00 H new ATOM 918 N ASN A 572 30.195 14.873 35.867 1.00 0.00 N ATOM 919 CA ASN A 572 30.919 13.594 35.791 1.00 0.00 C ATOM 920 C ASN A 572 30.619 12.685 37.008 1.00 0.00 C ATOM 921 O ASN A 572 30.916 11.492 36.992 1.00 0.00 O ATOM 922 CB ASN A 572 32.422 13.937 35.699 1.00 0.00 C ATOM 923 CG ASN A 572 33.297 12.892 35.039 1.00 0.00 C ATOM 924 OD1 ASN A 572 32.866 11.831 34.611 1.00 0.00 O ATOM 925 ND2 ASN A 572 34.548 13.231 34.840 1.00 0.00 N ATOM 0 H ASN A 572 30.812 15.642 36.128 1.00 0.00 H new ATOM 0 HA ASN A 572 30.596 13.028 34.917 1.00 0.00 H new ATOM 0 HB2 ASN A 572 32.529 14.873 35.150 1.00 0.00 H new ATOM 0 HB3 ASN A 572 32.797 14.114 36.707 1.00 0.00 H new ATOM 0 HD21 ASN A 572 35.170 12.608 34.325 1.00 0.00 H new ATOM 0 HD22 ASN A 572 34.900 14.118 35.200 1.00 0.00 H new ATOM 932 N GLN A 573 30.020 13.240 38.067 1.00 0.00 N ATOM 933 CA GLN A 573 29.331 12.532 39.159 1.00 0.00 C ATOM 934 C GLN A 573 27.875 12.136 38.826 1.00 0.00 C ATOM 935 O GLN A 573 27.204 11.487 39.636 1.00 0.00 O ATOM 936 CB GLN A 573 29.364 13.439 40.400 1.00 0.00 C ATOM 937 CG GLN A 573 30.715 13.417 41.130 1.00 0.00 C ATOM 938 CD GLN A 573 30.734 12.549 42.385 1.00 0.00 C ATOM 939 OE1 GLN A 573 29.816 11.808 42.705 1.00 0.00 O ATOM 940 NE2 GLN A 573 31.779 12.633 43.171 1.00 0.00 N ATOM 0 H GLN A 573 30.000 14.252 38.195 1.00 0.00 H new ATOM 0 HA GLN A 573 29.854 11.591 39.332 1.00 0.00 H new ATOM 0 HB2 GLN A 573 29.137 14.462 40.100 1.00 0.00 H new ATOM 0 HB3 GLN A 573 28.580 13.128 41.090 1.00 0.00 H new ATOM 0 HG2 GLN A 573 31.481 13.059 40.442 1.00 0.00 H new ATOM 0 HG3 GLN A 573 30.984 14.437 41.403 1.00 0.00 H new ATOM 0 HE21 GLN A 573 32.556 13.245 42.923 1.00 0.00 H new ATOM 0 HE22 GLN A 573 31.815 12.086 44.031 1.00 0.00 H new ATOM 949 N HIS A 574 27.365 12.547 37.660 1.00 0.00 N ATOM 950 CA HIS A 574 26.004 12.288 37.166 1.00 0.00 C ATOM 951 C HIS A 574 24.871 12.786 38.097 1.00 0.00 C ATOM 952 O HIS A 574 23.760 12.243 38.114 1.00 0.00 O ATOM 953 CB HIS A 574 25.879 10.832 36.676 1.00 0.00 C ATOM 954 CG HIS A 574 26.968 10.447 35.697 1.00 0.00 C ATOM 955 ND1 HIS A 574 27.223 11.055 34.488 1.00 0.00 N ATOM 956 CD2 HIS A 574 27.865 9.420 35.821 1.00 0.00 C ATOM 957 CE1 HIS A 574 28.276 10.450 33.917 1.00 0.00 C ATOM 958 NE2 HIS A 574 28.692 9.422 34.683 1.00 0.00 N ATOM 0 H HIS A 574 27.916 13.097 37.001 1.00 0.00 H new ATOM 0 HA HIS A 574 25.845 12.919 36.292 1.00 0.00 H new ATOM 0 HB2 HIS A 574 25.914 10.160 37.534 1.00 0.00 H new ATOM 0 HB3 HIS A 574 24.907 10.695 36.203 1.00 0.00 H new ATOM 0 HD2 HIS A 574 27.927 8.729 36.648 1.00 0.00 H new ATOM 0 HE1 HIS A 574 28.725 10.744 32.980 1.00 0.00 H new ATOM 0 HE2 HIS A 574 29.454 8.775 34.479 1.00 0.00 H new ATOM 966 N LYS A 575 25.158 13.838 38.879 1.00 0.00 N ATOM 967 CA LYS A 575 24.242 14.495 39.831 1.00 0.00 C ATOM 968 C LYS A 575 23.151 15.319 39.137 1.00 0.00 C ATOM 969 O LYS A 575 23.301 15.698 37.972 1.00 0.00 O ATOM 970 CB LYS A 575 25.061 15.375 40.796 1.00 0.00 C ATOM 971 CG LYS A 575 25.979 14.549 41.715 1.00 0.00 C ATOM 972 CD LYS A 575 27.183 15.337 42.249 1.00 0.00 C ATOM 973 CE LYS A 575 26.858 16.567 43.095 1.00 0.00 C ATOM 974 NZ LYS A 575 26.126 16.233 44.337 1.00 0.00 N ATOM 0 H LYS A 575 26.079 14.277 38.866 1.00 0.00 H new ATOM 0 HA LYS A 575 23.723 13.714 40.387 1.00 0.00 H new ATOM 0 HB2 LYS A 575 25.665 16.075 40.219 1.00 0.00 H new ATOM 0 HB3 LYS A 575 24.381 15.969 41.407 1.00 0.00 H new ATOM 0 HG2 LYS A 575 25.396 14.177 42.558 1.00 0.00 H new ATOM 0 HG3 LYS A 575 26.339 13.678 41.167 1.00 0.00 H new ATOM 0 HD2 LYS A 575 27.797 14.663 42.845 1.00 0.00 H new ATOM 0 HD3 LYS A 575 27.789 15.654 41.401 1.00 0.00 H new ATOM 0 HE2 LYS A 575 27.785 17.080 43.352 1.00 0.00 H new ATOM 0 HE3 LYS A 575 26.262 17.262 42.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 25.932 17.104 44.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 25.228 15.768 44.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 26.703 15.592 44.918 1.00 0.00 H new ATOM 988 N GLU A 576 22.082 15.632 39.868 1.00 0.00 N ATOM 989 CA GLU A 576 20.939 16.427 39.399 1.00 0.00 C ATOM 990 C GLU A 576 21.324 17.851 38.942 1.00 0.00 C ATOM 991 O GLU A 576 21.566 18.755 39.748 1.00 0.00 O ATOM 992 CB GLU A 576 19.811 16.433 40.451 1.00 0.00 C ATOM 993 CG GLU A 576 20.260 16.765 41.886 1.00 0.00 C ATOM 994 CD GLU A 576 19.096 17.016 42.864 1.00 0.00 C ATOM 995 OE1 GLU A 576 19.376 17.394 44.028 1.00 0.00 O ATOM 996 OE2 GLU A 576 17.900 16.848 42.514 1.00 0.00 O ATOM 0 H GLU A 576 21.981 15.330 40.837 1.00 0.00 H new ATOM 0 HA GLU A 576 20.562 15.937 38.501 1.00 0.00 H new ATOM 0 HB2 GLU A 576 19.055 17.157 40.147 1.00 0.00 H new ATOM 0 HB3 GLU A 576 19.332 15.454 40.454 1.00 0.00 H new ATOM 0 HG2 GLU A 576 20.869 15.944 42.265 1.00 0.00 H new ATOM 0 HG3 GLU A 576 20.897 17.649 41.861 1.00 0.00 H new ATOM 1003 N LEU A 577 21.341 18.057 37.623 1.00 0.00 N ATOM 1004 CA LEU A 577 21.781 19.282 36.947 1.00 0.00 C ATOM 1005 C LEU A 577 21.002 20.519 37.418 1.00 0.00 C ATOM 1006 O LEU A 577 21.595 21.553 37.705 1.00 0.00 O ATOM 1007 CB LEU A 577 21.616 19.031 35.438 1.00 0.00 C ATOM 1008 CG LEU A 577 21.860 20.233 34.507 1.00 0.00 C ATOM 1009 CD1 LEU A 577 23.290 20.751 34.601 1.00 0.00 C ATOM 1010 CD2 LEU A 577 21.565 19.903 33.043 1.00 0.00 C ATOM 0 H LEU A 577 21.034 17.341 36.965 1.00 0.00 H new ATOM 0 HA LEU A 577 22.821 19.501 37.189 1.00 0.00 H new ATOM 0 HB2 LEU A 577 22.299 18.232 35.149 1.00 0.00 H new ATOM 0 HB3 LEU A 577 20.605 18.664 35.262 1.00 0.00 H new ATOM 0 HG LEU A 577 21.170 21.004 34.849 1.00 0.00 H new ATOM 0 HD11 LEU A 577 23.415 21.598 33.927 1.00 0.00 H new ATOM 0 HD12 LEU A 577 23.496 21.067 35.624 1.00 0.00 H new ATOM 0 HD13 LEU A 577 23.983 19.958 34.320 1.00 0.00 H new ATOM 0 HD21 LEU A 577 21.752 20.783 32.427 1.00 0.00 H new ATOM 0 HD22 LEU A 577 22.210 19.087 32.717 1.00 0.00 H new ATOM 0 HD23 LEU A 577 20.522 19.604 32.941 1.00 0.00 H new ATOM 1022 N GLU A 578 19.684 20.388 37.573 1.00 0.00 N ATOM 1023 CA GLU A 578 18.785 21.448 38.049 1.00 0.00 C ATOM 1024 C GLU A 578 19.168 22.046 39.418 1.00 0.00 C ATOM 1025 O GLU A 578 18.979 23.240 39.660 1.00 0.00 O ATOM 1026 CB GLU A 578 17.354 20.888 38.093 1.00 0.00 C ATOM 1027 CG GLU A 578 17.173 19.582 38.897 1.00 0.00 C ATOM 1028 CD GLU A 578 17.208 18.286 38.070 1.00 0.00 C ATOM 1029 OE1 GLU A 578 17.656 18.293 36.896 1.00 0.00 O ATOM 1030 OE2 GLU A 578 16.777 17.230 38.597 1.00 0.00 O ATOM 0 H GLU A 578 19.195 19.517 37.366 1.00 0.00 H new ATOM 0 HA GLU A 578 18.869 22.277 37.346 1.00 0.00 H new ATOM 0 HB2 GLU A 578 16.698 21.648 38.517 1.00 0.00 H new ATOM 0 HB3 GLU A 578 17.020 20.713 37.070 1.00 0.00 H new ATOM 0 HG2 GLU A 578 17.955 19.531 39.654 1.00 0.00 H new ATOM 0 HG3 GLU A 578 16.221 19.630 39.425 1.00 0.00 H new ATOM 1037 N LYS A 579 19.737 21.231 40.314 1.00 0.00 N ATOM 1038 CA LYS A 579 20.206 21.626 41.644 1.00 0.00 C ATOM 1039 C LYS A 579 21.658 22.097 41.589 1.00 0.00 C ATOM 1040 O LYS A 579 21.990 23.128 42.178 1.00 0.00 O ATOM 1041 CB LYS A 579 20.052 20.417 42.582 1.00 0.00 C ATOM 1042 CG LYS A 579 20.031 20.785 44.070 1.00 0.00 C ATOM 1043 CD LYS A 579 18.741 21.474 44.530 1.00 0.00 C ATOM 1044 CE LYS A 579 17.457 20.667 44.295 1.00 0.00 C ATOM 1045 NZ LYS A 579 17.476 19.331 44.940 1.00 0.00 N ATOM 0 H LYS A 579 19.888 20.240 40.123 1.00 0.00 H new ATOM 0 HA LYS A 579 19.614 22.461 42.017 1.00 0.00 H new ATOM 0 HB2 LYS A 579 19.129 19.892 42.334 1.00 0.00 H new ATOM 0 HB3 LYS A 579 20.872 19.722 42.401 1.00 0.00 H new ATOM 0 HG2 LYS A 579 20.175 19.879 44.659 1.00 0.00 H new ATOM 0 HG3 LYS A 579 20.875 21.441 44.282 1.00 0.00 H new ATOM 0 HD2 LYS A 579 18.824 21.695 45.594 1.00 0.00 H new ATOM 0 HD3 LYS A 579 18.652 22.429 44.012 1.00 0.00 H new ATOM 0 HE2 LYS A 579 16.606 21.233 44.674 1.00 0.00 H new ATOM 0 HE3 LYS A 579 17.306 20.543 43.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 16.562 18.858 44.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 18.237 18.756 44.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 17.642 19.441 45.961 1.00 0.00 H new ATOM 1059 N CYS A 580 22.488 21.357 40.850 1.00 0.00 N ATOM 1060 CA CYS A 580 23.938 21.519 40.746 1.00 0.00 C ATOM 1061 C CYS A 580 24.404 22.718 39.896 1.00 0.00 C ATOM 1062 O CYS A 580 25.510 23.219 40.105 1.00 0.00 O ATOM 1063 CB CYS A 580 24.506 20.189 40.219 1.00 0.00 C ATOM 1064 SG CYS A 580 24.378 18.906 41.495 1.00 0.00 S ATOM 0 H CYS A 580 22.146 20.586 40.277 1.00 0.00 H new ATOM 0 HA CYS A 580 24.324 21.757 41.737 1.00 0.00 H new ATOM 0 HB2 CYS A 580 23.962 19.881 39.326 1.00 0.00 H new ATOM 0 HB3 CYS A 580 25.548 20.320 39.927 1.00 0.00 H new ATOM 0 HG CYS A 580 23.230 18.305 41.393 1.00 0.00 H new ATOM 1070 N ARG A 581 23.583 23.196 38.950 1.00 0.00 N ATOM 1071 CA ARG A 581 23.866 24.365 38.094 1.00 0.00 C ATOM 1072 C ARG A 581 23.994 25.672 38.869 1.00 0.00 C ATOM 1073 O ARG A 581 23.533 25.808 40.006 1.00 0.00 O ATOM 1074 CB ARG A 581 22.780 24.497 37.005 1.00 0.00 C ATOM 1075 CG ARG A 581 21.394 24.913 37.547 1.00 0.00 C ATOM 1076 CD ARG A 581 20.360 24.922 36.417 1.00 0.00 C ATOM 1077 NE ARG A 581 19.024 25.383 36.854 1.00 0.00 N ATOM 1078 CZ ARG A 581 18.507 26.595 36.739 1.00 0.00 C ATOM 1079 NH1 ARG A 581 19.212 27.667 36.516 1.00 0.00 N ATOM 1080 NH2 ARG A 581 17.227 26.750 36.863 1.00 0.00 N ATOM 0 H ARG A 581 22.678 22.771 38.751 1.00 0.00 H new ATOM 0 HA ARG A 581 24.838 24.184 37.636 1.00 0.00 H new ATOM 0 HB2 ARG A 581 23.106 25.231 36.268 1.00 0.00 H new ATOM 0 HB3 ARG A 581 22.684 23.544 36.484 1.00 0.00 H new ATOM 0 HG2 ARG A 581 21.080 24.223 38.330 1.00 0.00 H new ATOM 0 HG3 ARG A 581 21.456 25.902 38.000 1.00 0.00 H new ATOM 0 HD2 ARG A 581 20.715 25.567 35.613 1.00 0.00 H new ATOM 0 HD3 ARG A 581 20.273 23.917 36.004 1.00 0.00 H new ATOM 0 HE ARG A 581 18.430 24.682 37.297 1.00 0.00 H new ATOM 0 HH11 ARG A 581 20.225 27.600 36.420 1.00 0.00 H new ATOM 0 HH12 ARG A 581 18.751 28.573 36.438 1.00 0.00 H new ATOM 0 HH21 ARG A 581 16.631 25.943 37.047 1.00 0.00 H new ATOM 0 HH22 ARG A 581 16.815 27.679 36.777 1.00 0.00 H new ATOM 1094 N GLY A 582 24.535 26.676 38.191 1.00 0.00 N ATOM 1095 CA GLY A 582 24.460 28.058 38.644 1.00 0.00 C ATOM 1096 C GLY A 582 24.985 29.084 37.645 1.00 0.00 C ATOM 1097 O GLY A 582 25.539 28.729 36.603 1.00 0.00 O ATOM 0 H GLY A 582 25.038 26.555 37.312 1.00 0.00 H new ATOM 0 HA2 GLY A 582 23.422 28.295 38.876 1.00 0.00 H new ATOM 0 HA3 GLY A 582 25.023 28.153 39.572 1.00 0.00 H new ATOM 1101 N VAL A 583 24.827 30.359 37.998 1.00 0.00 N ATOM 1102 CA VAL A 583 25.502 31.487 37.345 1.00 0.00 C ATOM 1103 C VAL A 583 26.816 31.821 38.046 1.00 0.00 C ATOM 1104 O VAL A 583 26.917 31.747 39.269 1.00 0.00 O ATOM 1105 CB VAL A 583 24.623 32.751 37.226 1.00 0.00 C ATOM 1106 CG1 VAL A 583 23.352 32.498 36.422 1.00 0.00 C ATOM 1107 CG2 VAL A 583 24.212 33.355 38.572 1.00 0.00 C ATOM 0 H VAL A 583 24.214 30.646 38.761 1.00 0.00 H new ATOM 0 HA VAL A 583 25.709 31.156 36.327 1.00 0.00 H new ATOM 0 HB VAL A 583 25.266 33.463 36.709 1.00 0.00 H new ATOM 0 HG11 VAL A 583 22.768 33.416 36.367 1.00 0.00 H new ATOM 0 HG12 VAL A 583 23.617 32.175 35.415 1.00 0.00 H new ATOM 0 HG13 VAL A 583 22.762 31.721 36.909 1.00 0.00 H new ATOM 0 HG21 VAL A 583 23.597 34.239 38.402 1.00 0.00 H new ATOM 0 HG22 VAL A 583 23.642 32.621 39.142 1.00 0.00 H new ATOM 0 HG23 VAL A 583 25.104 33.636 39.132 1.00 0.00 H new ATOM 1117 N PHE A 584 27.814 32.226 37.273 1.00 0.00 N ATOM 1118 CA PHE A 584 29.132 32.649 37.754 1.00 0.00 C ATOM 1119 C PHE A 584 29.670 33.892 37.023 1.00 0.00 C ATOM 1120 O PHE A 584 29.288 34.129 35.869 1.00 0.00 O ATOM 1121 CB PHE A 584 30.129 31.490 37.694 1.00 0.00 C ATOM 1122 CG PHE A 584 30.278 30.862 36.324 1.00 0.00 C ATOM 1123 CD1 PHE A 584 31.328 31.270 35.479 1.00 0.00 C ATOM 1124 CD2 PHE A 584 29.368 29.881 35.888 1.00 0.00 C ATOM 1125 CE1 PHE A 584 31.472 30.686 34.211 1.00 0.00 C ATOM 1126 CE2 PHE A 584 29.524 29.286 34.626 1.00 0.00 C ATOM 1127 CZ PHE A 584 30.581 29.684 33.793 1.00 0.00 C ATOM 0 H PHE A 584 27.730 32.273 36.257 1.00 0.00 H new ATOM 0 HA PHE A 584 29.006 32.944 38.796 1.00 0.00 H new ATOM 0 HB2 PHE A 584 31.104 31.848 38.024 1.00 0.00 H new ATOM 0 HB3 PHE A 584 29.816 30.721 38.400 1.00 0.00 H new ATOM 0 HD1 PHE A 584 32.021 32.031 35.806 1.00 0.00 H new ATOM 0 HD2 PHE A 584 28.548 29.585 36.526 1.00 0.00 H new ATOM 0 HE1 PHE A 584 32.268 31.007 33.556 1.00 0.00 H new ATOM 0 HE2 PHE A 584 28.833 28.524 34.297 1.00 0.00 H new ATOM 0 HZ PHE A 584 30.710 29.218 32.827 1.00 0.00 H new ATOM 1137 N PRO A 585 30.556 34.687 37.654 1.00 0.00 N ATOM 1138 CA PRO A 585 31.262 35.754 36.957 1.00 0.00 C ATOM 1139 C PRO A 585 32.213 35.137 35.925 1.00 0.00 C ATOM 1140 O PRO A 585 33.235 34.549 36.268 1.00 0.00 O ATOM 1141 CB PRO A 585 32.000 36.528 38.050 1.00 0.00 C ATOM 1142 CG PRO A 585 32.241 35.487 39.144 1.00 0.00 C ATOM 1143 CD PRO A 585 31.011 34.593 39.040 1.00 0.00 C ATOM 0 HA PRO A 585 30.604 36.423 36.403 1.00 0.00 H new ATOM 0 HB2 PRO A 585 32.938 36.943 37.681 1.00 0.00 H new ATOM 0 HB3 PRO A 585 31.405 37.363 38.418 1.00 0.00 H new ATOM 0 HG2 PRO A 585 33.162 34.929 38.975 1.00 0.00 H new ATOM 0 HG3 PRO A 585 32.324 35.947 40.129 1.00 0.00 H new ATOM 0 HD2 PRO A 585 31.255 33.563 39.301 1.00 0.00 H new ATOM 0 HD3 PRO A 585 30.232 34.920 39.729 1.00 0.00 H new ATOM 1151 N GLU A 586 31.892 35.275 34.640 1.00 0.00 N ATOM 1152 CA GLU A 586 32.683 34.719 33.529 1.00 0.00 C ATOM 1153 C GLU A 586 34.138 35.235 33.498 1.00 0.00 C ATOM 1154 O GLU A 586 35.029 34.590 32.951 1.00 0.00 O ATOM 1155 CB GLU A 586 31.945 35.058 32.223 1.00 0.00 C ATOM 1156 CG GLU A 586 32.041 36.551 31.875 1.00 0.00 C ATOM 1157 CD GLU A 586 30.981 37.048 30.880 1.00 0.00 C ATOM 1158 OE1 GLU A 586 31.310 37.935 30.055 1.00 0.00 O ATOM 1159 OE2 GLU A 586 29.809 36.614 30.907 1.00 0.00 O ATOM 0 H GLU A 586 31.064 35.783 34.330 1.00 0.00 H new ATOM 0 HA GLU A 586 32.769 33.641 33.662 1.00 0.00 H new ATOM 0 HB2 GLU A 586 32.364 34.469 31.407 1.00 0.00 H new ATOM 0 HB3 GLU A 586 30.897 34.775 32.316 1.00 0.00 H new ATOM 0 HG2 GLU A 586 31.957 37.131 32.794 1.00 0.00 H new ATOM 0 HG3 GLU A 586 33.030 36.751 31.462 1.00 0.00 H new ATOM 1166 N ASN A 587 34.396 36.383 34.127 1.00 0.00 N ATOM 1167 CA ASN A 587 35.718 36.974 34.316 1.00 0.00 C ATOM 1168 C ASN A 587 36.589 36.252 35.369 1.00 0.00 C ATOM 1169 O ASN A 587 37.779 36.548 35.486 1.00 0.00 O ATOM 1170 CB ASN A 587 35.543 38.472 34.625 1.00 0.00 C ATOM 1171 CG ASN A 587 34.584 38.774 35.762 1.00 0.00 C ATOM 1172 OD1 ASN A 587 33.395 38.496 35.684 1.00 0.00 O ATOM 1173 ND2 ASN A 587 35.036 39.413 36.805 1.00 0.00 N ATOM 0 H ASN A 587 33.654 36.950 34.536 1.00 0.00 H new ATOM 0 HA ASN A 587 36.279 36.849 33.390 1.00 0.00 H new ATOM 0 HB2 ASN A 587 36.518 38.896 34.867 1.00 0.00 H new ATOM 0 HB3 ASN A 587 35.190 38.976 33.726 1.00 0.00 H new ATOM 0 HD21 ASN A 587 34.399 39.681 37.555 1.00 0.00 H new ATOM 0 HD22 ASN A 587 36.027 39.645 36.871 1.00 0.00 H new ATOM 1180 N PHE A 588 36.028 35.293 36.115 1.00 0.00 N ATOM 1181 CA PHE A 588 36.778 34.360 36.965 1.00 0.00 C ATOM 1182 C PHE A 588 37.370 33.140 36.262 1.00 0.00 C ATOM 1183 O PHE A 588 38.238 32.459 36.809 1.00 0.00 O ATOM 1184 CB PHE A 588 35.996 33.972 38.229 1.00 0.00 C ATOM 1185 CG PHE A 588 36.063 34.982 39.357 1.00 0.00 C ATOM 1186 CD1 PHE A 588 35.518 36.271 39.204 1.00 0.00 C ATOM 1187 CD2 PHE A 588 36.677 34.625 40.571 1.00 0.00 C ATOM 1188 CE1 PHE A 588 35.578 37.193 40.260 1.00 0.00 C ATOM 1189 CE2 PHE A 588 36.757 35.556 41.621 1.00 0.00 C ATOM 1190 CZ PHE A 588 36.200 36.837 41.468 1.00 0.00 C ATOM 0 H PHE A 588 35.020 35.141 36.145 1.00 0.00 H new ATOM 0 HA PHE A 588 37.654 34.936 37.265 1.00 0.00 H new ATOM 0 HB2 PHE A 588 34.951 33.819 37.959 1.00 0.00 H new ATOM 0 HB3 PHE A 588 36.374 33.017 38.593 1.00 0.00 H new ATOM 0 HD1 PHE A 588 35.052 36.551 38.271 1.00 0.00 H new ATOM 0 HD2 PHE A 588 37.088 33.634 40.697 1.00 0.00 H new ATOM 0 HE1 PHE A 588 35.146 38.176 40.144 1.00 0.00 H new ATOM 0 HE2 PHE A 588 37.247 35.287 42.545 1.00 0.00 H new ATOM 0 HZ PHE A 588 36.250 37.548 42.279 1.00 0.00 H new ATOM 1200 N THR A 589 36.888 32.848 35.056 1.00 0.00 N ATOM 1201 CA THR A 589 37.195 31.645 34.291 1.00 0.00 C ATOM 1202 C THR A 589 37.796 32.068 32.938 1.00 0.00 C ATOM 1203 O THR A 589 38.003 33.252 32.646 1.00 0.00 O ATOM 1204 CB THR A 589 35.890 30.838 34.116 1.00 0.00 C ATOM 1205 OG1 THR A 589 34.820 31.656 33.697 1.00 0.00 O ATOM 1206 CG2 THR A 589 35.397 30.164 35.407 1.00 0.00 C ATOM 0 H THR A 589 36.246 33.471 34.566 1.00 0.00 H new ATOM 0 HA THR A 589 37.922 31.014 34.802 1.00 0.00 H new ATOM 0 HB THR A 589 36.155 30.086 33.373 1.00 0.00 H new ATOM 0 HG1 THR A 589 34.285 31.178 33.030 1.00 0.00 H new ATOM 0 HG21 THR A 589 34.477 29.617 35.203 1.00 0.00 H new ATOM 0 HG22 THR A 589 36.158 29.473 35.770 1.00 0.00 H new ATOM 0 HG23 THR A 589 35.207 30.924 36.165 1.00 0.00 H new ATOM 1214 N GLU A 590 38.139 31.092 32.102 1.00 0.00 N ATOM 1215 CA GLU A 590 38.544 31.320 30.711 1.00 0.00 C ATOM 1216 C GLU A 590 37.966 30.224 29.803 1.00 0.00 C ATOM 1217 O GLU A 590 37.936 29.059 30.205 1.00 0.00 O ATOM 1218 CB GLU A 590 40.082 31.421 30.628 1.00 0.00 C ATOM 1219 CG GLU A 590 40.834 30.091 30.463 1.00 0.00 C ATOM 1220 CD GLU A 590 42.356 30.258 30.334 1.00 0.00 C ATOM 1221 OE1 GLU A 590 43.022 29.223 30.086 1.00 0.00 O ATOM 1222 OE2 GLU A 590 42.885 31.396 30.411 1.00 0.00 O ATOM 0 H GLU A 590 38.145 30.108 32.371 1.00 0.00 H new ATOM 0 HA GLU A 590 38.139 32.267 30.353 1.00 0.00 H new ATOM 0 HB2 GLU A 590 40.340 32.068 29.790 1.00 0.00 H new ATOM 0 HB3 GLU A 590 40.444 31.911 31.532 1.00 0.00 H new ATOM 0 HG2 GLU A 590 40.618 29.452 31.319 1.00 0.00 H new ATOM 0 HG3 GLU A 590 40.457 29.577 29.579 1.00 0.00 H new ATOM 1229 N ARG A 591 37.545 30.570 28.579 1.00 0.00 N ATOM 1230 CA ARG A 591 37.104 29.634 27.533 1.00 0.00 C ATOM 1231 C ARG A 591 38.157 28.544 27.298 1.00 0.00 C ATOM 1232 O ARG A 591 39.347 28.851 27.177 1.00 0.00 O ATOM 1233 CB ARG A 591 36.835 30.445 26.240 1.00 0.00 C ATOM 1234 CG ARG A 591 35.504 30.141 25.539 1.00 0.00 C ATOM 1235 CD ARG A 591 35.328 28.684 25.109 1.00 0.00 C ATOM 1236 NE ARG A 591 36.389 28.215 24.193 1.00 0.00 N ATOM 1237 CZ ARG A 591 36.286 27.315 23.234 1.00 0.00 C ATOM 1238 NH1 ARG A 591 35.162 26.784 22.856 1.00 0.00 N ATOM 1239 NH2 ARG A 591 37.351 26.910 22.618 1.00 0.00 N ATOM 0 H ARG A 591 37.500 31.544 28.278 1.00 0.00 H new ATOM 0 HA ARG A 591 36.190 29.129 27.844 1.00 0.00 H new ATOM 0 HB2 ARG A 591 36.863 31.507 26.484 1.00 0.00 H new ATOM 0 HB3 ARG A 591 37.647 30.258 25.538 1.00 0.00 H new ATOM 0 HG2 ARG A 591 34.687 30.410 26.208 1.00 0.00 H new ATOM 0 HG3 ARG A 591 35.418 30.778 24.659 1.00 0.00 H new ATOM 0 HD2 ARG A 591 35.315 28.049 25.995 1.00 0.00 H new ATOM 0 HD3 ARG A 591 34.360 28.570 24.622 1.00 0.00 H new ATOM 0 HE ARG A 591 37.309 28.637 24.317 1.00 0.00 H new ATOM 0 HH11 ARG A 591 34.290 27.059 23.309 1.00 0.00 H new ATOM 0 HH12 ARG A 591 35.151 26.092 22.107 1.00 0.00 H new ATOM 0 HH21 ARG A 591 38.263 27.287 22.875 1.00 0.00 H new ATOM 0 HH22 ARG A 591 37.277 26.214 21.876 1.00 0.00 H new ATOM 1253 N VAL A 592 37.712 27.293 27.185 1.00 0.00 N ATOM 1254 CA VAL A 592 38.537 26.115 26.856 1.00 0.00 C ATOM 1255 C VAL A 592 37.803 25.251 25.807 1.00 0.00 C ATOM 1256 O VAL A 592 36.566 25.270 25.743 1.00 0.00 O ATOM 1257 CB VAL A 592 38.803 25.245 28.103 1.00 0.00 C ATOM 1258 CG1 VAL A 592 39.960 25.811 28.934 1.00 0.00 C ATOM 1259 CG2 VAL A 592 37.581 25.086 29.007 1.00 0.00 C ATOM 0 H VAL A 592 36.730 27.056 27.324 1.00 0.00 H new ATOM 0 HA VAL A 592 39.490 26.474 26.467 1.00 0.00 H new ATOM 0 HB VAL A 592 39.061 24.259 27.716 1.00 0.00 H new ATOM 0 HG11 VAL A 592 40.125 25.178 29.806 1.00 0.00 H new ATOM 0 HG12 VAL A 592 40.865 25.836 28.327 1.00 0.00 H new ATOM 0 HG13 VAL A 592 39.713 26.821 29.260 1.00 0.00 H new ATOM 0 HG21 VAL A 592 37.840 24.463 29.863 1.00 0.00 H new ATOM 0 HG22 VAL A 592 37.257 26.066 29.356 1.00 0.00 H new ATOM 0 HG23 VAL A 592 36.773 24.615 28.447 1.00 0.00 H new ATOM 1328 N PRO B1731 40.223 39.388 39.777 1.00 0.00 N ATOM 1329 CA PRO B1731 38.917 39.730 39.211 1.00 0.00 C ATOM 1330 C PRO B1731 37.854 40.085 40.267 1.00 0.00 C ATOM 1331 O PRO B1731 37.962 39.734 41.450 1.00 0.00 O ATOM 1332 CB PRO B1731 38.506 38.518 38.365 1.00 0.00 C ATOM 1333 CG PRO B1731 39.192 37.358 39.075 1.00 0.00 C ATOM 1334 CD PRO B1731 40.513 37.981 39.522 1.00 0.00 C ATOM 0 HA PRO B1731 38.993 40.639 38.614 1.00 0.00 H new ATOM 0 HB2 PRO B1731 37.424 38.392 38.339 1.00 0.00 H new ATOM 0 HB3 PRO B1731 38.841 38.614 37.332 1.00 0.00 H new ATOM 0 HG2 PRO B1731 38.607 36.996 39.921 1.00 0.00 H new ATOM 0 HG3 PRO B1731 39.348 36.509 38.409 1.00 0.00 H new ATOM 0 HD2 PRO B1731 40.893 37.491 40.419 1.00 0.00 H new ATOM 0 HD3 PRO B1731 41.277 37.873 38.752 1.00 0.00 H new ATOM 1342 N VAL B1732 36.793 40.757 39.809 1.00 0.00 N ATOM 1343 CA VAL B1732 35.663 41.257 40.611 1.00 0.00 C ATOM 1344 C VAL B1732 34.334 40.943 39.915 1.00 0.00 C ATOM 1345 O VAL B1732 34.135 41.247 38.736 1.00 0.00 O ATOM 1346 CB VAL B1732 35.841 42.763 40.912 1.00 0.00 C ATOM 1347 CG1 VAL B1732 36.020 43.649 39.671 1.00 0.00 C ATOM 1348 CG2 VAL B1732 34.656 43.309 41.712 1.00 0.00 C ATOM 0 H VAL B1732 36.690 40.980 38.819 1.00 0.00 H new ATOM 0 HA VAL B1732 35.645 40.743 41.572 1.00 0.00 H new ATOM 0 HB VAL B1732 36.766 42.811 41.487 1.00 0.00 H new ATOM 0 HG11 VAL B1732 36.137 44.688 39.979 1.00 0.00 H new ATOM 0 HG12 VAL B1732 36.906 43.331 39.122 1.00 0.00 H new ATOM 0 HG13 VAL B1732 35.144 43.558 39.029 1.00 0.00 H new ATOM 0 HG21 VAL B1732 34.808 44.370 41.909 1.00 0.00 H new ATOM 0 HG22 VAL B1732 33.738 43.174 41.140 1.00 0.00 H new ATOM 0 HG23 VAL B1732 34.577 42.772 42.657 1.00 0.00 H new ATOM 1358 N ALA B1733 33.412 40.290 40.625 1.00 0.00 N ATOM 1359 CA ALA B1733 32.141 39.844 40.057 1.00 0.00 C ATOM 1360 C ALA B1733 31.249 41.036 39.641 1.00 0.00 C ATOM 1361 O ALA B1733 31.115 41.988 40.424 1.00 0.00 O ATOM 1362 CB ALA B1733 31.417 38.932 41.052 1.00 0.00 C ATOM 0 H ALA B1733 33.527 40.056 41.611 1.00 0.00 H new ATOM 0 HA ALA B1733 32.354 39.277 39.150 1.00 0.00 H new ATOM 0 HB1 ALA B1733 30.471 38.603 40.622 1.00 0.00 H new ATOM 0 HB2 ALA B1733 32.039 38.063 41.268 1.00 0.00 H new ATOM 0 HB3 ALA B1733 31.226 39.480 41.975 1.00 0.00 H new ATOM 1368 N PRO B1734 30.608 40.999 38.454 1.00 0.00 N ATOM 1369 CA PRO B1734 29.716 42.066 38.017 1.00 0.00 C ATOM 1370 C PRO B1734 28.423 42.120 38.850 1.00 0.00 C ATOM 1371 O PRO B1734 28.053 41.130 39.496 1.00 0.00 O ATOM 1372 CB PRO B1734 29.413 41.822 36.535 1.00 0.00 C ATOM 1373 CG PRO B1734 30.025 40.469 36.189 1.00 0.00 C ATOM 1374 CD PRO B1734 30.669 39.933 37.465 1.00 0.00 C ATOM 0 HA PRO B1734 30.197 43.033 38.160 1.00 0.00 H new ATOM 0 HB2 PRO B1734 28.338 41.820 36.353 1.00 0.00 H new ATOM 0 HB3 PRO B1734 29.840 42.611 35.916 1.00 0.00 H new ATOM 0 HG2 PRO B1734 29.261 39.782 35.824 1.00 0.00 H new ATOM 0 HG3 PRO B1734 30.766 40.572 35.396 1.00 0.00 H new ATOM 0 HD2 PRO B1734 30.142 39.047 37.820 1.00 0.00 H new ATOM 0 HD3 PRO B1734 31.702 39.637 37.281 1.00 0.00 H new ATOM 1382 N PRO B1735 27.683 43.239 38.803 1.00 0.00 N ATOM 1383 CA PRO B1735 26.329 43.309 39.347 1.00 0.00 C ATOM 1384 C PRO B1735 25.368 42.358 38.614 1.00 0.00 C ATOM 1385 O PRO B1735 25.579 42.014 37.447 1.00 0.00 O ATOM 1386 CB PRO B1735 25.922 44.773 39.185 1.00 0.00 C ATOM 1387 CG PRO B1735 26.708 45.234 37.961 1.00 0.00 C ATOM 1388 CD PRO B1735 28.019 44.471 38.099 1.00 0.00 C ATOM 0 HA PRO B1735 26.290 42.991 40.389 1.00 0.00 H new ATOM 0 HB2 PRO B1735 24.848 44.875 39.033 1.00 0.00 H new ATOM 0 HB3 PRO B1735 26.176 45.359 40.068 1.00 0.00 H new ATOM 0 HG2 PRO B1735 26.192 44.989 37.033 1.00 0.00 H new ATOM 0 HG3 PRO B1735 26.865 46.313 37.963 1.00 0.00 H new ATOM 0 HD2 PRO B1735 28.454 44.258 37.122 1.00 0.00 H new ATOM 0 HD3 PRO B1735 28.754 45.052 38.655 1.00 0.00 H new