USER MOD reduce.3.24.130724 H: found=0, std=0, add=586, rem=0, adj=12 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 Set 1.1: A 573 GLN : amide:sc= 1.05 K(o=2.3,f=-4.7) USER MOD Set 1.2: A 575 LYS NZ :NH3+ -166:sc= 1.21 (180deg=0) USER MOD Single : A 522 MET CE :methyl -179:sc= -0.224 (180deg=-0.225) USER MOD Single : A 524 LYS NZ :NH3+ -152:sc= 1.25 (180deg=1.14) USER MOD Single : A 526 GLN : amide:sc= 0.796 K(o=0.8,f=-0.43) USER MOD Single : A 528 GLN : amide:sc= 0.594 K(o=0.59,f=-0.069) USER MOD Single : A 529 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.47) USER MOD Single : A 531 TYR OH : rot 39:sc= 1.26 USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot -40:sc= 0.0313 USER MOD Single : A 536 THR OG1 : rot 180:sc= 0 USER MOD Single : A 540 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 558 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 564 MET CE :methyl 132:sc= -0.108 (180deg=-0.376) USER MOD Single : A 567 LYS NZ :NH3+ 180:sc= 0 (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=-0.54) USER MOD Single : A 574 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 579 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0727) USER MOD Single : A 580 CYS SG : rot -110:sc= -0.409 USER MOD Single : A 587 ASN : amide:sc= 0.887 K(o=0.89,f=-4.5!) USER MOD Single : A 589 THR OG1 : rot -19:sc= 0.911 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 517 27.598 15.379 27.343 1.00 0.00 N ATOM 66 CA LEU A 517 27.549 16.778 27.777 1.00 0.00 C ATOM 67 C LEU A 517 26.091 17.248 27.919 1.00 0.00 C ATOM 68 O LEU A 517 25.176 16.638 27.353 1.00 0.00 O ATOM 69 CB LEU A 517 28.353 17.645 26.790 1.00 0.00 C ATOM 70 CG LEU A 517 29.879 17.561 26.967 1.00 0.00 C ATOM 71 CD1 LEU A 517 30.512 18.681 26.156 1.00 0.00 C ATOM 72 CD2 LEU A 517 30.376 17.809 28.390 1.00 0.00 C ATOM 0 HA LEU A 517 28.006 16.878 28.761 1.00 0.00 H new ATOM 0 HB2 LEU A 517 28.100 17.345 25.773 1.00 0.00 H new ATOM 0 HB3 LEU A 517 28.043 18.684 26.902 1.00 0.00 H new ATOM 0 HG LEU A 517 30.145 16.548 26.666 1.00 0.00 H new ATOM 0 HD11 LEU A 517 31.596 18.642 26.266 1.00 0.00 H new ATOM 0 HD12 LEU A 517 30.249 18.562 25.105 1.00 0.00 H new ATOM 0 HD13 LEU A 517 30.145 19.643 26.515 1.00 0.00 H new ATOM 0 HD21 LEU A 517 31.463 17.729 28.415 1.00 0.00 H new ATOM 0 HD22 LEU A 517 30.078 18.807 28.711 1.00 0.00 H new ATOM 0 HD23 LEU A 517 29.942 17.068 29.061 1.00 0.00 H new ATOM 84 N PRO A 518 25.848 18.317 28.697 1.00 0.00 N ATOM 85 CA PRO A 518 24.500 18.768 29.023 1.00 0.00 C ATOM 86 C PRO A 518 23.708 19.265 27.802 1.00 0.00 C ATOM 87 O PRO A 518 24.297 19.600 26.764 1.00 0.00 O ATOM 88 CB PRO A 518 24.672 19.841 30.103 1.00 0.00 C ATOM 89 CG PRO A 518 26.106 20.331 29.924 1.00 0.00 C ATOM 90 CD PRO A 518 26.842 19.112 29.396 1.00 0.00 C ATOM 0 HA PRO A 518 23.894 17.938 29.386 1.00 0.00 H new ATOM 0 HB2 PRO A 518 23.956 20.652 29.975 1.00 0.00 H new ATOM 0 HB3 PRO A 518 24.514 19.430 31.100 1.00 0.00 H new ATOM 0 HG2 PRO A 518 26.159 21.165 29.224 1.00 0.00 H new ATOM 0 HG3 PRO A 518 26.531 20.678 30.866 1.00 0.00 H new ATOM 0 HD2 PRO A 518 27.650 19.404 28.725 1.00 0.00 H new ATOM 0 HD3 PRO A 518 27.293 18.545 30.211 1.00 0.00 H new ATOM 98 N PRO A 519 22.368 19.327 27.914 1.00 0.00 N ATOM 99 CA PRO A 519 21.507 19.842 26.854 1.00 0.00 C ATOM 100 C PRO A 519 21.889 21.282 26.504 1.00 0.00 C ATOM 101 O PRO A 519 22.154 22.106 27.383 1.00 0.00 O ATOM 102 CB PRO A 519 20.076 19.736 27.392 1.00 0.00 C ATOM 103 CG PRO A 519 20.247 19.752 28.909 1.00 0.00 C ATOM 104 CD PRO A 519 21.582 19.036 29.106 1.00 0.00 C ATOM 0 HA PRO A 519 21.610 19.276 25.928 1.00 0.00 H new ATOM 0 HB2 PRO A 519 19.459 20.568 27.051 1.00 0.00 H new ATOM 0 HB3 PRO A 519 19.590 18.820 27.055 1.00 0.00 H new ATOM 0 HG2 PRO A 519 20.271 20.768 29.303 1.00 0.00 H new ATOM 0 HG3 PRO A 519 19.432 19.234 29.414 1.00 0.00 H new ATOM 0 HD2 PRO A 519 22.087 19.391 30.004 1.00 0.00 H new ATOM 0 HD3 PRO A 519 21.436 17.962 29.226 1.00 0.00 H new ATOM 112 N GLY A 520 21.962 21.579 25.209 1.00 0.00 N ATOM 113 CA GLY A 520 22.338 22.891 24.691 1.00 0.00 C ATOM 114 C GLY A 520 23.807 23.292 24.884 1.00 0.00 C ATOM 115 O GLY A 520 24.155 24.388 24.450 1.00 0.00 O ATOM 0 H GLY A 520 21.757 20.900 24.476 1.00 0.00 H new ATOM 0 HA2 GLY A 520 22.111 22.918 23.625 1.00 0.00 H new ATOM 0 HA3 GLY A 520 21.710 23.643 25.170 1.00 0.00 H new ATOM 119 N PHE A 521 24.681 22.461 25.483 1.00 0.00 N ATOM 120 CA PHE A 521 26.091 22.782 25.732 1.00 0.00 C ATOM 121 C PHE A 521 26.815 23.616 24.656 1.00 0.00 C ATOM 122 O PHE A 521 26.833 23.218 23.485 1.00 0.00 O ATOM 123 CB PHE A 521 26.859 21.498 26.066 1.00 0.00 C ATOM 124 CG PHE A 521 28.357 21.680 26.112 1.00 0.00 C ATOM 125 CD1 PHE A 521 28.968 21.972 27.342 1.00 0.00 C ATOM 126 CD2 PHE A 521 29.126 21.622 24.931 1.00 0.00 C ATOM 127 CE1 PHE A 521 30.355 22.185 27.394 1.00 0.00 C ATOM 128 CE2 PHE A 521 30.507 21.860 24.984 1.00 0.00 C ATOM 129 CZ PHE A 521 31.122 22.098 26.220 1.00 0.00 C ATOM 0 H PHE A 521 24.418 21.532 25.812 1.00 0.00 H new ATOM 0 HA PHE A 521 26.078 23.459 26.586 1.00 0.00 H new ATOM 0 HB2 PHE A 521 26.518 21.122 27.031 1.00 0.00 H new ATOM 0 HB3 PHE A 521 26.617 20.737 25.324 1.00 0.00 H new ATOM 0 HD1 PHE A 521 28.375 22.032 28.243 1.00 0.00 H new ATOM 0 HD2 PHE A 521 28.652 21.395 23.988 1.00 0.00 H new ATOM 0 HE1 PHE A 521 30.832 22.415 28.335 1.00 0.00 H new ATOM 0 HE2 PHE A 521 31.093 21.860 24.077 1.00 0.00 H new ATOM 0 HZ PHE A 521 32.194 22.216 26.271 1.00 0.00 H new ATOM 139 N MET A 522 27.416 24.745 25.044 1.00 0.00 N ATOM 140 CA MET A 522 28.089 25.664 24.113 1.00 0.00 C ATOM 141 C MET A 522 29.609 25.460 24.089 1.00 0.00 C ATOM 142 O MET A 522 30.220 25.300 23.030 1.00 0.00 O ATOM 143 CB MET A 522 27.774 27.123 24.485 1.00 0.00 C ATOM 144 CG MET A 522 26.280 27.441 24.530 1.00 0.00 C ATOM 145 SD MET A 522 25.888 29.216 24.580 1.00 0.00 S ATOM 146 CE MET A 522 26.553 29.644 26.211 1.00 0.00 C ATOM 0 H MET A 522 27.451 25.051 26.016 1.00 0.00 H new ATOM 0 HA MET A 522 27.708 25.443 23.116 1.00 0.00 H new ATOM 0 HB2 MET A 522 28.212 27.342 25.459 1.00 0.00 H new ATOM 0 HB3 MET A 522 28.255 27.784 23.764 1.00 0.00 H new ATOM 0 HG2 MET A 522 25.801 27.001 23.655 1.00 0.00 H new ATOM 0 HG3 MET A 522 25.845 26.961 25.407 1.00 0.00 H new ATOM 0 HE1 MET A 522 26.378 30.701 26.409 1.00 0.00 H new ATOM 0 HE2 MET A 522 26.057 29.045 26.975 1.00 0.00 H new ATOM 0 HE3 MET A 522 27.624 29.443 26.231 1.00 0.00 H new ATOM 156 N PHE A 523 30.213 25.505 25.272 1.00 0.00 N ATOM 157 CA PHE A 523 31.657 25.462 25.511 1.00 0.00 C ATOM 158 C PHE A 523 32.007 25.154 26.960 1.00 0.00 C ATOM 159 O PHE A 523 31.143 25.184 27.825 1.00 0.00 O ATOM 160 CB PHE A 523 32.346 26.747 25.021 1.00 0.00 C ATOM 161 CG PHE A 523 31.739 28.068 25.467 1.00 0.00 C ATOM 162 CD1 PHE A 523 32.192 28.695 26.641 1.00 0.00 C ATOM 163 CD2 PHE A 523 30.757 28.697 24.683 1.00 0.00 C ATOM 164 CE1 PHE A 523 31.665 29.943 27.023 1.00 0.00 C ATOM 165 CE2 PHE A 523 30.230 29.945 25.061 1.00 0.00 C ATOM 166 CZ PHE A 523 30.690 30.571 26.231 1.00 0.00 C ATOM 0 H PHE A 523 29.681 25.576 26.140 1.00 0.00 H new ATOM 0 HA PHE A 523 32.044 24.631 24.921 1.00 0.00 H new ATOM 0 HB2 PHE A 523 33.384 26.722 25.352 1.00 0.00 H new ATOM 0 HB3 PHE A 523 32.358 26.730 23.931 1.00 0.00 H new ATOM 0 HD1 PHE A 523 32.945 28.218 27.251 1.00 0.00 H new ATOM 0 HD2 PHE A 523 30.404 28.218 23.782 1.00 0.00 H new ATOM 0 HE1 PHE A 523 32.012 30.419 27.928 1.00 0.00 H new ATOM 0 HE2 PHE A 523 29.474 30.420 24.454 1.00 0.00 H new ATOM 0 HZ PHE A 523 30.295 31.533 26.521 1.00 0.00 H new ATOM 176 N LYS A 524 33.269 24.873 27.254 1.00 0.00 N ATOM 177 CA LYS A 524 33.788 24.832 28.619 1.00 0.00 C ATOM 178 C LYS A 524 34.551 26.116 28.962 1.00 0.00 C ATOM 179 O LYS A 524 35.013 26.859 28.092 1.00 0.00 O ATOM 180 CB LYS A 524 34.676 23.601 28.794 1.00 0.00 C ATOM 181 CG LYS A 524 33.949 22.272 28.651 1.00 0.00 C ATOM 182 CD LYS A 524 34.870 21.129 29.066 1.00 0.00 C ATOM 183 CE LYS A 524 34.266 19.798 28.646 1.00 0.00 C ATOM 184 NZ LYS A 524 35.186 18.667 28.893 1.00 0.00 N ATOM 0 H LYS A 524 33.972 24.664 26.545 1.00 0.00 H new ATOM 0 HA LYS A 524 32.948 24.762 29.310 1.00 0.00 H new ATOM 0 HB2 LYS A 524 35.480 23.642 28.059 1.00 0.00 H new ATOM 0 HB3 LYS A 524 35.142 23.642 29.779 1.00 0.00 H new ATOM 0 HG2 LYS A 524 33.051 22.270 29.269 1.00 0.00 H new ATOM 0 HG3 LYS A 524 33.626 22.134 27.619 1.00 0.00 H new ATOM 0 HD2 LYS A 524 35.850 21.255 28.606 1.00 0.00 H new ATOM 0 HD3 LYS A 524 35.020 21.145 30.145 1.00 0.00 H new ATOM 0 HE2 LYS A 524 33.336 19.634 29.191 1.00 0.00 H new ATOM 0 HE3 LYS A 524 34.012 19.834 27.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 34.990 17.905 28.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 36.169 18.988 28.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 35.047 18.312 29.860 1.00 0.00 H new ATOM 198 N VAL A 525 34.753 26.326 30.252 1.00 0.00 N ATOM 199 CA VAL A 525 35.686 27.300 30.839 1.00 0.00 C ATOM 200 C VAL A 525 36.452 26.630 31.984 1.00 0.00 C ATOM 201 O VAL A 525 35.988 25.617 32.512 1.00 0.00 O ATOM 202 CB VAL A 525 34.964 28.579 31.310 1.00 0.00 C ATOM 203 CG1 VAL A 525 34.142 29.238 30.199 1.00 0.00 C ATOM 204 CG2 VAL A 525 34.028 28.244 32.472 1.00 0.00 C ATOM 0 H VAL A 525 34.248 25.798 30.964 1.00 0.00 H new ATOM 0 HA VAL A 525 36.393 27.617 30.072 1.00 0.00 H new ATOM 0 HB VAL A 525 35.738 29.282 31.618 1.00 0.00 H new ATOM 0 HG11 VAL A 525 33.656 30.133 30.588 1.00 0.00 H new ATOM 0 HG12 VAL A 525 34.799 29.511 29.373 1.00 0.00 H new ATOM 0 HG13 VAL A 525 33.384 28.539 29.844 1.00 0.00 H new ATOM 0 HG21 VAL A 525 33.520 29.150 32.802 1.00 0.00 H new ATOM 0 HG22 VAL A 525 33.290 27.512 32.145 1.00 0.00 H new ATOM 0 HG23 VAL A 525 34.607 27.831 33.298 1.00 0.00 H new ATOM 214 N GLN A 526 37.587 27.193 32.403 1.00 0.00 N ATOM 215 CA GLN A 526 38.281 26.763 33.624 1.00 0.00 C ATOM 216 C GLN A 526 38.506 27.931 34.596 1.00 0.00 C ATOM 217 O GLN A 526 39.035 28.971 34.196 1.00 0.00 O ATOM 218 CB GLN A 526 39.598 26.054 33.280 1.00 0.00 C ATOM 219 CG GLN A 526 40.152 25.335 34.522 1.00 0.00 C ATOM 220 CD GLN A 526 41.461 24.602 34.274 1.00 0.00 C ATOM 221 OE1 GLN A 526 42.188 24.857 33.320 1.00 0.00 O ATOM 222 NE2 GLN A 526 41.817 23.687 35.142 1.00 0.00 N ATOM 0 H GLN A 526 38.051 27.956 31.910 1.00 0.00 H new ATOM 0 HA GLN A 526 37.637 26.048 34.136 1.00 0.00 H new ATOM 0 HB2 GLN A 526 39.434 25.335 32.477 1.00 0.00 H new ATOM 0 HB3 GLN A 526 40.326 26.779 32.915 1.00 0.00 H new ATOM 0 HG2 GLN A 526 40.301 26.066 35.317 1.00 0.00 H new ATOM 0 HG3 GLN A 526 39.409 24.622 34.879 1.00 0.00 H new ATOM 0 HE21 GLN A 526 41.213 23.474 35.936 1.00 0.00 H new ATOM 0 HE22 GLN A 526 42.698 23.187 35.024 1.00 0.00 H new ATOM 231 N ALA A 527 38.146 27.771 35.873 1.00 0.00 N ATOM 232 CA ALA A 527 38.355 28.781 36.917 1.00 0.00 C ATOM 233 C ALA A 527 39.844 29.130 37.090 1.00 0.00 C ATOM 234 O ALA A 527 40.677 28.259 37.332 1.00 0.00 O ATOM 235 CB ALA A 527 37.699 28.293 38.217 1.00 0.00 C ATOM 0 H ALA A 527 37.694 26.923 36.217 1.00 0.00 H new ATOM 0 HA ALA A 527 37.878 29.715 36.620 1.00 0.00 H new ATOM 0 HB1 ALA A 527 37.848 29.036 39.001 1.00 0.00 H new ATOM 0 HB2 ALA A 527 36.631 28.147 38.053 1.00 0.00 H new ATOM 0 HB3 ALA A 527 38.152 27.349 38.521 1.00 0.00 H new ATOM 241 N GLN A 528 40.175 30.415 36.966 1.00 0.00 N ATOM 242 CA GLN A 528 41.509 30.972 37.221 1.00 0.00 C ATOM 243 C GLN A 528 41.704 31.369 38.695 1.00 0.00 C ATOM 244 O GLN A 528 42.830 31.376 39.200 1.00 0.00 O ATOM 245 CB GLN A 528 41.718 32.202 36.322 1.00 0.00 C ATOM 246 CG GLN A 528 41.611 31.949 34.813 1.00 0.00 C ATOM 247 CD GLN A 528 42.496 30.797 34.354 1.00 0.00 C ATOM 248 OE1 GLN A 528 43.720 30.870 34.314 1.00 0.00 O ATOM 249 NE2 GLN A 528 41.902 29.660 34.101 1.00 0.00 N ATOM 0 H GLN A 528 39.501 31.123 36.676 1.00 0.00 H new ATOM 0 HA GLN A 528 42.244 30.200 36.994 1.00 0.00 H new ATOM 0 HB2 GLN A 528 40.984 32.959 36.598 1.00 0.00 H new ATOM 0 HB3 GLN A 528 42.702 32.620 36.533 1.00 0.00 H new ATOM 0 HG2 GLN A 528 40.574 31.732 34.556 1.00 0.00 H new ATOM 0 HG3 GLN A 528 41.890 32.855 34.275 1.00 0.00 H new ATOM 0 HE21 GLN A 528 40.884 29.598 34.134 1.00 0.00 H new ATOM 0 HE22 GLN A 528 42.456 28.835 33.871 1.00 0.00 H new ATOM 258 N HIS A 529 40.598 31.670 39.378 1.00 0.00 N ATOM 259 CA HIS A 529 40.505 32.046 40.789 1.00 0.00 C ATOM 260 C HIS A 529 39.280 31.360 41.416 1.00 0.00 C ATOM 261 O HIS A 529 38.432 30.816 40.709 1.00 0.00 O ATOM 262 CB HIS A 529 40.390 33.579 40.914 1.00 0.00 C ATOM 263 CG HIS A 529 41.450 34.382 40.199 1.00 0.00 C ATOM 264 ND1 HIS A 529 42.623 34.860 40.738 1.00 0.00 N ATOM 265 CD2 HIS A 529 41.388 34.840 38.910 1.00 0.00 C ATOM 266 CE1 HIS A 529 43.244 35.594 39.798 1.00 0.00 C ATOM 267 NE2 HIS A 529 42.532 35.606 38.656 1.00 0.00 N ATOM 0 H HIS A 529 39.682 31.656 38.929 1.00 0.00 H new ATOM 0 HA HIS A 529 41.402 31.723 41.317 1.00 0.00 H new ATOM 0 HB2 HIS A 529 39.414 33.883 40.534 1.00 0.00 H new ATOM 0 HB3 HIS A 529 40.416 33.841 41.972 1.00 0.00 H new ATOM 0 HD2 HIS A 529 40.591 34.644 38.208 1.00 0.00 H new ATOM 0 HE1 HIS A 529 44.185 36.104 39.940 1.00 0.00 H new ATOM 0 HE2 HIS A 529 42.776 36.077 37.784 1.00 0.00 H new ATOM 275 N ASP A 530 39.176 31.384 42.740 1.00 0.00 N ATOM 276 CA ASP A 530 38.035 30.887 43.500 1.00 0.00 C ATOM 277 C ASP A 530 36.893 31.894 43.663 1.00 0.00 C ATOM 278 O ASP A 530 37.119 33.070 43.948 1.00 0.00 O ATOM 279 CB ASP A 530 38.442 30.258 44.842 1.00 0.00 C ATOM 280 CG ASP A 530 39.443 31.036 45.715 1.00 0.00 C ATOM 281 OD1 ASP A 530 39.583 30.623 46.892 1.00 0.00 O ATOM 282 OD2 ASP A 530 40.103 32.003 45.271 1.00 0.00 O ATOM 0 H ASP A 530 39.911 31.764 43.336 1.00 0.00 H new ATOM 0 HA ASP A 530 37.627 30.089 42.879 1.00 0.00 H new ATOM 0 HB2 ASP A 530 37.537 30.099 45.428 1.00 0.00 H new ATOM 0 HB3 ASP A 530 38.866 29.275 44.638 1.00 0.00 H new ATOM 287 N TYR A 531 35.656 31.415 43.533 1.00 0.00 N ATOM 288 CA TYR A 531 34.438 32.198 43.667 1.00 0.00 C ATOM 289 C TYR A 531 33.407 31.498 44.556 1.00 0.00 C ATOM 290 O TYR A 531 32.781 30.511 44.158 1.00 0.00 O ATOM 291 CB TYR A 531 33.866 32.527 42.284 1.00 0.00 C ATOM 292 CG TYR A 531 32.579 33.331 42.382 1.00 0.00 C ATOM 293 CD1 TYR A 531 31.321 32.707 42.241 1.00 0.00 C ATOM 294 CD2 TYR A 531 32.646 34.686 42.756 1.00 0.00 C ATOM 295 CE1 TYR A 531 30.135 33.425 42.505 1.00 0.00 C ATOM 296 CE2 TYR A 531 31.466 35.401 43.034 1.00 0.00 C ATOM 297 CZ TYR A 531 30.208 34.771 42.925 1.00 0.00 C ATOM 298 OH TYR A 531 29.085 35.468 43.247 1.00 0.00 O ATOM 0 H TYR A 531 35.473 30.434 43.324 1.00 0.00 H new ATOM 0 HA TYR A 531 34.689 33.135 44.164 1.00 0.00 H new ATOM 0 HB2 TYR A 531 34.603 33.089 41.710 1.00 0.00 H new ATOM 0 HB3 TYR A 531 33.676 31.602 41.740 1.00 0.00 H new ATOM 0 HD1 TYR A 531 31.266 31.674 41.929 1.00 0.00 H new ATOM 0 HD2 TYR A 531 33.605 35.178 42.830 1.00 0.00 H new ATOM 0 HE1 TYR A 531 29.174 32.946 42.386 1.00 0.00 H new ATOM 0 HE2 TYR A 531 31.524 36.437 43.332 1.00 0.00 H new ATOM 0 HH TYR A 531 28.467 34.885 43.735 1.00 0.00 H new ATOM 308 N THR A 532 33.221 32.028 45.765 1.00 0.00 N ATOM 309 CA THR A 532 32.138 31.600 46.659 1.00 0.00 C ATOM 310 C THR A 532 30.795 32.244 46.345 1.00 0.00 C ATOM 311 O THR A 532 30.573 33.416 46.658 1.00 0.00 O ATOM 312 CB THR A 532 32.459 31.653 48.159 1.00 0.00 C ATOM 313 OG1 THR A 532 33.823 31.428 48.433 1.00 0.00 O ATOM 314 CG2 THR A 532 31.670 30.603 48.931 1.00 0.00 C ATOM 0 H THR A 532 33.812 32.763 46.153 1.00 0.00 H new ATOM 0 HA THR A 532 32.047 30.538 46.429 1.00 0.00 H new ATOM 0 HB THR A 532 32.185 32.660 48.474 1.00 0.00 H new ATOM 0 HG1 THR A 532 33.974 31.474 49.400 1.00 0.00 H new ATOM 0 HG21 THR A 532 31.920 30.666 49.990 1.00 0.00 H new ATOM 0 HG22 THR A 532 30.603 30.780 48.799 1.00 0.00 H new ATOM 0 HG23 THR A 532 31.923 29.611 48.557 1.00 0.00 H new ATOM 322 N ALA A 533 29.905 31.471 45.733 1.00 0.00 N ATOM 323 CA ALA A 533 28.544 31.859 45.396 1.00 0.00 C ATOM 324 C ALA A 533 27.758 32.238 46.652 1.00 0.00 C ATOM 325 O ALA A 533 27.802 31.535 47.663 1.00 0.00 O ATOM 326 CB ALA A 533 27.900 30.696 44.639 1.00 0.00 C ATOM 0 H ALA A 533 30.123 30.517 45.447 1.00 0.00 H new ATOM 0 HA ALA A 533 28.543 32.745 44.761 1.00 0.00 H new ATOM 0 HB1 ALA A 533 26.876 30.958 44.372 1.00 0.00 H new ATOM 0 HB2 ALA A 533 28.470 30.492 43.733 1.00 0.00 H new ATOM 0 HB3 ALA A 533 27.894 29.809 45.272 1.00 0.00 H new ATOM 332 N THR A 534 27.066 33.369 46.568 1.00 0.00 N ATOM 333 CA THR A 534 26.369 34.034 47.684 1.00 0.00 C ATOM 334 C THR A 534 24.838 33.971 47.623 1.00 0.00 C ATOM 335 O THR A 534 24.150 34.288 48.592 1.00 0.00 O ATOM 336 CB THR A 534 26.925 35.456 47.852 1.00 0.00 C ATOM 337 OG1 THR A 534 26.629 35.986 49.122 1.00 0.00 O ATOM 338 CG2 THR A 534 26.375 36.415 46.802 1.00 0.00 C ATOM 0 H THR A 534 26.966 33.875 45.688 1.00 0.00 H new ATOM 0 HA THR A 534 26.584 33.464 48.588 1.00 0.00 H new ATOM 0 HB THR A 534 28.004 35.364 47.731 1.00 0.00 H new ATOM 0 HG1 THR A 534 25.717 35.734 49.377 1.00 0.00 H new ATOM 0 HG21 THR A 534 26.796 37.408 46.960 1.00 0.00 H new ATOM 0 HG22 THR A 534 26.646 36.060 45.808 1.00 0.00 H new ATOM 0 HG23 THR A 534 25.289 36.463 46.886 1.00 0.00 H new ATOM 346 N ASP A 535 24.298 33.526 46.487 1.00 0.00 N ATOM 347 CA ASP A 535 22.873 33.322 46.225 1.00 0.00 C ATOM 348 C ASP A 535 22.503 31.995 45.563 1.00 0.00 C ATOM 349 O ASP A 535 23.317 31.413 44.849 1.00 0.00 O ATOM 350 CB ASP A 535 22.264 34.540 45.518 1.00 0.00 C ATOM 351 CG ASP A 535 21.865 35.663 46.481 1.00 0.00 C ATOM 352 OD1 ASP A 535 21.147 35.385 47.472 1.00 0.00 O ATOM 353 OD2 ASP A 535 22.146 36.849 46.189 1.00 0.00 O ATOM 0 H ASP A 535 24.875 33.285 45.681 1.00 0.00 H new ATOM 0 HA ASP A 535 22.412 33.233 47.209 1.00 0.00 H new ATOM 0 HB2 ASP A 535 22.982 34.928 44.795 1.00 0.00 H new ATOM 0 HB3 ASP A 535 21.385 34.223 44.956 1.00 0.00 H new ATOM 358 N THR A 536 21.282 31.495 45.770 1.00 0.00 N ATOM 359 CA THR A 536 20.927 30.138 45.321 1.00 0.00 C ATOM 360 C THR A 536 20.982 29.879 43.813 1.00 0.00 C ATOM 361 O THR A 536 21.258 28.760 43.375 1.00 0.00 O ATOM 362 CB THR A 536 19.633 29.633 45.972 1.00 0.00 C ATOM 363 OG1 THR A 536 19.678 28.223 46.003 1.00 0.00 O ATOM 364 CG2 THR A 536 18.377 30.064 45.215 1.00 0.00 C ATOM 0 H THR A 536 20.529 31.998 46.239 1.00 0.00 H new ATOM 0 HA THR A 536 21.748 29.525 45.692 1.00 0.00 H new ATOM 0 HB THR A 536 19.573 30.065 46.971 1.00 0.00 H new ATOM 0 HG1 THR A 536 18.859 27.879 46.417 1.00 0.00 H new ATOM 0 HG21 THR A 536 17.494 29.676 45.724 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.328 31.152 45.181 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.412 29.671 44.199 1.00 0.00 H new ATOM 372 N ASP A 537 20.783 30.927 43.009 1.00 0.00 N ATOM 373 CA ASP A 537 20.985 30.895 41.558 1.00 0.00 C ATOM 374 C ASP A 537 22.447 30.848 41.070 1.00 0.00 C ATOM 375 O ASP A 537 22.702 30.480 39.921 1.00 0.00 O ATOM 376 CB ASP A 537 20.145 31.992 40.865 1.00 0.00 C ATOM 377 CG ASP A 537 18.648 31.670 40.742 1.00 0.00 C ATOM 378 OD1 ASP A 537 18.212 30.530 41.028 1.00 0.00 O ATOM 379 OD2 ASP A 537 17.854 32.536 40.299 1.00 0.00 O ATOM 0 H ASP A 537 20.472 31.835 43.353 1.00 0.00 H new ATOM 0 HA ASP A 537 20.614 29.919 41.244 1.00 0.00 H new ATOM 0 HB2 ASP A 537 20.258 32.923 41.420 1.00 0.00 H new ATOM 0 HB3 ASP A 537 20.549 32.165 39.868 1.00 0.00 H new ATOM 384 N GLU A 538 23.415 31.192 41.925 1.00 0.00 N ATOM 385 CA GLU A 538 24.839 31.255 41.609 1.00 0.00 C ATOM 386 C GLU A 538 25.560 29.898 41.670 1.00 0.00 C ATOM 387 O GLU A 538 25.197 29.014 42.452 1.00 0.00 O ATOM 388 CB GLU A 538 25.512 32.277 42.535 1.00 0.00 C ATOM 389 CG GLU A 538 25.142 33.716 42.174 1.00 0.00 C ATOM 390 CD GLU A 538 25.785 34.747 43.105 1.00 0.00 C ATOM 391 OE1 GLU A 538 26.753 34.415 43.834 1.00 0.00 O ATOM 392 OE2 GLU A 538 25.325 35.916 43.081 1.00 0.00 O ATOM 0 H GLU A 538 23.217 31.443 42.893 1.00 0.00 H new ATOM 0 HA GLU A 538 24.921 31.569 40.569 1.00 0.00 H new ATOM 0 HB2 GLU A 538 25.221 32.077 43.566 1.00 0.00 H new ATOM 0 HB3 GLU A 538 26.594 32.157 42.480 1.00 0.00 H new ATOM 0 HG2 GLU A 538 25.449 33.919 41.148 1.00 0.00 H new ATOM 0 HG3 GLU A 538 24.058 33.827 42.210 1.00 0.00 H new ATOM 399 N LEU A 539 26.600 29.747 40.846 1.00 0.00 N ATOM 400 CA LEU A 539 27.475 28.576 40.748 1.00 0.00 C ATOM 401 C LEU A 539 28.765 28.800 41.558 1.00 0.00 C ATOM 402 O LEU A 539 29.449 29.808 41.370 1.00 0.00 O ATOM 403 CB LEU A 539 27.821 28.341 39.261 1.00 0.00 C ATOM 404 CG LEU A 539 27.823 26.880 38.776 1.00 0.00 C ATOM 405 CD1 LEU A 539 28.589 26.779 37.470 1.00 0.00 C ATOM 406 CD2 LEU A 539 28.474 25.889 39.734 1.00 0.00 C ATOM 0 H LEU A 539 26.869 30.481 40.191 1.00 0.00 H new ATOM 0 HA LEU A 539 26.964 27.704 41.155 1.00 0.00 H new ATOM 0 HB2 LEU A 539 27.110 28.901 38.653 1.00 0.00 H new ATOM 0 HB3 LEU A 539 28.807 28.765 39.070 1.00 0.00 H new ATOM 0 HG LEU A 539 26.769 26.617 38.682 1.00 0.00 H new ATOM 0 HD11 LEU A 539 28.590 25.744 37.128 1.00 0.00 H new ATOM 0 HD12 LEU A 539 28.113 27.409 36.719 1.00 0.00 H new ATOM 0 HD13 LEU A 539 29.616 27.111 37.624 1.00 0.00 H new ATOM 0 HD21 LEU A 539 28.428 24.887 39.308 1.00 0.00 H new ATOM 0 HD22 LEU A 539 29.516 26.168 39.894 1.00 0.00 H new ATOM 0 HD23 LEU A 539 27.945 25.903 40.687 1.00 0.00 H new ATOM 418 N GLN A 540 29.126 27.862 42.431 1.00 0.00 N ATOM 419 CA GLN A 540 30.344 27.934 43.241 1.00 0.00 C ATOM 420 C GLN A 540 31.562 27.367 42.484 1.00 0.00 C ATOM 421 O GLN A 540 31.520 26.226 42.021 1.00 0.00 O ATOM 422 CB GLN A 540 30.079 27.159 44.536 1.00 0.00 C ATOM 423 CG GLN A 540 31.119 27.468 45.621 1.00 0.00 C ATOM 424 CD GLN A 540 31.016 26.518 46.809 1.00 0.00 C ATOM 425 OE1 GLN A 540 31.873 25.666 47.027 1.00 0.00 O ATOM 426 NE2 GLN A 540 29.915 26.523 47.518 1.00 0.00 N ATOM 0 H GLN A 540 28.576 27.020 42.599 1.00 0.00 H new ATOM 0 HA GLN A 540 30.586 28.973 43.465 1.00 0.00 H new ATOM 0 HB2 GLN A 540 29.085 27.406 44.908 1.00 0.00 H new ATOM 0 HB3 GLN A 540 30.084 26.090 44.325 1.00 0.00 H new ATOM 0 HG2 GLN A 540 32.119 27.402 45.192 1.00 0.00 H new ATOM 0 HG3 GLN A 540 30.987 28.493 45.966 1.00 0.00 H new ATOM 0 HE21 GLN A 540 29.199 27.228 47.343 1.00 0.00 H new ATOM 0 HE22 GLN A 540 29.774 25.822 48.246 1.00 0.00 H new ATOM 435 N LEU A 541 32.660 28.130 42.402 1.00 0.00 N ATOM 436 CA LEU A 541 33.897 27.747 41.699 1.00 0.00 C ATOM 437 C LEU A 541 35.118 27.765 42.621 1.00 0.00 C ATOM 438 O LEU A 541 35.265 28.653 43.460 1.00 0.00 O ATOM 439 CB LEU A 541 34.155 28.670 40.486 1.00 0.00 C ATOM 440 CG LEU A 541 33.019 28.716 39.443 1.00 0.00 C ATOM 441 CD1 LEU A 541 33.428 29.625 38.285 1.00 0.00 C ATOM 442 CD2 LEU A 541 32.707 27.334 38.876 1.00 0.00 C ATOM 0 H LEU A 541 32.717 29.053 42.832 1.00 0.00 H new ATOM 0 HA LEU A 541 33.749 26.724 41.352 1.00 0.00 H new ATOM 0 HB2 LEU A 541 34.333 29.682 40.851 1.00 0.00 H new ATOM 0 HB3 LEU A 541 35.069 28.344 39.990 1.00 0.00 H new ATOM 0 HG LEU A 541 32.130 29.095 39.947 1.00 0.00 H new ATOM 0 HD11 LEU A 541 32.626 29.658 37.548 1.00 0.00 H new ATOM 0 HD12 LEU A 541 33.617 30.631 38.661 1.00 0.00 H new ATOM 0 HD13 LEU A 541 34.333 29.236 37.819 1.00 0.00 H new ATOM 0 HD21 LEU A 541 31.902 27.414 38.146 1.00 0.00 H new ATOM 0 HD22 LEU A 541 33.596 26.930 38.392 1.00 0.00 H new ATOM 0 HD23 LEU A 541 32.400 26.670 39.684 1.00 0.00 H new ATOM 454 N LYS A 542 36.039 26.829 42.414 1.00 0.00 N ATOM 455 CA LYS A 542 37.374 26.776 43.022 1.00 0.00 C ATOM 456 C LYS A 542 38.428 26.916 41.935 1.00 0.00 C ATOM 457 O LYS A 542 38.198 26.462 40.815 1.00 0.00 O ATOM 458 CB LYS A 542 37.479 25.441 43.782 1.00 0.00 C ATOM 459 CG LYS A 542 38.527 25.405 44.907 1.00 0.00 C ATOM 460 CD LYS A 542 39.880 24.793 44.514 1.00 0.00 C ATOM 461 CE LYS A 542 40.703 24.451 45.766 1.00 0.00 C ATOM 462 NZ LYS A 542 41.118 25.657 46.521 1.00 0.00 N ATOM 0 H LYS A 542 35.870 26.044 41.785 1.00 0.00 H new ATOM 0 HA LYS A 542 37.538 27.593 43.725 1.00 0.00 H new ATOM 0 HB2 LYS A 542 36.504 25.207 44.209 1.00 0.00 H new ATOM 0 HB3 LYS A 542 37.711 24.652 43.067 1.00 0.00 H new ATOM 0 HG2 LYS A 542 38.694 26.423 45.260 1.00 0.00 H new ATOM 0 HG3 LYS A 542 38.119 24.840 45.745 1.00 0.00 H new ATOM 0 HD2 LYS A 542 39.719 23.893 43.921 1.00 0.00 H new ATOM 0 HD3 LYS A 542 40.434 25.493 43.888 1.00 0.00 H new ATOM 0 HE2 LYS A 542 40.116 23.803 46.417 1.00 0.00 H new ATOM 0 HE3 LYS A 542 41.589 23.888 45.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 542 41.670 25.372 47.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 542 41.702 26.265 45.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 542 40.274 26.182 46.827 1.00 0.00 H new ATOM 476 N ALA A 543 39.575 27.531 42.228 1.00 0.00 N ATOM 477 CA ALA A 543 40.622 27.705 41.229 1.00 0.00 C ATOM 478 C ALA A 543 41.005 26.355 40.594 1.00 0.00 C ATOM 479 O ALA A 543 41.376 25.393 41.275 1.00 0.00 O ATOM 480 CB ALA A 543 41.817 28.416 41.860 1.00 0.00 C ATOM 0 H ALA A 543 39.799 27.914 43.146 1.00 0.00 H new ATOM 0 HA ALA A 543 40.252 28.332 40.418 1.00 0.00 H new ATOM 0 HB1 ALA A 543 42.600 28.546 41.112 1.00 0.00 H new ATOM 0 HB2 ALA A 543 41.505 29.392 42.232 1.00 0.00 H new ATOM 0 HB3 ALA A 543 42.201 27.819 42.687 1.00 0.00 H new ATOM 486 N GLY A 544 40.834 26.285 39.275 1.00 0.00 N ATOM 487 CA GLY A 544 41.094 25.107 38.449 1.00 0.00 C ATOM 488 C GLY A 544 39.850 24.303 38.071 1.00 0.00 C ATOM 489 O GLY A 544 39.983 23.291 37.380 1.00 0.00 O ATOM 0 H GLY A 544 40.497 27.079 38.731 1.00 0.00 H new ATOM 0 HA2 GLY A 544 41.596 25.425 37.535 1.00 0.00 H new ATOM 0 HA3 GLY A 544 41.785 24.453 38.981 1.00 0.00 H new ATOM 493 N ASP A 545 38.651 24.719 38.488 1.00 0.00 N ATOM 494 CA ASP A 545 37.407 24.015 38.188 1.00 0.00 C ATOM 495 C ASP A 545 36.980 24.114 36.720 1.00 0.00 C ATOM 496 O ASP A 545 36.786 25.224 36.220 1.00 0.00 O ATOM 497 CB ASP A 545 36.279 24.460 39.140 1.00 0.00 C ATOM 498 CG ASP A 545 36.327 23.883 40.556 1.00 0.00 C ATOM 499 OD1 ASP A 545 35.472 24.295 41.367 1.00 0.00 O ATOM 500 OD2 ASP A 545 37.140 22.973 40.854 1.00 0.00 O ATOM 0 H ASP A 545 38.518 25.561 39.048 1.00 0.00 H new ATOM 0 HA ASP A 545 37.608 22.957 38.359 1.00 0.00 H new ATOM 0 HB2 ASP A 545 36.300 25.547 39.212 1.00 0.00 H new ATOM 0 HB3 ASP A 545 35.324 24.188 38.691 1.00 0.00 H new ATOM 505 N VAL A 546 36.806 22.980 36.033 1.00 0.00 N ATOM 506 CA VAL A 546 36.135 22.949 34.724 1.00 0.00 C ATOM 507 C VAL A 546 34.648 23.239 34.915 1.00 0.00 C ATOM 508 O VAL A 546 34.003 22.620 35.766 1.00 0.00 O ATOM 509 CB VAL A 546 36.302 21.594 34.007 1.00 0.00 C ATOM 510 CG1 VAL A 546 35.616 21.585 32.641 1.00 0.00 C ATOM 511 CG2 VAL A 546 37.766 21.210 33.779 1.00 0.00 C ATOM 0 H VAL A 546 37.121 22.067 36.361 1.00 0.00 H new ATOM 0 HA VAL A 546 36.601 23.710 34.098 1.00 0.00 H new ATOM 0 HB VAL A 546 35.838 20.871 34.678 1.00 0.00 H new ATOM 0 HG11 VAL A 546 35.757 20.613 32.169 1.00 0.00 H new ATOM 0 HG12 VAL A 546 34.550 21.775 32.768 1.00 0.00 H new ATOM 0 HG13 VAL A 546 36.050 22.361 32.011 1.00 0.00 H new ATOM 0 HG21 VAL A 546 37.815 20.247 33.271 1.00 0.00 H new ATOM 0 HG22 VAL A 546 38.250 21.969 33.165 1.00 0.00 H new ATOM 0 HG23 VAL A 546 38.277 21.140 34.739 1.00 0.00 H new ATOM 521 N VAL A 547 34.086 24.116 34.083 1.00 0.00 N ATOM 522 CA VAL A 547 32.645 24.390 34.002 1.00 0.00 C ATOM 523 C VAL A 547 32.134 24.248 32.583 1.00 0.00 C ATOM 524 O VAL A 547 32.648 24.878 31.662 1.00 0.00 O ATOM 525 CB VAL A 547 32.213 25.744 34.624 1.00 0.00 C ATOM 526 CG1 VAL A 547 30.800 25.670 35.190 1.00 0.00 C ATOM 527 CG2 VAL A 547 33.162 26.269 35.704 1.00 0.00 C ATOM 0 H VAL A 547 34.633 24.673 33.427 1.00 0.00 H new ATOM 0 HA VAL A 547 32.174 23.626 34.621 1.00 0.00 H new ATOM 0 HB VAL A 547 32.248 26.452 33.796 1.00 0.00 H new ATOM 0 HG11 VAL A 547 30.529 26.635 35.618 1.00 0.00 H new ATOM 0 HG12 VAL A 547 30.101 25.417 34.392 1.00 0.00 H new ATOM 0 HG13 VAL A 547 30.758 24.905 35.965 1.00 0.00 H new ATOM 0 HG21 VAL A 547 32.788 27.219 36.087 1.00 0.00 H new ATOM 0 HG22 VAL A 547 33.221 25.547 36.519 1.00 0.00 H new ATOM 0 HG23 VAL A 547 34.154 26.416 35.277 1.00 0.00 H new ATOM 537 N LEU A 548 31.131 23.399 32.408 1.00 0.00 N ATOM 538 CA LEU A 548 30.442 23.188 31.149 1.00 0.00 C ATOM 539 C LEU A 548 29.420 24.325 30.955 1.00 0.00 C ATOM 540 O LEU A 548 28.353 24.304 31.572 1.00 0.00 O ATOM 541 CB LEU A 548 29.761 21.803 31.180 1.00 0.00 C ATOM 542 CG LEU A 548 30.565 20.575 31.647 1.00 0.00 C ATOM 543 CD1 LEU A 548 29.660 19.364 31.848 1.00 0.00 C ATOM 544 CD2 LEU A 548 31.632 20.169 30.649 1.00 0.00 C ATOM 0 H LEU A 548 30.765 22.821 33.165 1.00 0.00 H new ATOM 0 HA LEU A 548 31.136 23.203 30.309 1.00 0.00 H new ATOM 0 HB2 LEU A 548 28.885 21.884 31.823 1.00 0.00 H new ATOM 0 HB3 LEU A 548 29.400 21.594 30.173 1.00 0.00 H new ATOM 0 HG LEU A 548 31.031 20.874 32.586 1.00 0.00 H new ATOM 0 HD11 LEU A 548 30.257 18.514 32.177 1.00 0.00 H new ATOM 0 HD12 LEU A 548 28.908 19.593 32.603 1.00 0.00 H new ATOM 0 HD13 LEU A 548 29.167 19.118 30.907 1.00 0.00 H new ATOM 0 HD21 LEU A 548 32.170 19.299 31.025 1.00 0.00 H new ATOM 0 HD22 LEU A 548 31.164 19.922 29.696 1.00 0.00 H new ATOM 0 HD23 LEU A 548 32.330 20.994 30.507 1.00 0.00 H new ATOM 556 N VAL A 549 29.747 25.338 30.151 1.00 0.00 N ATOM 557 CA VAL A 549 28.807 26.423 29.777 1.00 0.00 C ATOM 558 C VAL A 549 27.580 25.961 28.970 1.00 0.00 C ATOM 559 O VAL A 549 27.699 25.262 27.958 1.00 0.00 O ATOM 560 CB VAL A 549 29.528 27.579 29.056 1.00 0.00 C ATOM 561 CG1 VAL A 549 28.694 28.858 28.996 1.00 0.00 C ATOM 562 CG2 VAL A 549 30.849 27.912 29.757 1.00 0.00 C ATOM 0 H VAL A 549 30.672 25.439 29.734 1.00 0.00 H new ATOM 0 HA VAL A 549 28.416 26.785 30.728 1.00 0.00 H new ATOM 0 HB VAL A 549 29.702 27.229 28.038 1.00 0.00 H new ATOM 0 HG11 VAL A 549 29.256 29.635 28.477 1.00 0.00 H new ATOM 0 HG12 VAL A 549 27.765 28.662 28.460 1.00 0.00 H new ATOM 0 HG13 VAL A 549 28.465 29.191 30.008 1.00 0.00 H new ATOM 0 HG21 VAL A 549 31.343 28.730 29.233 1.00 0.00 H new ATOM 0 HG22 VAL A 549 30.650 28.208 30.787 1.00 0.00 H new ATOM 0 HG23 VAL A 549 31.496 27.035 29.751 1.00 0.00 H new ATOM 572 N ILE A 550 26.392 26.410 29.387 1.00 0.00 N ATOM 573 CA ILE A 550 25.084 26.125 28.776 1.00 0.00 C ATOM 574 C ILE A 550 24.317 27.438 28.507 1.00 0.00 C ATOM 575 O ILE A 550 24.567 28.445 29.175 1.00 0.00 O ATOM 576 CB ILE A 550 24.255 25.163 29.668 1.00 0.00 C ATOM 577 CG1 ILE A 550 23.783 25.831 30.984 1.00 0.00 C ATOM 578 CG2 ILE A 550 25.029 23.858 29.922 1.00 0.00 C ATOM 579 CD1 ILE A 550 22.996 24.918 31.939 1.00 0.00 C ATOM 0 H ILE A 550 26.309 27.015 30.204 1.00 0.00 H new ATOM 0 HA ILE A 550 25.250 25.628 27.820 1.00 0.00 H new ATOM 0 HB ILE A 550 23.346 24.911 29.122 1.00 0.00 H new ATOM 0 HG12 ILE A 550 24.657 26.214 31.511 1.00 0.00 H new ATOM 0 HG13 ILE A 550 23.160 26.690 30.733 1.00 0.00 H new ATOM 0 HG21 ILE A 550 24.431 23.197 30.549 1.00 0.00 H new ATOM 0 HG22 ILE A 550 25.236 23.367 28.971 1.00 0.00 H new ATOM 0 HG23 ILE A 550 25.969 24.084 30.426 1.00 0.00 H new ATOM 0 HD11 ILE A 550 22.712 25.480 32.829 1.00 0.00 H new ATOM 0 HD12 ILE A 550 22.099 24.554 31.438 1.00 0.00 H new ATOM 0 HD13 ILE A 550 23.618 24.071 32.228 1.00 0.00 H new ATOM 591 N PRO A 551 23.376 27.453 27.546 1.00 0.00 N ATOM 592 CA PRO A 551 22.466 28.572 27.326 1.00 0.00 C ATOM 593 C PRO A 551 21.446 28.671 28.467 1.00 0.00 C ATOM 594 O PRO A 551 21.102 27.685 29.126 1.00 0.00 O ATOM 595 CB PRO A 551 21.811 28.294 25.971 1.00 0.00 C ATOM 596 CG PRO A 551 21.765 26.768 25.913 1.00 0.00 C ATOM 597 CD PRO A 551 23.036 26.358 26.655 1.00 0.00 C ATOM 0 HA PRO A 551 22.977 29.535 27.316 1.00 0.00 H new ATOM 0 HB2 PRO A 551 20.814 28.730 25.909 1.00 0.00 H new ATOM 0 HB3 PRO A 551 22.393 28.711 25.149 1.00 0.00 H new ATOM 0 HG2 PRO A 551 20.871 26.372 26.395 1.00 0.00 H new ATOM 0 HG3 PRO A 551 21.762 26.403 24.886 1.00 0.00 H new ATOM 0 HD2 PRO A 551 22.875 25.438 27.217 1.00 0.00 H new ATOM 0 HD3 PRO A 551 23.847 26.165 25.953 1.00 0.00 H new ATOM 605 N PHE A 552 20.955 29.882 28.707 1.00 0.00 N ATOM 606 CA PHE A 552 20.031 30.160 29.799 1.00 0.00 C ATOM 607 C PHE A 552 18.623 29.580 29.644 1.00 0.00 C ATOM 608 O PHE A 552 18.018 29.675 28.575 1.00 0.00 O ATOM 609 CB PHE A 552 19.985 31.653 30.120 1.00 0.00 C ATOM 610 CG PHE A 552 21.204 32.212 30.834 1.00 0.00 C ATOM 611 CD1 PHE A 552 22.393 32.470 30.123 1.00 0.00 C ATOM 612 CD2 PHE A 552 21.130 32.539 32.200 1.00 0.00 C ATOM 613 CE1 PHE A 552 23.504 33.035 30.776 1.00 0.00 C ATOM 614 CE2 PHE A 552 22.235 33.118 32.847 1.00 0.00 C ATOM 615 CZ PHE A 552 23.426 33.364 32.140 1.00 0.00 C ATOM 0 H PHE A 552 21.188 30.702 28.147 1.00 0.00 H new ATOM 0 HA PHE A 552 20.450 29.620 30.648 1.00 0.00 H new ATOM 0 HB2 PHE A 552 19.849 32.202 29.188 1.00 0.00 H new ATOM 0 HB3 PHE A 552 19.106 31.847 30.735 1.00 0.00 H new ATOM 0 HD1 PHE A 552 22.452 32.233 29.071 1.00 0.00 H new ATOM 0 HD2 PHE A 552 20.223 32.345 32.752 1.00 0.00 H new ATOM 0 HE1 PHE A 552 24.417 33.216 30.229 1.00 0.00 H new ATOM 0 HE2 PHE A 552 22.169 33.376 33.894 1.00 0.00 H new ATOM 0 HZ PHE A 552 24.275 33.803 32.642 1.00 0.00 H new ATOM 700 N GLN A 558 19.245 35.592 32.960 1.00 0.00 N ATOM 701 CA GLN A 558 20.563 36.105 32.565 1.00 0.00 C ATOM 702 C GLN A 558 20.879 37.495 33.134 1.00 0.00 C ATOM 703 O GLN A 558 20.000 38.356 33.236 1.00 0.00 O ATOM 704 CB GLN A 558 20.685 36.041 31.030 1.00 0.00 C ATOM 705 CG GLN A 558 22.068 36.466 30.505 1.00 0.00 C ATOM 706 CD GLN A 558 22.394 35.916 29.115 1.00 0.00 C ATOM 707 OE1 GLN A 558 21.537 35.528 28.328 1.00 0.00 O ATOM 708 NE2 GLN A 558 23.660 35.876 28.763 1.00 0.00 N ATOM 0 HA GLN A 558 21.325 35.464 33.008 1.00 0.00 H new ATOM 0 HB2 GLN A 558 20.477 35.024 30.699 1.00 0.00 H new ATOM 0 HB3 GLN A 558 19.924 36.683 30.586 1.00 0.00 H new ATOM 0 HG2 GLN A 558 22.117 37.555 30.476 1.00 0.00 H new ATOM 0 HG3 GLN A 558 22.832 36.131 31.207 1.00 0.00 H new ATOM 0 HE21 GLN A 558 24.380 36.197 29.411 1.00 0.00 H new ATOM 0 HE22 GLN A 558 23.922 35.524 27.842 1.00 0.00 H new ATOM 717 N ASP A 559 22.151 37.706 33.495 1.00 0.00 N ATOM 718 CA ASP A 559 22.671 38.940 34.096 1.00 0.00 C ATOM 719 C ASP A 559 23.902 39.462 33.306 1.00 0.00 C ATOM 720 O ASP A 559 24.631 38.684 32.680 1.00 0.00 O ATOM 721 CB ASP A 559 22.935 38.748 35.609 1.00 0.00 C ATOM 722 CG ASP A 559 21.776 38.239 36.465 1.00 0.00 C ATOM 723 OD1 ASP A 559 20.603 38.205 36.044 1.00 0.00 O ATOM 724 OD2 ASP A 559 22.038 37.926 37.648 1.00 0.00 O ATOM 0 H ASP A 559 22.873 36.996 33.372 1.00 0.00 H new ATOM 0 HA ASP A 559 21.914 39.721 34.022 1.00 0.00 H new ATOM 0 HB2 ASP A 559 23.767 38.053 35.720 1.00 0.00 H new ATOM 0 HB3 ASP A 559 23.262 39.704 36.018 1.00 0.00 H new ATOM 729 N GLU A 560 24.126 40.779 33.275 1.00 0.00 N ATOM 730 CA GLU A 560 25.127 41.428 32.404 1.00 0.00 C ATOM 731 C GLU A 560 26.578 41.138 32.841 1.00 0.00 C ATOM 732 O GLU A 560 26.988 41.485 33.951 1.00 0.00 O ATOM 733 CB GLU A 560 24.843 42.941 32.372 1.00 0.00 C ATOM 734 CG GLU A 560 25.720 43.772 31.420 1.00 0.00 C ATOM 735 CD GLU A 560 25.256 43.741 29.958 1.00 0.00 C ATOM 736 OE1 GLU A 560 25.644 44.645 29.181 1.00 0.00 O ATOM 737 OE2 GLU A 560 24.509 42.824 29.542 1.00 0.00 O ATOM 0 H GLU A 560 23.613 41.439 33.860 1.00 0.00 H new ATOM 0 HA GLU A 560 25.035 41.010 31.402 1.00 0.00 H new ATOM 0 HB2 GLU A 560 23.799 43.089 32.095 1.00 0.00 H new ATOM 0 HB3 GLU A 560 24.963 43.335 33.381 1.00 0.00 H new ATOM 0 HG2 GLU A 560 25.733 44.806 31.764 1.00 0.00 H new ATOM 0 HG3 GLU A 560 26.745 43.405 31.473 1.00 0.00 H new ATOM 744 N GLY A 561 27.379 40.524 31.963 1.00 0.00 N ATOM 745 CA GLY A 561 28.744 40.058 32.265 1.00 0.00 C ATOM 746 C GLY A 561 28.833 38.676 32.939 1.00 0.00 C ATOM 747 O GLY A 561 29.933 38.202 33.226 1.00 0.00 O ATOM 0 H GLY A 561 27.094 40.332 31.003 1.00 0.00 H new ATOM 0 HA2 GLY A 561 29.314 40.029 31.336 1.00 0.00 H new ATOM 0 HA3 GLY A 561 29.226 40.791 32.912 1.00 0.00 H new ATOM 751 N TRP A 562 27.698 38.021 33.195 1.00 0.00 N ATOM 752 CA TRP A 562 27.608 36.665 33.756 1.00 0.00 C ATOM 753 C TRP A 562 27.580 35.558 32.683 1.00 0.00 C ATOM 754 O TRP A 562 27.289 35.823 31.513 1.00 0.00 O ATOM 755 CB TRP A 562 26.389 36.601 34.692 1.00 0.00 C ATOM 756 CG TRP A 562 26.509 37.387 35.960 1.00 0.00 C ATOM 757 CD1 TRP A 562 26.455 38.735 36.061 1.00 0.00 C ATOM 758 CD2 TRP A 562 26.944 36.921 37.271 1.00 0.00 C ATOM 759 NE1 TRP A 562 26.768 39.117 37.348 1.00 0.00 N ATOM 760 CE2 TRP A 562 27.140 38.045 38.122 1.00 0.00 C ATOM 761 CE3 TRP A 562 27.169 35.653 37.833 1.00 0.00 C ATOM 762 CZ2 TRP A 562 27.596 37.921 39.441 1.00 0.00 C ATOM 763 CZ3 TRP A 562 27.609 35.511 39.160 1.00 0.00 C ATOM 764 CH2 TRP A 562 27.842 36.641 39.961 1.00 0.00 C ATOM 0 H TRP A 562 26.783 38.432 33.012 1.00 0.00 H new ATOM 0 HA TRP A 562 28.517 36.468 34.325 1.00 0.00 H new ATOM 0 HB2 TRP A 562 25.515 36.956 34.146 1.00 0.00 H new ATOM 0 HB3 TRP A 562 26.203 35.558 34.948 1.00 0.00 H new ATOM 0 HD1 TRP A 562 26.205 39.409 35.256 1.00 0.00 H new ATOM 0 HE1 TRP A 562 26.728 40.079 37.685 1.00 0.00 H new ATOM 0 HE3 TRP A 562 27.001 34.771 37.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 27.756 38.799 40.049 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 27.769 34.524 39.568 1.00 0.00 H new ATOM 0 HH2 TRP A 562 28.208 36.526 40.970 1.00 0.00 H new ATOM 775 N LEU A 563 27.814 34.306 33.088 1.00 0.00 N ATOM 776 CA LEU A 563 27.542 33.091 32.298 1.00 0.00 C ATOM 777 C LEU A 563 26.838 32.037 33.159 1.00 0.00 C ATOM 778 O LEU A 563 26.900 32.108 34.383 1.00 0.00 O ATOM 779 CB LEU A 563 28.852 32.503 31.730 1.00 0.00 C ATOM 780 CG LEU A 563 29.255 33.022 30.340 1.00 0.00 C ATOM 781 CD1 LEU A 563 30.538 32.312 29.902 1.00 0.00 C ATOM 782 CD2 LEU A 563 28.202 32.756 29.259 1.00 0.00 C ATOM 0 H LEU A 563 28.211 34.099 34.004 1.00 0.00 H new ATOM 0 HA LEU A 563 26.891 33.369 31.469 1.00 0.00 H new ATOM 0 HB2 LEU A 563 29.661 32.718 32.429 1.00 0.00 H new ATOM 0 HB3 LEU A 563 28.753 31.419 31.681 1.00 0.00 H new ATOM 0 HG LEU A 563 29.378 34.101 30.437 1.00 0.00 H new ATOM 0 HD11 LEU A 563 30.835 32.672 28.917 1.00 0.00 H new ATOM 0 HD12 LEU A 563 31.332 32.521 30.619 1.00 0.00 H new ATOM 0 HD13 LEU A 563 30.362 31.237 29.858 1.00 0.00 H new ATOM 0 HD21 LEU A 563 28.553 33.149 28.305 1.00 0.00 H new ATOM 0 HD22 LEU A 563 28.035 31.683 29.170 1.00 0.00 H new ATOM 0 HD23 LEU A 563 27.268 33.247 29.532 1.00 0.00 H new ATOM 794 N MET A 564 26.188 31.057 32.524 1.00 0.00 N ATOM 795 CA MET A 564 25.612 29.877 33.173 1.00 0.00 C ATOM 796 C MET A 564 26.288 28.582 32.714 1.00 0.00 C ATOM 797 O MET A 564 26.694 28.437 31.564 1.00 0.00 O ATOM 798 CB MET A 564 24.094 29.856 32.931 1.00 0.00 C ATOM 799 CG MET A 564 23.373 28.650 33.550 1.00 0.00 C ATOM 800 SD MET A 564 21.563 28.718 33.461 1.00 0.00 S ATOM 801 CE MET A 564 21.250 29.975 34.728 1.00 0.00 C ATOM 0 H MET A 564 26.044 31.064 31.514 1.00 0.00 H new ATOM 0 HA MET A 564 25.794 29.941 34.246 1.00 0.00 H new ATOM 0 HB2 MET A 564 23.661 30.771 33.335 1.00 0.00 H new ATOM 0 HB3 MET A 564 23.909 29.863 31.857 1.00 0.00 H new ATOM 0 HG2 MET A 564 23.714 27.744 33.048 1.00 0.00 H new ATOM 0 HG3 MET A 564 23.668 28.565 34.596 1.00 0.00 H new ATOM 0 HE1 MET A 564 20.558 30.721 34.337 1.00 0.00 H new ATOM 0 HE2 MET A 564 20.815 29.503 35.609 1.00 0.00 H new ATOM 0 HE3 MET A 564 22.188 30.458 35.001 1.00 0.00 H new ATOM 811 N GLY A 565 26.395 27.623 33.627 1.00 0.00 N ATOM 812 CA GLY A 565 26.968 26.309 33.376 1.00 0.00 C ATOM 813 C GLY A 565 26.792 25.362 34.558 1.00 0.00 C ATOM 814 O GLY A 565 26.078 25.665 35.517 1.00 0.00 O ATOM 0 H GLY A 565 26.076 27.743 34.588 1.00 0.00 H new ATOM 0 HA2 GLY A 565 26.500 25.874 32.493 1.00 0.00 H new ATOM 0 HA3 GLY A 565 28.030 26.415 33.154 1.00 0.00 H new ATOM 818 N VAL A 566 27.477 24.225 34.486 1.00 0.00 N ATOM 819 CA VAL A 566 27.579 23.215 35.550 1.00 0.00 C ATOM 820 C VAL A 566 29.029 22.738 35.663 1.00 0.00 C ATOM 821 O VAL A 566 29.706 22.606 34.644 1.00 0.00 O ATOM 822 CB VAL A 566 26.582 22.067 35.285 1.00 0.00 C ATOM 823 CG1 VAL A 566 26.909 21.305 33.993 1.00 0.00 C ATOM 824 CG2 VAL A 566 26.511 21.066 36.443 1.00 0.00 C ATOM 0 H VAL A 566 28.001 23.965 33.651 1.00 0.00 H new ATOM 0 HA VAL A 566 27.307 23.647 36.513 1.00 0.00 H new ATOM 0 HB VAL A 566 25.611 22.552 35.182 1.00 0.00 H new ATOM 0 HG11 VAL A 566 26.181 20.507 33.847 1.00 0.00 H new ATOM 0 HG12 VAL A 566 26.870 21.991 33.146 1.00 0.00 H new ATOM 0 HG13 VAL A 566 27.908 20.876 34.067 1.00 0.00 H new ATOM 0 HG21 VAL A 566 25.795 20.281 36.202 1.00 0.00 H new ATOM 0 HG22 VAL A 566 27.494 20.624 36.602 1.00 0.00 H new ATOM 0 HG23 VAL A 566 26.194 21.581 37.350 1.00 0.00 H new ATOM 834 N LYS A 567 29.543 22.493 36.869 1.00 0.00 N ATOM 835 CA LYS A 567 30.887 21.931 37.061 1.00 0.00 C ATOM 836 C LYS A 567 31.017 20.586 36.355 1.00 0.00 C ATOM 837 O LYS A 567 30.128 19.744 36.494 1.00 0.00 O ATOM 838 CB LYS A 567 31.196 21.822 38.566 1.00 0.00 C ATOM 839 CG LYS A 567 31.894 23.099 39.066 1.00 0.00 C ATOM 840 CD LYS A 567 32.297 23.028 40.544 1.00 0.00 C ATOM 841 CE LYS A 567 31.080 23.096 41.470 1.00 0.00 C ATOM 842 NZ LYS A 567 31.470 22.938 42.890 1.00 0.00 N ATOM 0 H LYS A 567 29.044 22.677 37.739 1.00 0.00 H new ATOM 0 HA LYS A 567 31.623 22.599 36.612 1.00 0.00 H new ATOM 0 HB2 LYS A 567 30.272 21.664 39.123 1.00 0.00 H new ATOM 0 HB3 LYS A 567 31.832 20.956 38.751 1.00 0.00 H new ATOM 0 HG2 LYS A 567 32.783 23.280 38.462 1.00 0.00 H new ATOM 0 HG3 LYS A 567 31.230 23.950 38.918 1.00 0.00 H new ATOM 0 HD2 LYS A 567 32.842 22.102 40.728 1.00 0.00 H new ATOM 0 HD3 LYS A 567 32.976 23.849 40.775 1.00 0.00 H new ATOM 0 HE2 LYS A 567 30.572 24.051 41.335 1.00 0.00 H new ATOM 0 HE3 LYS A 567 30.370 22.315 41.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 30.622 22.989 43.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 31.933 22.016 43.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 32.129 23.698 43.156 1.00 0.00 H new ATOM 856 N GLU A 568 32.118 20.342 35.636 1.00 0.00 N ATOM 857 CA GLU A 568 32.324 19.008 35.051 1.00 0.00 C ATOM 858 C GLU A 568 32.388 17.947 36.160 1.00 0.00 C ATOM 859 O GLU A 568 31.760 16.904 36.027 1.00 0.00 O ATOM 860 CB GLU A 568 33.529 18.902 34.091 1.00 0.00 C ATOM 861 CG GLU A 568 33.697 17.455 33.551 1.00 0.00 C ATOM 862 CD GLU A 568 34.290 17.311 32.140 1.00 0.00 C ATOM 863 OE1 GLU A 568 34.942 18.246 31.616 1.00 0.00 O ATOM 864 OE2 GLU A 568 34.101 16.228 31.533 1.00 0.00 O ATOM 0 H GLU A 568 32.856 21.020 35.448 1.00 0.00 H new ATOM 0 HA GLU A 568 31.457 18.820 34.418 1.00 0.00 H new ATOM 0 HB2 GLU A 568 33.393 19.590 33.257 1.00 0.00 H new ATOM 0 HB3 GLU A 568 34.438 19.206 34.610 1.00 0.00 H new ATOM 0 HG2 GLU A 568 34.332 16.904 34.245 1.00 0.00 H new ATOM 0 HG3 GLU A 568 32.720 16.972 33.561 1.00 0.00 H new ATOM 871 N SER A 569 33.026 18.252 37.297 1.00 0.00 N ATOM 872 CA SER A 569 33.114 17.361 38.461 1.00 0.00 C ATOM 873 C SER A 569 31.733 16.965 39.001 1.00 0.00 C ATOM 874 O SER A 569 31.517 15.816 39.389 1.00 0.00 O ATOM 875 CB SER A 569 33.940 18.073 39.541 1.00 0.00 C ATOM 876 OG SER A 569 34.097 17.304 40.719 1.00 0.00 O ATOM 0 H SER A 569 33.505 19.142 37.436 1.00 0.00 H new ATOM 0 HA SER A 569 33.596 16.431 38.160 1.00 0.00 H new ATOM 0 HB2 SER A 569 34.924 18.313 39.138 1.00 0.00 H new ATOM 0 HB3 SER A 569 33.459 19.018 39.793 1.00 0.00 H new ATOM 0 HG SER A 569 34.631 17.806 41.369 1.00 0.00 H new ATOM 882 N ASP A 570 30.783 17.902 38.979 1.00 0.00 N ATOM 883 CA ASP A 570 29.387 17.697 39.367 1.00 0.00 C ATOM 884 C ASP A 570 28.541 16.906 38.354 1.00 0.00 C ATOM 885 O ASP A 570 27.806 15.980 38.706 1.00 0.00 O ATOM 886 CB ASP A 570 28.752 19.061 39.688 1.00 0.00 C ATOM 887 CG ASP A 570 29.159 19.683 41.028 1.00 0.00 C ATOM 888 OD1 ASP A 570 28.695 20.817 41.287 1.00 0.00 O ATOM 889 OD2 ASP A 570 29.920 19.063 41.808 1.00 0.00 O ATOM 0 H ASP A 570 30.972 18.859 38.680 1.00 0.00 H new ATOM 0 HA ASP A 570 29.398 17.062 40.253 1.00 0.00 H new ATOM 0 HB2 ASP A 570 29.010 19.758 38.891 1.00 0.00 H new ATOM 0 HB3 ASP A 570 27.668 18.949 39.674 1.00 0.00 H new ATOM 894 N TRP A 571 28.688 17.243 37.070 1.00 0.00 N ATOM 895 CA TRP A 571 28.029 16.564 35.951 1.00 0.00 C ATOM 896 C TRP A 571 28.536 15.126 35.738 1.00 0.00 C ATOM 897 O TRP A 571 27.748 14.240 35.397 1.00 0.00 O ATOM 898 CB TRP A 571 28.153 17.467 34.710 1.00 0.00 C ATOM 899 CG TRP A 571 27.644 16.938 33.399 1.00 0.00 C ATOM 900 CD1 TRP A 571 28.386 16.317 32.455 1.00 0.00 C ATOM 901 CD2 TRP A 571 26.261 16.804 32.949 1.00 0.00 C ATOM 902 NE1 TRP A 571 27.578 15.869 31.428 1.00 0.00 N ATOM 903 CE2 TRP A 571 26.251 16.139 31.685 1.00 0.00 C ATOM 904 CE3 TRP A 571 25.011 17.193 33.482 1.00 0.00 C ATOM 905 CZ2 TRP A 571 25.063 15.875 30.989 1.00 0.00 C ATOM 906 CZ3 TRP A 571 23.814 16.933 32.788 1.00 0.00 C ATOM 907 CH2 TRP A 571 23.837 16.266 31.551 1.00 0.00 C ATOM 0 H TRP A 571 29.284 18.015 36.772 1.00 0.00 H new ATOM 0 HA TRP A 571 26.971 16.422 36.173 1.00 0.00 H new ATOM 0 HB2 TRP A 571 27.627 18.398 34.921 1.00 0.00 H new ATOM 0 HB3 TRP A 571 29.206 17.717 34.583 1.00 0.00 H new ATOM 0 HD1 TRP A 571 29.458 16.189 32.498 1.00 0.00 H new ATOM 0 HE1 TRP A 571 27.919 15.400 30.589 1.00 0.00 H new ATOM 0 HE3 TRP A 571 24.974 17.697 34.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 571 25.090 15.376 30.031 1.00 0.00 H new ATOM 0 HZ3 TRP A 571 22.871 17.248 33.209 1.00 0.00 H new ATOM 0 HH2 TRP A 571 22.913 16.055 31.033 1.00 0.00 H new ATOM 918 N ASN A 572 29.816 14.867 36.030 1.00 0.00 N ATOM 919 CA ASN A 572 30.465 13.549 36.013 1.00 0.00 C ATOM 920 C ASN A 572 29.910 12.610 37.103 1.00 0.00 C ATOM 921 O ASN A 572 29.736 11.414 36.859 1.00 0.00 O ATOM 922 CB ASN A 572 31.983 13.789 36.175 1.00 0.00 C ATOM 923 CG ASN A 572 32.861 12.627 35.759 1.00 0.00 C ATOM 924 OD1 ASN A 572 32.549 11.464 35.948 1.00 0.00 O ATOM 925 ND2 ASN A 572 33.993 12.913 35.162 1.00 0.00 N ATOM 0 H ASN A 572 30.462 15.610 36.299 1.00 0.00 H new ATOM 0 HA ASN A 572 30.258 13.041 35.071 1.00 0.00 H new ATOM 0 HB2 ASN A 572 32.262 14.664 35.589 1.00 0.00 H new ATOM 0 HB3 ASN A 572 32.189 14.026 37.219 1.00 0.00 H new ATOM 0 HD21 ASN A 572 34.612 12.162 34.856 1.00 0.00 H new ATOM 0 HD22 ASN A 572 34.254 13.886 35.004 1.00 0.00 H new ATOM 932 N GLN A 573 29.568 13.169 38.269 1.00 0.00 N ATOM 933 CA GLN A 573 28.931 12.473 39.397 1.00 0.00 C ATOM 934 C GLN A 573 27.432 12.193 39.183 1.00 0.00 C ATOM 935 O GLN A 573 26.806 11.507 39.992 1.00 0.00 O ATOM 936 CB GLN A 573 29.195 13.286 40.680 1.00 0.00 C ATOM 937 CG GLN A 573 30.640 13.063 41.161 1.00 0.00 C ATOM 938 CD GLN A 573 31.104 14.076 42.199 1.00 0.00 C ATOM 939 OE1 GLN A 573 30.428 15.042 42.537 1.00 0.00 O ATOM 940 NE2 GLN A 573 32.283 13.903 42.742 1.00 0.00 N ATOM 0 H GLN A 573 29.733 14.157 38.462 1.00 0.00 H new ATOM 0 HA GLN A 573 29.377 11.483 39.486 1.00 0.00 H new ATOM 0 HB2 GLN A 573 29.027 14.346 40.489 1.00 0.00 H new ATOM 0 HB3 GLN A 573 28.494 12.987 41.459 1.00 0.00 H new ATOM 0 HG2 GLN A 573 30.723 12.061 41.582 1.00 0.00 H new ATOM 0 HG3 GLN A 573 31.310 13.104 40.302 1.00 0.00 H new ATOM 0 HE21 GLN A 573 32.857 13.104 42.471 1.00 0.00 H new ATOM 0 HE22 GLN A 573 32.627 14.567 43.436 1.00 0.00 H new ATOM 949 N HIS A 574 26.851 12.697 38.088 1.00 0.00 N ATOM 950 CA HIS A 574 25.431 12.562 37.748 1.00 0.00 C ATOM 951 C HIS A 574 24.503 13.096 38.854 1.00 0.00 C ATOM 952 O HIS A 574 23.552 12.444 39.304 1.00 0.00 O ATOM 953 CB HIS A 574 25.113 11.142 37.255 1.00 0.00 C ATOM 954 CG HIS A 574 25.938 10.727 36.062 1.00 0.00 C ATOM 955 ND1 HIS A 574 25.821 11.212 34.781 1.00 0.00 N ATOM 956 CD2 HIS A 574 26.896 9.751 36.034 1.00 0.00 C ATOM 957 CE1 HIS A 574 26.679 10.541 33.996 1.00 0.00 C ATOM 958 NE2 HIS A 574 27.358 9.625 34.713 1.00 0.00 N ATOM 0 H HIS A 574 27.374 13.228 37.392 1.00 0.00 H new ATOM 0 HA HIS A 574 25.218 13.215 36.901 1.00 0.00 H new ATOM 0 HB2 HIS A 574 25.282 10.436 38.068 1.00 0.00 H new ATOM 0 HB3 HIS A 574 24.056 11.083 36.996 1.00 0.00 H new ATOM 0 HD2 HIS A 574 27.238 9.176 36.882 1.00 0.00 H new ATOM 0 HE1 HIS A 574 26.807 10.712 32.937 1.00 0.00 H new ATOM 0 HE2 HIS A 574 28.063 8.974 34.368 1.00 0.00 H new ATOM 966 N LYS A 575 24.824 14.305 39.319 1.00 0.00 N ATOM 967 CA LYS A 575 23.956 15.142 40.155 1.00 0.00 C ATOM 968 C LYS A 575 22.837 15.797 39.336 1.00 0.00 C ATOM 969 O LYS A 575 22.918 15.883 38.109 1.00 0.00 O ATOM 970 CB LYS A 575 24.827 16.186 40.868 1.00 0.00 C ATOM 971 CG LYS A 575 25.750 15.560 41.929 1.00 0.00 C ATOM 972 CD LYS A 575 26.959 16.458 42.218 1.00 0.00 C ATOM 973 CE LYS A 575 27.523 16.279 43.631 1.00 0.00 C ATOM 974 NZ LYS A 575 28.010 14.913 43.921 1.00 0.00 N ATOM 0 H LYS A 575 25.723 14.744 39.119 1.00 0.00 H new ATOM 0 HA LYS A 575 23.458 14.519 40.897 1.00 0.00 H new ATOM 0 HB2 LYS A 575 25.432 16.714 40.131 1.00 0.00 H new ATOM 0 HB3 LYS A 575 24.184 16.927 41.343 1.00 0.00 H new ATOM 0 HG2 LYS A 575 25.190 15.394 42.849 1.00 0.00 H new ATOM 0 HG3 LYS A 575 26.093 14.584 41.585 1.00 0.00 H new ATOM 0 HD2 LYS A 575 27.743 16.245 41.492 1.00 0.00 H new ATOM 0 HD3 LYS A 575 26.670 17.500 42.079 1.00 0.00 H new ATOM 0 HE2 LYS A 575 28.343 16.983 43.775 1.00 0.00 H new ATOM 0 HE3 LYS A 575 26.750 16.538 44.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 28.152 14.805 44.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 27.309 14.218 43.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 28.912 14.754 43.428 1.00 0.00 H new ATOM 988 N GLU A 576 21.796 16.269 40.016 1.00 0.00 N ATOM 989 CA GLU A 576 20.658 16.967 39.409 1.00 0.00 C ATOM 990 C GLU A 576 21.060 18.299 38.748 1.00 0.00 C ATOM 991 O GLU A 576 21.268 19.318 39.411 1.00 0.00 O ATOM 992 CB GLU A 576 19.479 17.118 40.391 1.00 0.00 C ATOM 993 CG GLU A 576 19.804 17.702 41.774 1.00 0.00 C ATOM 994 CD GLU A 576 20.341 16.706 42.814 1.00 0.00 C ATOM 995 OE1 GLU A 576 20.679 15.549 42.465 1.00 0.00 O ATOM 996 OE2 GLU A 576 20.456 17.096 44.001 1.00 0.00 O ATOM 0 H GLU A 576 21.715 16.176 41.029 1.00 0.00 H new ATOM 0 HA GLU A 576 20.303 16.332 38.598 1.00 0.00 H new ATOM 0 HB2 GLU A 576 18.725 17.751 39.923 1.00 0.00 H new ATOM 0 HB3 GLU A 576 19.027 16.136 40.534 1.00 0.00 H new ATOM 0 HG2 GLU A 576 20.539 18.497 41.648 1.00 0.00 H new ATOM 0 HG3 GLU A 576 18.901 18.163 42.174 1.00 0.00 H new ATOM 1003 N LEU A 577 21.154 18.309 37.412 1.00 0.00 N ATOM 1004 CA LEU A 577 21.637 19.463 36.646 1.00 0.00 C ATOM 1005 C LEU A 577 20.791 20.719 36.907 1.00 0.00 C ATOM 1006 O LEU A 577 21.347 21.808 36.965 1.00 0.00 O ATOM 1007 CB LEU A 577 21.692 19.097 35.149 1.00 0.00 C ATOM 1008 CG LEU A 577 21.950 20.290 34.205 1.00 0.00 C ATOM 1009 CD1 LEU A 577 23.367 20.827 34.356 1.00 0.00 C ATOM 1010 CD2 LEU A 577 21.719 19.980 32.732 1.00 0.00 C ATOM 0 H LEU A 577 20.896 17.512 36.830 1.00 0.00 H new ATOM 0 HA LEU A 577 22.645 19.710 36.979 1.00 0.00 H new ATOM 0 HB2 LEU A 577 22.476 18.355 34.998 1.00 0.00 H new ATOM 0 HB3 LEU A 577 20.750 18.626 34.869 1.00 0.00 H new ATOM 0 HG LEU A 577 21.218 21.037 34.512 1.00 0.00 H new ATOM 0 HD11 LEU A 577 23.512 21.666 33.676 1.00 0.00 H new ATOM 0 HD12 LEU A 577 23.522 21.160 35.382 1.00 0.00 H new ATOM 0 HD13 LEU A 577 24.082 20.039 34.118 1.00 0.00 H new ATOM 0 HD21 LEU A 577 21.922 20.870 32.137 1.00 0.00 H new ATOM 0 HD22 LEU A 577 22.385 19.176 32.421 1.00 0.00 H new ATOM 0 HD23 LEU A 577 20.684 19.672 32.583 1.00 0.00 H new ATOM 1022 N GLU A 578 19.478 20.593 37.103 1.00 0.00 N ATOM 1023 CA GLU A 578 18.556 21.718 37.345 1.00 0.00 C ATOM 1024 C GLU A 578 18.819 22.469 38.671 1.00 0.00 C ATOM 1025 O GLU A 578 18.337 23.591 38.842 1.00 0.00 O ATOM 1026 CB GLU A 578 17.104 21.185 37.291 1.00 0.00 C ATOM 1027 CG GLU A 578 16.720 20.325 38.512 1.00 0.00 C ATOM 1028 CD GLU A 578 15.379 19.590 38.372 1.00 0.00 C ATOM 1029 OE1 GLU A 578 15.080 19.012 37.299 1.00 0.00 O ATOM 1030 OE2 GLU A 578 14.606 19.551 39.361 1.00 0.00 O ATOM 0 H GLU A 578 19.009 19.687 37.099 1.00 0.00 H new ATOM 0 HA GLU A 578 18.726 22.457 36.562 1.00 0.00 H new ATOM 0 HB2 GLU A 578 16.418 22.029 37.220 1.00 0.00 H new ATOM 0 HB3 GLU A 578 16.976 20.593 36.385 1.00 0.00 H new ATOM 0 HG2 GLU A 578 17.507 19.591 38.686 1.00 0.00 H new ATOM 0 HG3 GLU A 578 16.680 20.965 39.394 1.00 0.00 H new ATOM 1037 N LYS A 579 19.585 21.869 39.597 1.00 0.00 N ATOM 1038 CA LYS A 579 19.982 22.454 40.896 1.00 0.00 C ATOM 1039 C LYS A 579 21.491 22.702 40.989 1.00 0.00 C ATOM 1040 O LYS A 579 21.904 23.735 41.512 1.00 0.00 O ATOM 1041 CB LYS A 579 19.550 21.556 42.073 1.00 0.00 C ATOM 1042 CG LYS A 579 18.083 21.096 42.101 1.00 0.00 C ATOM 1043 CD LYS A 579 17.071 22.250 42.050 1.00 0.00 C ATOM 1044 CE LYS A 579 15.625 21.788 42.283 1.00 0.00 C ATOM 1045 NZ LYS A 579 15.396 21.311 43.667 1.00 0.00 N ATOM 0 H LYS A 579 19.960 20.930 39.460 1.00 0.00 H new ATOM 0 HA LYS A 579 19.469 23.414 40.960 1.00 0.00 H new ATOM 0 HB2 LYS A 579 20.183 20.669 42.071 1.00 0.00 H new ATOM 0 HB3 LYS A 579 19.754 22.092 43.000 1.00 0.00 H new ATOM 0 HG2 LYS A 579 17.904 20.431 41.256 1.00 0.00 H new ATOM 0 HG3 LYS A 579 17.911 20.514 43.007 1.00 0.00 H new ATOM 0 HD2 LYS A 579 17.336 22.992 42.803 1.00 0.00 H new ATOM 0 HD3 LYS A 579 17.138 22.742 41.080 1.00 0.00 H new ATOM 0 HE2 LYS A 579 14.945 22.613 42.070 1.00 0.00 H new ATOM 0 HE3 LYS A 579 15.386 20.988 41.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 14.379 21.156 43.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 15.908 20.418 43.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 15.740 22.024 44.341 1.00 0.00 H new ATOM 1059 N CYS A 580 22.316 21.786 40.477 1.00 0.00 N ATOM 1060 CA CYS A 580 23.771 21.946 40.453 1.00 0.00 C ATOM 1061 C CYS A 580 24.271 23.015 39.471 1.00 0.00 C ATOM 1062 O CYS A 580 25.343 23.582 39.703 1.00 0.00 O ATOM 1063 CB CYS A 580 24.450 20.590 40.222 1.00 0.00 C ATOM 1064 SG CYS A 580 24.426 19.652 41.775 1.00 0.00 S ATOM 0 H CYS A 580 21.993 20.910 40.066 1.00 0.00 H new ATOM 0 HA CYS A 580 24.057 22.323 41.435 1.00 0.00 H new ATOM 0 HB2 CYS A 580 23.931 20.037 39.439 1.00 0.00 H new ATOM 0 HB3 CYS A 580 25.476 20.734 39.884 1.00 0.00 H new ATOM 0 HG CYS A 580 25.633 19.566 42.249 1.00 0.00 H new ATOM 1070 N ARG A 581 23.508 23.332 38.413 1.00 0.00 N ATOM 1071 CA ARG A 581 23.778 24.493 37.549 1.00 0.00 C ATOM 1072 C ARG A 581 23.691 25.810 38.324 1.00 0.00 C ATOM 1073 O ARG A 581 23.032 25.908 39.360 1.00 0.00 O ATOM 1074 CB ARG A 581 22.843 24.515 36.325 1.00 0.00 C ATOM 1075 CG ARG A 581 21.395 24.857 36.709 1.00 0.00 C ATOM 1076 CD ARG A 581 20.458 24.990 35.516 1.00 0.00 C ATOM 1077 NE ARG A 581 20.272 23.791 34.680 1.00 0.00 N ATOM 1078 CZ ARG A 581 19.797 23.816 33.440 1.00 0.00 C ATOM 1079 NH1 ARG A 581 19.484 24.926 32.830 1.00 0.00 N ATOM 1080 NH2 ARG A 581 19.603 22.718 32.779 1.00 0.00 N ATOM 0 H ARG A 581 22.689 22.793 38.133 1.00 0.00 H new ATOM 0 HA ARG A 581 24.801 24.389 37.188 1.00 0.00 H new ATOM 0 HB2 ARG A 581 23.208 25.246 35.604 1.00 0.00 H new ATOM 0 HB3 ARG A 581 22.867 23.542 35.834 1.00 0.00 H new ATOM 0 HG2 ARG A 581 21.013 24.083 37.375 1.00 0.00 H new ATOM 0 HG3 ARG A 581 21.389 25.792 37.270 1.00 0.00 H new ATOM 0 HD2 ARG A 581 19.481 25.302 35.885 1.00 0.00 H new ATOM 0 HD3 ARG A 581 20.830 25.793 34.880 1.00 0.00 H new ATOM 0 HE ARG A 581 20.524 22.886 35.078 1.00 0.00 H new ATOM 0 HH11 ARG A 581 19.601 25.820 33.306 1.00 0.00 H new ATOM 0 HH12 ARG A 581 19.122 24.900 31.877 1.00 0.00 H new ATOM 0 HH21 ARG A 581 19.816 21.819 33.211 1.00 0.00 H new ATOM 0 HH22 ARG A 581 19.238 22.753 31.827 1.00 0.00 H new ATOM 1094 N GLY A 582 24.288 26.846 37.753 1.00 0.00 N ATOM 1095 CA GLY A 582 24.241 28.204 38.291 1.00 0.00 C ATOM 1096 C GLY A 582 24.867 29.253 37.384 1.00 0.00 C ATOM 1097 O GLY A 582 25.505 28.922 36.383 1.00 0.00 O ATOM 0 H GLY A 582 24.827 26.769 36.891 1.00 0.00 H new ATOM 0 HA2 GLY A 582 23.201 28.474 38.477 1.00 0.00 H new ATOM 0 HA3 GLY A 582 24.752 28.220 39.254 1.00 0.00 H new ATOM 1101 N VAL A 583 24.704 30.522 37.767 1.00 0.00 N ATOM 1102 CA VAL A 583 25.401 31.663 37.164 1.00 0.00 C ATOM 1103 C VAL A 583 26.730 31.938 37.866 1.00 0.00 C ATOM 1104 O VAL A 583 26.817 31.915 39.091 1.00 0.00 O ATOM 1105 CB VAL A 583 24.546 32.948 37.102 1.00 0.00 C ATOM 1106 CG1 VAL A 583 23.260 32.784 36.301 1.00 0.00 C ATOM 1107 CG2 VAL A 583 24.149 33.502 38.471 1.00 0.00 C ATOM 0 H VAL A 583 24.071 30.791 38.520 1.00 0.00 H new ATOM 0 HA VAL A 583 25.598 31.372 36.132 1.00 0.00 H new ATOM 0 HB VAL A 583 25.215 33.650 36.604 1.00 0.00 H new ATOM 0 HG11 VAL A 583 22.710 33.725 36.300 1.00 0.00 H new ATOM 0 HG12 VAL A 583 23.503 32.504 35.276 1.00 0.00 H new ATOM 0 HG13 VAL A 583 22.646 32.005 36.754 1.00 0.00 H new ATOM 0 HG21 VAL A 583 23.551 34.404 38.339 1.00 0.00 H new ATOM 0 HG22 VAL A 583 23.566 32.756 39.010 1.00 0.00 H new ATOM 0 HG23 VAL A 583 25.047 33.742 39.041 1.00 0.00 H new ATOM 1117 N PHE A 584 27.763 32.253 37.094 1.00 0.00 N ATOM 1118 CA PHE A 584 29.074 32.683 37.591 1.00 0.00 C ATOM 1119 C PHE A 584 29.618 33.922 36.853 1.00 0.00 C ATOM 1120 O PHE A 584 29.242 34.156 35.696 1.00 0.00 O ATOM 1121 CB PHE A 584 30.074 31.520 37.575 1.00 0.00 C ATOM 1122 CG PHE A 584 30.273 30.880 36.216 1.00 0.00 C ATOM 1123 CD1 PHE A 584 29.382 29.895 35.757 1.00 0.00 C ATOM 1124 CD2 PHE A 584 31.355 31.283 35.411 1.00 0.00 C ATOM 1125 CE1 PHE A 584 29.586 29.296 34.504 1.00 0.00 C ATOM 1126 CE2 PHE A 584 31.551 30.692 34.153 1.00 0.00 C ATOM 1127 CZ PHE A 584 30.672 29.690 33.708 1.00 0.00 C ATOM 0 H PHE A 584 27.715 32.217 36.076 1.00 0.00 H new ATOM 0 HA PHE A 584 28.935 32.993 38.627 1.00 0.00 H new ATOM 0 HB2 PHE A 584 31.037 31.881 37.937 1.00 0.00 H new ATOM 0 HB3 PHE A 584 29.735 30.757 38.276 1.00 0.00 H new ATOM 0 HD1 PHE A 584 28.542 29.599 36.367 1.00 0.00 H new ATOM 0 HD2 PHE A 584 32.034 32.046 35.761 1.00 0.00 H new ATOM 0 HE1 PHE A 584 28.908 28.533 34.153 1.00 0.00 H new ATOM 0 HE2 PHE A 584 32.375 31.006 33.529 1.00 0.00 H new ATOM 0 HZ PHE A 584 30.833 29.221 32.749 1.00 0.00 H new ATOM 1137 N PRO A 585 30.499 34.724 37.480 1.00 0.00 N ATOM 1138 CA PRO A 585 31.238 35.767 36.772 1.00 0.00 C ATOM 1139 C PRO A 585 32.186 35.117 35.761 1.00 0.00 C ATOM 1140 O PRO A 585 33.169 34.481 36.142 1.00 0.00 O ATOM 1141 CB PRO A 585 31.981 36.541 37.860 1.00 0.00 C ATOM 1142 CG PRO A 585 32.152 35.531 38.996 1.00 0.00 C ATOM 1143 CD PRO A 585 30.933 34.630 38.873 1.00 0.00 C ATOM 0 HA PRO A 585 30.599 36.440 36.201 1.00 0.00 H new ATOM 0 HB2 PRO A 585 32.945 36.903 37.502 1.00 0.00 H new ATOM 0 HB3 PRO A 585 31.413 37.413 38.185 1.00 0.00 H new ATOM 0 HG2 PRO A 585 33.078 34.966 38.892 1.00 0.00 H new ATOM 0 HG3 PRO A 585 32.187 36.025 39.967 1.00 0.00 H new ATOM 0 HD2 PRO A 585 31.180 33.601 39.136 1.00 0.00 H new ATOM 0 HD3 PRO A 585 30.141 34.950 39.550 1.00 0.00 H new ATOM 1151 N GLU A 586 31.914 35.270 34.462 1.00 0.00 N ATOM 1152 CA GLU A 586 32.714 34.634 33.400 1.00 0.00 C ATOM 1153 C GLU A 586 34.202 35.029 33.472 1.00 0.00 C ATOM 1154 O GLU A 586 35.078 34.245 33.095 1.00 0.00 O ATOM 1155 CB GLU A 586 32.103 34.971 32.026 1.00 0.00 C ATOM 1156 CG GLU A 586 32.410 36.384 31.497 1.00 0.00 C ATOM 1157 CD GLU A 586 31.682 36.711 30.183 1.00 0.00 C ATOM 1158 OE1 GLU A 586 31.667 37.892 29.764 1.00 0.00 O ATOM 1159 OE2 GLU A 586 31.142 35.805 29.508 1.00 0.00 O ATOM 0 H GLU A 586 31.139 35.834 34.114 1.00 0.00 H new ATOM 0 HA GLU A 586 32.683 33.555 33.548 1.00 0.00 H new ATOM 0 HB2 GLU A 586 32.462 34.243 31.299 1.00 0.00 H new ATOM 0 HB3 GLU A 586 31.021 34.852 32.089 1.00 0.00 H new ATOM 0 HG2 GLU A 586 32.128 37.117 32.253 1.00 0.00 H new ATOM 0 HG3 GLU A 586 33.485 36.482 31.343 1.00 0.00 H new ATOM 1166 N ASN A 587 34.475 36.216 34.027 1.00 0.00 N ATOM 1167 CA ASN A 587 35.794 36.803 34.245 1.00 0.00 C ATOM 1168 C ASN A 587 36.623 36.128 35.360 1.00 0.00 C ATOM 1169 O ASN A 587 37.831 36.351 35.448 1.00 0.00 O ATOM 1170 CB ASN A 587 35.626 38.321 34.465 1.00 0.00 C ATOM 1171 CG ASN A 587 34.655 38.719 35.568 1.00 0.00 C ATOM 1172 OD1 ASN A 587 33.480 38.378 35.544 1.00 0.00 O ATOM 1173 ND2 ASN A 587 35.085 39.507 36.518 1.00 0.00 N ATOM 0 H ASN A 587 33.729 36.829 34.356 1.00 0.00 H new ATOM 0 HA ASN A 587 36.389 36.622 33.350 1.00 0.00 H new ATOM 0 HB2 ASN A 587 36.603 38.748 34.693 1.00 0.00 H new ATOM 0 HB3 ASN A 587 35.292 38.771 33.530 1.00 0.00 H new ATOM 0 HD21 ASN A 587 34.442 39.837 37.238 1.00 0.00 H new ATOM 0 HD22 ASN A 587 36.064 39.792 36.540 1.00 0.00 H new ATOM 1180 N PHE A 588 36.017 35.267 36.190 1.00 0.00 N ATOM 1181 CA PHE A 588 36.745 34.318 37.047 1.00 0.00 C ATOM 1182 C PHE A 588 37.370 33.098 36.356 1.00 0.00 C ATOM 1183 O PHE A 588 38.188 32.393 36.949 1.00 0.00 O ATOM 1184 CB PHE A 588 35.934 33.928 38.293 1.00 0.00 C ATOM 1185 CG PHE A 588 35.985 34.928 39.434 1.00 0.00 C ATOM 1186 CD1 PHE A 588 35.379 36.193 39.311 1.00 0.00 C ATOM 1187 CD2 PHE A 588 36.627 34.582 40.637 1.00 0.00 C ATOM 1188 CE1 PHE A 588 35.392 37.089 40.391 1.00 0.00 C ATOM 1189 CE2 PHE A 588 36.663 35.492 41.708 1.00 0.00 C ATOM 1190 CZ PHE A 588 36.036 36.743 41.590 1.00 0.00 C ATOM 0 H PHE A 588 35.003 35.208 36.287 1.00 0.00 H new ATOM 0 HA PHE A 588 37.618 34.890 37.362 1.00 0.00 H new ATOM 0 HB2 PHE A 588 34.894 33.787 38.001 1.00 0.00 H new ATOM 0 HB3 PHE A 588 36.296 32.966 38.657 1.00 0.00 H new ATOM 0 HD1 PHE A 588 34.903 36.474 38.383 1.00 0.00 H new ATOM 0 HD2 PHE A 588 37.094 33.613 40.738 1.00 0.00 H new ATOM 0 HE1 PHE A 588 34.905 38.049 40.300 1.00 0.00 H new ATOM 0 HE2 PHE A 588 37.173 35.229 42.623 1.00 0.00 H new ATOM 0 HZ PHE A 588 36.049 37.436 42.418 1.00 0.00 H new ATOM 1200 N THR A 589 36.981 32.835 35.108 1.00 0.00 N ATOM 1201 CA THR A 589 37.365 31.658 34.323 1.00 0.00 C ATOM 1202 C THR A 589 38.046 32.046 33.009 1.00 0.00 C ATOM 1203 O THR A 589 38.104 33.223 32.662 1.00 0.00 O ATOM 1204 CB THR A 589 36.133 30.774 34.064 1.00 0.00 C ATOM 1205 OG1 THR A 589 35.184 31.433 33.251 1.00 0.00 O ATOM 1206 CG2 THR A 589 35.411 30.271 35.321 1.00 0.00 C ATOM 0 H THR A 589 36.363 33.462 34.593 1.00 0.00 H new ATOM 0 HA THR A 589 38.093 31.090 34.902 1.00 0.00 H new ATOM 0 HB THR A 589 36.550 29.902 33.560 1.00 0.00 H new ATOM 0 HG1 THR A 589 35.353 32.398 33.267 1.00 0.00 H new ATOM 0 HG21 THR A 589 34.558 29.658 35.030 1.00 0.00 H new ATOM 0 HG22 THR A 589 36.098 29.675 35.921 1.00 0.00 H new ATOM 0 HG23 THR A 589 35.063 31.122 35.906 1.00 0.00 H new ATOM 1214 N GLU A 590 38.566 31.066 32.271 1.00 0.00 N ATOM 1215 CA GLU A 590 39.093 31.254 30.913 1.00 0.00 C ATOM 1216 C GLU A 590 38.446 30.236 29.961 1.00 0.00 C ATOM 1217 O GLU A 590 38.290 29.066 30.321 1.00 0.00 O ATOM 1218 CB GLU A 590 40.638 31.215 30.918 1.00 0.00 C ATOM 1219 CG GLU A 590 41.307 29.831 30.843 1.00 0.00 C ATOM 1220 CD GLU A 590 42.841 29.907 30.976 1.00 0.00 C ATOM 1221 OE1 GLU A 590 43.441 31.009 30.977 1.00 0.00 O ATOM 1222 OE2 GLU A 590 43.508 28.854 31.112 1.00 0.00 O ATOM 0 H GLU A 590 38.636 30.104 32.601 1.00 0.00 H new ATOM 0 HA GLU A 590 38.827 32.243 30.539 1.00 0.00 H new ATOM 0 HB2 GLU A 590 40.994 31.808 30.075 1.00 0.00 H new ATOM 0 HB3 GLU A 590 40.985 31.709 31.825 1.00 0.00 H new ATOM 0 HG2 GLU A 590 40.908 29.195 31.634 1.00 0.00 H new ATOM 0 HG3 GLU A 590 41.051 29.359 29.895 1.00 0.00 H new ATOM 1229 N ARG A 591 38.039 30.673 28.762 1.00 0.00 N ATOM 1230 CA ARG A 591 37.430 29.847 27.715 1.00 0.00 C ATOM 1231 C ARG A 591 38.452 28.809 27.232 1.00 0.00 C ATOM 1232 O ARG A 591 39.520 29.164 26.726 1.00 0.00 O ATOM 1233 CB ARG A 591 36.943 30.797 26.590 1.00 0.00 C ATOM 1234 CG ARG A 591 35.619 30.404 25.914 1.00 0.00 C ATOM 1235 CD ARG A 591 35.626 29.008 25.295 1.00 0.00 C ATOM 1236 NE ARG A 591 36.612 28.881 24.205 1.00 0.00 N ATOM 1237 CZ ARG A 591 36.404 28.602 22.932 1.00 0.00 C ATOM 1238 NH1 ARG A 591 35.249 28.637 22.335 1.00 0.00 N ATOM 1239 NH2 ARG A 591 37.424 28.281 22.199 1.00 0.00 N ATOM 0 H ARG A 591 38.129 31.651 28.485 1.00 0.00 H new ATOM 0 HA ARG A 591 36.569 29.287 28.081 1.00 0.00 H new ATOM 0 HB2 ARG A 591 36.834 31.798 27.007 1.00 0.00 H new ATOM 0 HB3 ARG A 591 37.718 30.853 25.825 1.00 0.00 H new ATOM 0 HG2 ARG A 591 34.817 30.459 26.650 1.00 0.00 H new ATOM 0 HG3 ARG A 591 35.390 31.133 25.137 1.00 0.00 H new ATOM 0 HD2 ARG A 591 35.846 28.272 26.068 1.00 0.00 H new ATOM 0 HD3 ARG A 591 34.632 28.779 24.911 1.00 0.00 H new ATOM 0 HE ARG A 591 37.586 29.029 24.471 1.00 0.00 H new ATOM 0 HH11 ARG A 591 34.412 28.896 22.858 1.00 0.00 H new ATOM 0 HH12 ARG A 591 35.180 28.405 21.344 1.00 0.00 H new ATOM 0 HH21 ARG A 591 38.357 28.249 22.610 1.00 0.00 H new ATOM 0 HH22 ARG A 591 37.293 28.060 21.212 1.00 0.00 H new ATOM 1253 N VAL A 592 38.119 27.527 27.372 1.00 0.00 N ATOM 1254 CA VAL A 592 38.941 26.386 26.923 1.00 0.00 C ATOM 1255 C VAL A 592 38.339 25.841 25.607 1.00 0.00 C ATOM 1256 O VAL A 592 37.127 25.947 25.401 1.00 0.00 O ATOM 1257 CB VAL A 592 38.999 25.286 28.007 1.00 0.00 C ATOM 1258 CG1 VAL A 592 40.033 25.649 29.079 1.00 0.00 C ATOM 1259 CG2 VAL A 592 37.656 25.038 28.699 1.00 0.00 C ATOM 0 H VAL A 592 37.246 27.237 27.813 1.00 0.00 H new ATOM 0 HA VAL A 592 39.966 26.714 26.749 1.00 0.00 H new ATOM 0 HB VAL A 592 39.278 24.371 27.484 1.00 0.00 H new ATOM 0 HG11 VAL A 592 40.063 24.865 29.836 1.00 0.00 H new ATOM 0 HG12 VAL A 592 41.016 25.746 28.618 1.00 0.00 H new ATOM 0 HG13 VAL A 592 39.756 26.594 29.546 1.00 0.00 H new ATOM 0 HG21 VAL A 592 37.772 24.254 29.447 1.00 0.00 H new ATOM 0 HG22 VAL A 592 37.321 25.955 29.183 1.00 0.00 H new ATOM 0 HG23 VAL A 592 36.918 24.728 27.960 1.00 0.00 H new ATOM 1328 N PRO B1731 40.029 39.335 39.760 1.00 0.00 N ATOM 1329 CA PRO B1731 38.704 39.727 39.276 1.00 0.00 C ATOM 1330 C PRO B1731 37.694 39.935 40.419 1.00 0.00 C ATOM 1331 O PRO B1731 37.880 39.447 41.536 1.00 0.00 O ATOM 1332 CB PRO B1731 38.266 38.588 38.347 1.00 0.00 C ATOM 1333 CG PRO B1731 38.922 37.365 38.974 1.00 0.00 C ATOM 1334 CD PRO B1731 40.252 37.922 39.477 1.00 0.00 C ATOM 0 HA PRO B1731 38.744 40.688 38.763 1.00 0.00 H new ATOM 0 HB2 PRO B1731 37.181 38.491 38.311 1.00 0.00 H new ATOM 0 HB3 PRO B1731 38.605 38.748 37.324 1.00 0.00 H new ATOM 0 HG2 PRO B1731 38.322 36.954 39.786 1.00 0.00 H new ATOM 0 HG3 PRO B1731 39.066 36.565 38.248 1.00 0.00 H new ATOM 0 HD2 PRO B1731 40.580 37.394 40.373 1.00 0.00 H new ATOM 0 HD3 PRO B1731 41.034 37.795 38.728 1.00 0.00 H new ATOM 1342 N VAL B1732 36.582 40.606 40.105 1.00 0.00 N ATOM 1343 CA VAL B1732 35.397 40.767 40.965 1.00 0.00 C ATOM 1344 C VAL B1732 34.129 40.653 40.108 1.00 0.00 C ATOM 1345 O VAL B1732 34.127 40.970 38.913 1.00 0.00 O ATOM 1346 CB VAL B1732 35.475 42.083 41.766 1.00 0.00 C ATOM 1347 CG1 VAL B1732 35.721 43.326 40.912 1.00 0.00 C ATOM 1348 CG2 VAL B1732 34.218 42.358 42.599 1.00 0.00 C ATOM 0 H VAL B1732 36.474 41.074 39.205 1.00 0.00 H new ATOM 0 HA VAL B1732 35.363 39.969 41.707 1.00 0.00 H new ATOM 0 HB VAL B1732 36.335 41.914 42.414 1.00 0.00 H new ATOM 0 HG11 VAL B1732 35.762 44.206 41.554 1.00 0.00 H new ATOM 0 HG12 VAL B1732 36.667 43.221 40.380 1.00 0.00 H new ATOM 0 HG13 VAL B1732 34.910 43.439 40.192 1.00 0.00 H new ATOM 0 HG21 VAL B1732 34.337 43.298 43.138 1.00 0.00 H new ATOM 0 HG22 VAL B1732 33.352 42.425 41.940 1.00 0.00 H new ATOM 0 HG23 VAL B1732 34.070 41.547 43.312 1.00 0.00 H new ATOM 1358 N ALA B1733 33.056 40.116 40.692 1.00 0.00 N ATOM 1359 CA ALA B1733 31.818 39.816 39.972 1.00 0.00 C ATOM 1360 C ALA B1733 31.005 41.083 39.588 1.00 0.00 C ATOM 1361 O ALA B1733 30.916 42.012 40.399 1.00 0.00 O ATOM 1362 CB ALA B1733 30.988 38.848 40.818 1.00 0.00 C ATOM 0 H ALA B1733 33.022 39.876 41.683 1.00 0.00 H new ATOM 0 HA ALA B1733 32.080 39.353 39.020 1.00 0.00 H new ATOM 0 HB1 ALA B1733 30.060 38.613 40.297 1.00 0.00 H new ATOM 0 HB2 ALA B1733 31.554 37.931 40.983 1.00 0.00 H new ATOM 0 HB3 ALA B1733 30.758 39.310 41.778 1.00 0.00 H new ATOM 1368 N PRO B1734 30.378 41.130 38.393 1.00 0.00 N ATOM 1369 CA PRO B1734 29.553 42.263 37.956 1.00 0.00 C ATOM 1370 C PRO B1734 28.129 42.262 38.573 1.00 0.00 C ATOM 1371 O PRO B1734 27.719 41.258 39.163 1.00 0.00 O ATOM 1372 CB PRO B1734 29.531 42.163 36.428 1.00 0.00 C ATOM 1373 CG PRO B1734 29.718 40.678 36.132 1.00 0.00 C ATOM 1374 CD PRO B1734 30.502 40.139 37.328 1.00 0.00 C ATOM 0 HA PRO B1734 29.971 43.210 38.298 1.00 0.00 H new ATOM 0 HB2 PRO B1734 28.590 42.532 36.021 1.00 0.00 H new ATOM 0 HB3 PRO B1734 30.327 42.759 35.981 1.00 0.00 H new ATOM 0 HG2 PRO B1734 28.759 40.171 36.027 1.00 0.00 H new ATOM 0 HG3 PRO B1734 30.263 40.526 35.200 1.00 0.00 H new ATOM 0 HD2 PRO B1734 30.105 39.175 37.648 1.00 0.00 H new ATOM 0 HD3 PRO B1734 31.548 39.982 37.066 1.00 0.00 H new ATOM 1382 N PRO B1735 27.342 43.354 38.450 1.00 0.00 N ATOM 1383 CA PRO B1735 25.983 43.460 39.001 1.00 0.00 C ATOM 1384 C PRO B1735 24.975 42.473 38.387 1.00 0.00 C ATOM 1385 O PRO B1735 25.163 41.978 37.272 1.00 0.00 O ATOM 1386 CB PRO B1735 25.558 44.922 38.812 1.00 0.00 C ATOM 1387 CG PRO B1735 26.883 45.662 38.675 1.00 0.00 C ATOM 1388 CD PRO B1735 27.744 44.650 37.931 1.00 0.00 C ATOM 0 HA PRO B1735 25.992 43.179 40.054 1.00 0.00 H new ATOM 0 HB2 PRO B1735 24.935 45.048 37.927 1.00 0.00 H new ATOM 0 HB3 PRO B1735 24.981 45.286 39.662 1.00 0.00 H new ATOM 0 HG2 PRO B1735 26.774 46.592 38.117 1.00 0.00 H new ATOM 0 HG3 PRO B1735 27.306 45.921 39.645 1.00 0.00 H new ATOM 0 HD2 PRO B1735 27.582 44.711 36.855 1.00 0.00 H new ATOM 0 HD3 PRO B1735 28.805 44.832 38.105 1.00 0.00 H new