USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 881 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 543 THR OG1 : rot 180:sc= -0.864 USER MOD Set 1.2: A 574 TYR OH : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot 180:sc= -0.121 USER MOD Single : A 501 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.434) USER MOD Single : A 502 ASN : amide:sc= -8.74! C(o=-8.7!,f=-14!) USER MOD Single : A 515 SER OG : rot 150:sc= -0.301 USER MOD Single : A 516 THR OG1 : rot 180:sc= 0.016 USER MOD Single : A 522 THR OG1 : rot 180:sc=0.000558 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 532 HIS : no HD1:sc= -0.0657 X(o=-0.066,f=-0.21) USER MOD Single : A 537 THR OG1 : rot 99:sc= 1.08 USER MOD Single : A 538 CYS SG : rot 180:sc= 0 USER MOD Single : A 539 ASN : amide:sc= -4.06! C(o=-4.1!,f=-5.4!) USER MOD Single : A 544 THR OG1 : rot -170:sc= -0.204 USER MOD Single : A 545 SER OG : rot 130:sc= -1.31 USER MOD Single : A 547 MET CE :methyl -173:sc= 0 (180deg=-0.0392) USER MOD Single : A 549 ASN : amide:sc= -2.06! K(o=-2.1!,f=-0.33) USER MOD Single : A 554 THR OG1 : rot 3:sc= 0.194 USER MOD Single : A 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 560 THR OG1 : rot 180:sc= 0 USER MOD Single : A 575 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 577 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 580 GLN : amide:sc= -2.49! K(o=-2.5!,f=-0.24) USER MOD Single : A 587 THR OG1 : rot 180:sc= 0.00894 USER MOD Single : A 589 SER OG : rot 180:sc= 0 USER MOD Single : A 593 HIS : no HD1:sc= -0.0158 X(o=-0.016,f=-0.092) USER MOD Single : A 595 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot -160:sc= -0.203 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 605 SER OG : rot -52:sc= 0.871 USER MOD Single : A 606 CYS SG : rot -48:sc= -0.163 USER MOD ----------------------------------------------------------------- ATOM 112 N ILE A 490 -13.594 1.910 -9.545 1.00 0.00 N ATOM 113 CA ILE A 490 -12.462 2.561 -8.893 1.00 0.00 C ATOM 114 C ILE A 490 -12.382 4.029 -9.297 1.00 0.00 C ATOM 115 O ILE A 490 -12.119 4.899 -8.467 1.00 0.00 O ATOM 116 CB ILE A 490 -11.161 1.855 -9.277 1.00 0.00 C ATOM 117 CG1 ILE A 490 -11.351 0.338 -9.183 1.00 0.00 C ATOM 118 CG2 ILE A 490 -10.043 2.289 -8.326 1.00 0.00 C ATOM 119 CD1 ILE A 490 -11.949 -0.026 -7.822 1.00 0.00 C ATOM 0 HA ILE A 490 -12.605 2.499 -7.814 1.00 0.00 H new ATOM 0 HB ILE A 490 -10.894 2.123 -10.299 1.00 0.00 H new ATOM 0 HG12 ILE A 490 -12.007 -0.006 -9.983 1.00 0.00 H new ATOM 0 HG13 ILE A 490 -10.394 -0.167 -9.317 1.00 0.00 H new ATOM 0 HG21 ILE A 490 -9.116 1.785 -8.600 1.00 0.00 H new ATOM 0 HG22 ILE A 490 -9.904 3.368 -8.396 1.00 0.00 H new ATOM 0 HG23 ILE A 490 -10.311 2.023 -7.304 1.00 0.00 H new ATOM 0 HD11 ILE A 490 -12.082 -1.106 -7.760 1.00 0.00 H new ATOM 0 HD12 ILE A 490 -11.277 0.303 -7.030 1.00 0.00 H new ATOM 0 HD13 ILE A 490 -12.915 0.466 -7.706 1.00 0.00 H new ATOM 131 N LEU A 491 -12.607 4.299 -10.579 1.00 0.00 N ATOM 132 CA LEU A 491 -12.553 5.665 -11.085 1.00 0.00 C ATOM 133 C LEU A 491 -13.620 6.526 -10.411 1.00 0.00 C ATOM 134 O LEU A 491 -13.305 7.435 -9.644 1.00 0.00 O ATOM 135 CB LEU A 491 -12.767 5.671 -12.602 1.00 0.00 C ATOM 136 CG LEU A 491 -11.447 5.358 -13.314 1.00 0.00 C ATOM 137 CD1 LEU A 491 -10.918 3.999 -12.852 1.00 0.00 C ATOM 138 CD2 LEU A 491 -11.681 5.322 -14.825 1.00 0.00 C ATOM 0 H LEU A 491 -12.827 3.594 -11.283 1.00 0.00 H new ATOM 0 HA LEU A 491 -11.571 6.080 -10.858 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -13.522 4.933 -12.875 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -13.141 6.643 -12.922 1.00 0.00 H new ATOM 0 HG LEU A 491 -10.717 6.131 -13.073 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -9.979 3.782 -13.362 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -10.750 4.021 -11.775 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -11.647 3.225 -13.090 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -10.743 5.099 -15.333 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -12.414 4.550 -15.061 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -12.054 6.291 -15.159 1.00 0.00 H new ATOM 150 N GLY A 492 -14.883 6.231 -10.704 1.00 0.00 N ATOM 151 CA GLY A 492 -15.988 6.985 -10.123 1.00 0.00 C ATOM 152 C GLY A 492 -15.742 7.263 -8.643 1.00 0.00 C ATOM 153 O GLY A 492 -15.471 8.398 -8.251 1.00 0.00 O ATOM 0 H GLY A 492 -15.165 5.481 -11.335 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -16.111 7.927 -10.658 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -16.916 6.427 -10.242 1.00 0.00 H new ATOM 157 N LEU A 493 -15.838 6.219 -7.826 1.00 0.00 N ATOM 158 CA LEU A 493 -15.623 6.359 -6.391 1.00 0.00 C ATOM 159 C LEU A 493 -14.387 7.216 -6.116 1.00 0.00 C ATOM 160 O LEU A 493 -14.390 8.059 -5.221 1.00 0.00 O ATOM 161 CB LEU A 493 -15.446 4.969 -5.755 1.00 0.00 C ATOM 162 CG LEU A 493 -16.630 4.649 -4.836 1.00 0.00 C ATOM 163 CD1 LEU A 493 -17.880 4.392 -5.680 1.00 0.00 C ATOM 164 CD2 LEU A 493 -16.307 3.400 -4.012 1.00 0.00 C ATOM 0 H LEU A 493 -16.062 5.272 -8.131 1.00 0.00 H new ATOM 0 HA LEU A 493 -16.492 6.850 -5.953 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -15.368 4.212 -6.535 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -14.517 4.938 -5.186 1.00 0.00 H new ATOM 0 HG LEU A 493 -16.811 5.492 -4.169 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -18.721 4.165 -5.025 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -18.109 5.279 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -17.701 3.549 -6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -17.147 3.169 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -16.127 2.559 -4.682 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -15.417 3.581 -3.410 1.00 0.00 H new ATOM 176 N GLY A 494 -13.332 6.988 -6.889 1.00 0.00 N ATOM 177 CA GLY A 494 -12.093 7.736 -6.718 1.00 0.00 C ATOM 178 C GLY A 494 -12.348 9.240 -6.664 1.00 0.00 C ATOM 179 O GLY A 494 -12.118 9.881 -5.639 1.00 0.00 O ATOM 0 H GLY A 494 -13.309 6.295 -7.637 1.00 0.00 H new ATOM 0 HA2 GLY A 494 -11.598 7.417 -5.801 1.00 0.00 H new ATOM 0 HA3 GLY A 494 -11.415 7.511 -7.541 1.00 0.00 H new ATOM 183 N ILE A 495 -12.812 9.799 -7.777 1.00 0.00 N ATOM 184 CA ILE A 495 -13.082 11.232 -7.849 1.00 0.00 C ATOM 185 C ILE A 495 -14.220 11.632 -6.913 1.00 0.00 C ATOM 186 O ILE A 495 -14.458 12.819 -6.691 1.00 0.00 O ATOM 187 CB ILE A 495 -13.444 11.621 -9.282 1.00 0.00 C ATOM 188 CG1 ILE A 495 -14.512 10.664 -9.815 1.00 0.00 C ATOM 189 CG2 ILE A 495 -12.198 11.536 -10.166 1.00 0.00 C ATOM 190 CD1 ILE A 495 -15.051 11.191 -11.146 1.00 0.00 C ATOM 0 H ILE A 495 -13.008 9.286 -8.637 1.00 0.00 H new ATOM 0 HA ILE A 495 -12.180 11.758 -7.537 1.00 0.00 H new ATOM 0 HB ILE A 495 -13.829 12.641 -9.295 1.00 0.00 H new ATOM 0 HG12 ILE A 495 -14.089 9.669 -9.950 1.00 0.00 H new ATOM 0 HG13 ILE A 495 -15.324 10.570 -9.094 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -12.457 11.814 -11.188 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -11.436 12.217 -9.787 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -11.812 10.517 -10.154 1.00 0.00 H new ATOM 0 HD11 ILE A 495 -15.812 10.509 -11.526 1.00 0.00 H new ATOM 0 HD12 ILE A 495 -15.490 12.177 -10.996 1.00 0.00 H new ATOM 0 HD13 ILE A 495 -14.236 11.262 -11.866 1.00 0.00 H new ATOM 202 N ALA A 496 -14.922 10.643 -6.372 1.00 0.00 N ATOM 203 CA ALA A 496 -16.034 10.924 -5.468 1.00 0.00 C ATOM 204 C ALA A 496 -15.528 11.492 -4.145 1.00 0.00 C ATOM 205 O ALA A 496 -16.038 12.503 -3.660 1.00 0.00 O ATOM 206 CB ALA A 496 -16.839 9.649 -5.209 1.00 0.00 C ATOM 0 H ALA A 496 -14.746 9.652 -6.539 1.00 0.00 H new ATOM 0 HA ALA A 496 -16.677 11.666 -5.941 1.00 0.00 H new ATOM 0 HB1 ALA A 496 -17.665 9.871 -4.534 1.00 0.00 H new ATOM 0 HB2 ALA A 496 -17.233 9.270 -6.152 1.00 0.00 H new ATOM 0 HB3 ALA A 496 -16.193 8.896 -4.757 1.00 0.00 H new ATOM 212 N PHE A 497 -14.526 10.840 -3.563 1.00 0.00 N ATOM 213 CA PHE A 497 -13.969 11.301 -2.295 1.00 0.00 C ATOM 214 C PHE A 497 -13.646 12.790 -2.373 1.00 0.00 C ATOM 215 O PHE A 497 -13.890 13.540 -1.428 1.00 0.00 O ATOM 216 CB PHE A 497 -12.698 10.516 -1.952 1.00 0.00 C ATOM 217 CG PHE A 497 -12.835 9.064 -2.367 1.00 0.00 C ATOM 218 CD1 PHE A 497 -14.096 8.448 -2.441 1.00 0.00 C ATOM 219 CD2 PHE A 497 -11.684 8.326 -2.670 1.00 0.00 C ATOM 220 CE1 PHE A 497 -14.196 7.102 -2.816 1.00 0.00 C ATOM 221 CE2 PHE A 497 -11.787 6.983 -3.045 1.00 0.00 C ATOM 222 CZ PHE A 497 -13.042 6.371 -3.119 1.00 0.00 C ATOM 0 H PHE A 497 -14.087 10.001 -3.943 1.00 0.00 H new ATOM 0 HA PHE A 497 -14.710 11.135 -1.513 1.00 0.00 H new ATOM 0 HB2 PHE A 497 -11.841 10.964 -2.456 1.00 0.00 H new ATOM 0 HB3 PHE A 497 -12.505 10.576 -0.881 1.00 0.00 H new ATOM 0 HD1 PHE A 497 -14.987 9.012 -2.209 1.00 0.00 H new ATOM 0 HD2 PHE A 497 -10.713 8.796 -2.614 1.00 0.00 H new ATOM 0 HE1 PHE A 497 -15.165 6.628 -2.871 1.00 0.00 H new ATOM 0 HE2 PHE A 497 -10.897 6.418 -3.278 1.00 0.00 H new ATOM 0 HZ PHE A 497 -13.121 5.334 -3.410 1.00 0.00 H new ATOM 232 N ALA A 498 -13.103 13.204 -3.512 1.00 0.00 N ATOM 233 CA ALA A 498 -12.747 14.603 -3.735 1.00 0.00 C ATOM 234 C ALA A 498 -13.901 15.533 -3.365 1.00 0.00 C ATOM 235 O ALA A 498 -13.767 16.754 -3.430 1.00 0.00 O ATOM 236 CB ALA A 498 -12.373 14.815 -5.202 1.00 0.00 C ATOM 0 H ALA A 498 -12.898 12.589 -4.299 1.00 0.00 H new ATOM 0 HA ALA A 498 -11.895 14.840 -3.097 1.00 0.00 H new ATOM 0 HB1 ALA A 498 -12.108 15.860 -5.363 1.00 0.00 H new ATOM 0 HB2 ALA A 498 -11.523 14.182 -5.456 1.00 0.00 H new ATOM 0 HB3 ALA A 498 -13.221 14.554 -5.835 1.00 0.00 H new ATOM 242 N GLY A 499 -15.041 14.951 -3.007 1.00 0.00 N ATOM 243 CA GLY A 499 -16.217 15.743 -2.666 1.00 0.00 C ATOM 244 C GLY A 499 -15.873 16.914 -1.749 1.00 0.00 C ATOM 245 O GLY A 499 -16.207 18.057 -2.063 1.00 0.00 O ATOM 0 H GLY A 499 -15.175 13.942 -2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -16.677 16.121 -3.579 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -16.954 15.105 -2.178 1.00 0.00 H new ATOM 249 N SER A 500 -15.212 16.650 -0.619 1.00 0.00 N ATOM 250 CA SER A 500 -14.858 17.740 0.294 1.00 0.00 C ATOM 251 C SER A 500 -13.424 17.622 0.814 1.00 0.00 C ATOM 252 O SER A 500 -12.578 18.458 0.499 1.00 0.00 O ATOM 253 CB SER A 500 -15.822 17.747 1.481 1.00 0.00 C ATOM 254 OG SER A 500 -15.688 16.530 2.201 1.00 0.00 O ATOM 0 H SER A 500 -14.918 15.720 -0.320 1.00 0.00 H new ATOM 0 HA SER A 500 -14.932 18.671 -0.268 1.00 0.00 H new ATOM 0 HB2 SER A 500 -15.608 18.594 2.133 1.00 0.00 H new ATOM 0 HB3 SER A 500 -16.847 17.865 1.131 1.00 0.00 H new ATOM 0 HG SER A 500 -16.303 16.532 2.964 1.00 0.00 H new ATOM 260 N LYS A 501 -13.157 16.593 1.619 1.00 0.00 N ATOM 261 CA LYS A 501 -11.817 16.401 2.180 1.00 0.00 C ATOM 262 C LYS A 501 -11.227 15.053 1.768 1.00 0.00 C ATOM 263 O LYS A 501 -10.010 14.904 1.661 1.00 0.00 O ATOM 264 CB LYS A 501 -11.883 16.491 3.711 1.00 0.00 C ATOM 265 CG LYS A 501 -10.641 17.213 4.249 1.00 0.00 C ATOM 266 CD LYS A 501 -9.378 16.451 3.835 1.00 0.00 C ATOM 267 CE LYS A 501 -8.222 16.835 4.761 1.00 0.00 C ATOM 268 NZ LYS A 501 -8.154 18.319 4.879 1.00 0.00 N ATOM 0 H LYS A 501 -13.840 15.888 1.895 1.00 0.00 H new ATOM 0 HA LYS A 501 -11.169 17.186 1.789 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -12.784 17.025 4.013 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -11.946 15.491 4.140 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -10.605 18.232 3.863 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -10.693 17.286 5.335 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -9.556 15.377 3.885 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -9.122 16.684 2.801 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -8.365 16.387 5.744 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -7.282 16.447 4.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -7.203 18.599 5.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -8.355 18.750 3.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -8.857 18.645 5.573 1.00 0.00 H new ATOM 282 N ASN A 502 -12.094 14.073 1.544 1.00 0.00 N ATOM 283 CA ASN A 502 -11.640 12.742 1.153 1.00 0.00 C ATOM 284 C ASN A 502 -11.004 12.020 2.343 1.00 0.00 C ATOM 285 O ASN A 502 -10.487 10.912 2.202 1.00 0.00 O ATOM 286 CB ASN A 502 -10.617 12.844 0.012 1.00 0.00 C ATOM 287 CG ASN A 502 -10.904 14.069 -0.852 1.00 0.00 C ATOM 288 OD1 ASN A 502 -11.978 14.660 -0.758 1.00 0.00 O ATOM 289 ND2 ASN A 502 -9.997 14.487 -1.693 1.00 0.00 N ATOM 0 H ASN A 502 -13.106 14.172 1.625 1.00 0.00 H new ATOM 0 HA ASN A 502 -12.505 12.173 0.813 1.00 0.00 H new ATOM 0 HB2 ASN A 502 -9.610 12.909 0.423 1.00 0.00 H new ATOM 0 HB3 ASN A 502 -10.654 11.943 -0.600 1.00 0.00 H new ATOM 0 HD21 ASN A 502 -10.179 15.306 -2.274 1.00 0.00 H new ATOM 0 HD22 ASN A 502 -9.107 13.995 -1.769 1.00 0.00 H new ATOM 296 N ASP A 503 -11.036 12.661 3.510 1.00 0.00 N ATOM 297 CA ASP A 503 -10.449 12.071 4.712 1.00 0.00 C ATOM 298 C ASP A 503 -11.371 11.009 5.310 1.00 0.00 C ATOM 299 O ASP A 503 -10.903 10.028 5.889 1.00 0.00 O ATOM 300 CB ASP A 503 -10.178 13.170 5.752 1.00 0.00 C ATOM 301 CG ASP A 503 -8.687 13.498 5.802 1.00 0.00 C ATOM 302 OD1 ASP A 503 -8.116 13.730 4.750 1.00 0.00 O ATOM 303 OD2 ASP A 503 -8.141 13.510 6.892 1.00 0.00 O ATOM 0 H ASP A 503 -11.457 13.579 3.649 1.00 0.00 H new ATOM 0 HA ASP A 503 -9.511 11.591 4.434 1.00 0.00 H new ATOM 0 HB2 ASP A 503 -10.746 14.066 5.501 1.00 0.00 H new ATOM 0 HB3 ASP A 503 -10.518 12.842 6.734 1.00 0.00 H new ATOM 308 N GLU A 504 -12.676 11.207 5.169 1.00 0.00 N ATOM 309 CA GLU A 504 -13.641 10.253 5.703 1.00 0.00 C ATOM 310 C GLU A 504 -13.514 8.931 4.963 1.00 0.00 C ATOM 311 O GLU A 504 -13.452 7.860 5.571 1.00 0.00 O ATOM 312 CB GLU A 504 -15.061 10.798 5.546 1.00 0.00 C ATOM 313 CG GLU A 504 -16.033 9.932 6.350 1.00 0.00 C ATOM 314 CD GLU A 504 -17.470 10.333 6.037 1.00 0.00 C ATOM 315 OE1 GLU A 504 -17.668 11.447 5.583 1.00 0.00 O ATOM 316 OE2 GLU A 504 -18.353 9.520 6.259 1.00 0.00 O ATOM 0 H GLU A 504 -13.088 12.011 4.695 1.00 0.00 H new ATOM 0 HA GLU A 504 -13.438 10.097 6.762 1.00 0.00 H new ATOM 0 HB2 GLU A 504 -15.106 11.831 5.892 1.00 0.00 H new ATOM 0 HB3 GLU A 504 -15.346 10.802 4.494 1.00 0.00 H new ATOM 0 HG2 GLU A 504 -15.880 8.880 6.110 1.00 0.00 H new ATOM 0 HG3 GLU A 504 -15.839 10.047 7.416 1.00 0.00 H new ATOM 323 N VAL A 505 -13.463 9.021 3.643 1.00 0.00 N ATOM 324 CA VAL A 505 -13.329 7.840 2.809 1.00 0.00 C ATOM 325 C VAL A 505 -12.087 7.054 3.218 1.00 0.00 C ATOM 326 O VAL A 505 -12.144 5.842 3.417 1.00 0.00 O ATOM 327 CB VAL A 505 -13.229 8.272 1.340 1.00 0.00 C ATOM 328 CG1 VAL A 505 -12.462 7.219 0.536 1.00 0.00 C ATOM 329 CG2 VAL A 505 -14.639 8.444 0.757 1.00 0.00 C ATOM 0 H VAL A 505 -13.512 9.900 3.128 1.00 0.00 H new ATOM 0 HA VAL A 505 -14.201 7.198 2.936 1.00 0.00 H new ATOM 0 HB VAL A 505 -12.695 9.221 1.282 1.00 0.00 H new ATOM 0 HG11 VAL A 505 -12.396 7.534 -0.506 1.00 0.00 H new ATOM 0 HG12 VAL A 505 -11.458 7.108 0.946 1.00 0.00 H new ATOM 0 HG13 VAL A 505 -12.985 6.265 0.594 1.00 0.00 H new ATOM 0 HG21 VAL A 505 -14.566 8.751 -0.286 1.00 0.00 H new ATOM 0 HG22 VAL A 505 -15.177 7.498 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 505 -15.176 9.205 1.323 1.00 0.00 H new ATOM 339 N LEU A 506 -10.968 7.758 3.349 1.00 0.00 N ATOM 340 CA LEU A 506 -9.718 7.120 3.742 1.00 0.00 C ATOM 341 C LEU A 506 -9.903 6.356 5.050 1.00 0.00 C ATOM 342 O LEU A 506 -9.195 5.387 5.320 1.00 0.00 O ATOM 343 CB LEU A 506 -8.626 8.181 3.916 1.00 0.00 C ATOM 344 CG LEU A 506 -7.252 7.506 4.056 1.00 0.00 C ATOM 345 CD1 LEU A 506 -6.647 7.262 2.670 1.00 0.00 C ATOM 346 CD2 LEU A 506 -6.319 8.413 4.864 1.00 0.00 C ATOM 0 H LEU A 506 -10.901 8.763 3.190 1.00 0.00 H new ATOM 0 HA LEU A 506 -9.421 6.419 2.962 1.00 0.00 H new ATOM 0 HB2 LEU A 506 -8.623 8.855 3.059 1.00 0.00 H new ATOM 0 HB3 LEU A 506 -8.834 8.787 4.798 1.00 0.00 H new ATOM 0 HG LEU A 506 -7.373 6.552 4.569 1.00 0.00 H new ATOM 0 HD11 LEU A 506 -5.674 6.783 2.777 1.00 0.00 H new ATOM 0 HD12 LEU A 506 -7.308 6.615 2.093 1.00 0.00 H new ATOM 0 HD13 LEU A 506 -6.528 8.214 2.152 1.00 0.00 H new ATOM 0 HD21 LEU A 506 -5.344 7.936 4.964 1.00 0.00 H new ATOM 0 HD22 LEU A 506 -6.205 9.367 4.350 1.00 0.00 H new ATOM 0 HD23 LEU A 506 -6.743 8.582 5.854 1.00 0.00 H new ATOM 358 N GLY A 507 -10.859 6.802 5.858 1.00 0.00 N ATOM 359 CA GLY A 507 -11.127 6.159 7.138 1.00 0.00 C ATOM 360 C GLY A 507 -11.717 4.763 6.952 1.00 0.00 C ATOM 361 O GLY A 507 -11.323 3.820 7.636 1.00 0.00 O ATOM 0 H GLY A 507 -11.458 7.601 5.651 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -10.203 6.091 7.712 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -11.817 6.773 7.717 1.00 0.00 H new ATOM 365 N LEU A 508 -12.672 4.640 6.032 1.00 0.00 N ATOM 366 CA LEU A 508 -13.316 3.351 5.780 1.00 0.00 C ATOM 367 C LEU A 508 -12.534 2.530 4.752 1.00 0.00 C ATOM 368 O LEU A 508 -12.254 1.348 4.966 1.00 0.00 O ATOM 369 CB LEU A 508 -14.743 3.577 5.271 1.00 0.00 C ATOM 370 CG LEU A 508 -15.652 3.961 6.442 1.00 0.00 C ATOM 371 CD1 LEU A 508 -15.072 5.178 7.165 1.00 0.00 C ATOM 372 CD2 LEU A 508 -17.047 4.300 5.910 1.00 0.00 C ATOM 0 H LEU A 508 -13.015 5.408 5.454 1.00 0.00 H new ATOM 0 HA LEU A 508 -13.338 2.796 6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 508 -14.751 4.365 4.518 1.00 0.00 H new ATOM 0 HB3 LEU A 508 -15.116 2.673 4.790 1.00 0.00 H new ATOM 0 HG LEU A 508 -15.719 3.126 7.139 1.00 0.00 H new ATOM 0 HD11 LEU A 508 -15.720 5.450 7.998 1.00 0.00 H new ATOM 0 HD12 LEU A 508 -14.078 4.937 7.542 1.00 0.00 H new ATOM 0 HD13 LEU A 508 -15.004 6.015 6.471 1.00 0.00 H new ATOM 0 HD21 LEU A 508 -17.697 4.574 6.741 1.00 0.00 H new ATOM 0 HD22 LEU A 508 -16.978 5.135 5.213 1.00 0.00 H new ATOM 0 HD23 LEU A 508 -17.461 3.432 5.396 1.00 0.00 H new ATOM 384 N LEU A 509 -12.200 3.156 3.631 1.00 0.00 N ATOM 385 CA LEU A 509 -11.468 2.472 2.571 1.00 0.00 C ATOM 386 C LEU A 509 -10.191 1.826 3.108 1.00 0.00 C ATOM 387 O LEU A 509 -9.707 0.840 2.550 1.00 0.00 O ATOM 388 CB LEU A 509 -11.120 3.470 1.454 1.00 0.00 C ATOM 389 CG LEU A 509 -11.537 2.907 0.088 1.00 0.00 C ATOM 390 CD1 LEU A 509 -13.048 3.071 -0.103 1.00 0.00 C ATOM 391 CD2 LEU A 509 -10.805 3.666 -1.022 1.00 0.00 C ATOM 0 H LEU A 509 -12.423 4.131 3.432 1.00 0.00 H new ATOM 0 HA LEU A 509 -12.104 1.682 2.171 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -11.626 4.419 1.634 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -10.049 3.674 1.460 1.00 0.00 H new ATOM 0 HG LEU A 509 -11.279 1.849 0.044 1.00 0.00 H new ATOM 0 HD11 LEU A 509 -13.338 2.670 -1.074 1.00 0.00 H new ATOM 0 HD12 LEU A 509 -13.575 2.532 0.684 1.00 0.00 H new ATOM 0 HD13 LEU A 509 -13.308 4.128 -0.055 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -11.101 3.267 -1.992 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -11.063 4.724 -0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -9.729 3.549 -0.894 1.00 0.00 H new ATOM 403 N LEU A 510 -9.642 2.383 4.183 1.00 0.00 N ATOM 404 CA LEU A 510 -8.418 1.837 4.760 1.00 0.00 C ATOM 405 C LEU A 510 -8.656 0.426 5.303 1.00 0.00 C ATOM 406 O LEU A 510 -8.112 -0.543 4.775 1.00 0.00 O ATOM 407 CB LEU A 510 -7.887 2.761 5.870 1.00 0.00 C ATOM 408 CG LEU A 510 -6.811 3.697 5.304 1.00 0.00 C ATOM 409 CD1 LEU A 510 -6.386 4.692 6.386 1.00 0.00 C ATOM 410 CD2 LEU A 510 -5.591 2.882 4.846 1.00 0.00 C ATOM 0 H LEU A 510 -10.018 3.199 4.666 1.00 0.00 H new ATOM 0 HA LEU A 510 -7.667 1.776 3.972 1.00 0.00 H new ATOM 0 HB2 LEU A 510 -8.705 3.346 6.290 1.00 0.00 H new ATOM 0 HB3 LEU A 510 -7.471 2.165 6.683 1.00 0.00 H new ATOM 0 HG LEU A 510 -7.218 4.236 4.448 1.00 0.00 H new ATOM 0 HD11 LEU A 510 -5.621 5.359 5.987 1.00 0.00 H new ATOM 0 HD12 LEU A 510 -7.250 5.278 6.701 1.00 0.00 H new ATOM 0 HD13 LEU A 510 -5.984 4.149 7.242 1.00 0.00 H new ATOM 0 HD21 LEU A 510 -4.833 3.555 4.446 1.00 0.00 H new ATOM 0 HD22 LEU A 510 -5.179 2.335 5.694 1.00 0.00 H new ATOM 0 HD23 LEU A 510 -5.894 2.177 4.072 1.00 0.00 H new ATOM 422 N PRO A 511 -9.450 0.286 6.336 1.00 0.00 N ATOM 423 CA PRO A 511 -9.746 -1.044 6.933 1.00 0.00 C ATOM 424 C PRO A 511 -10.082 -2.074 5.858 1.00 0.00 C ATOM 425 O PRO A 511 -9.798 -3.262 6.010 1.00 0.00 O ATOM 426 CB PRO A 511 -10.948 -0.801 7.864 1.00 0.00 C ATOM 427 CG PRO A 511 -11.299 0.657 7.758 1.00 0.00 C ATOM 428 CD PRO A 511 -10.146 1.364 7.041 1.00 0.00 C ATOM 0 HA PRO A 511 -8.887 -1.448 7.469 1.00 0.00 H new ATOM 0 HB2 PRO A 511 -11.794 -1.423 7.572 1.00 0.00 H new ATOM 0 HB3 PRO A 511 -10.699 -1.064 8.892 1.00 0.00 H new ATOM 0 HG2 PRO A 511 -12.230 0.787 7.205 1.00 0.00 H new ATOM 0 HG3 PRO A 511 -11.454 1.086 8.748 1.00 0.00 H new ATOM 0 HD2 PRO A 511 -10.512 2.122 6.349 1.00 0.00 H new ATOM 0 HD3 PRO A 511 -9.487 1.869 7.747 1.00 0.00 H new ATOM 436 N ILE A 512 -10.686 -1.606 4.767 1.00 0.00 N ATOM 437 CA ILE A 512 -11.053 -2.493 3.669 1.00 0.00 C ATOM 438 C ILE A 512 -9.877 -2.674 2.711 1.00 0.00 C ATOM 439 O ILE A 512 -9.736 -3.718 2.077 1.00 0.00 O ATOM 440 CB ILE A 512 -12.248 -1.918 2.907 1.00 0.00 C ATOM 441 CG1 ILE A 512 -13.388 -1.632 3.889 1.00 0.00 C ATOM 442 CG2 ILE A 512 -12.719 -2.927 1.859 1.00 0.00 C ATOM 443 CD1 ILE A 512 -14.530 -0.927 3.154 1.00 0.00 C ATOM 0 H ILE A 512 -10.929 -0.626 4.622 1.00 0.00 H new ATOM 0 HA ILE A 512 -11.322 -3.463 4.086 1.00 0.00 H new ATOM 0 HB ILE A 512 -11.953 -0.993 2.412 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -13.745 -2.563 4.330 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -13.029 -1.009 4.708 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -13.571 -2.517 1.316 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -11.908 -3.132 1.160 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -13.015 -3.853 2.352 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -15.341 -0.723 3.853 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -14.168 0.012 2.735 1.00 0.00 H new ATOM 0 HD13 ILE A 512 -14.895 -1.567 2.350 1.00 0.00 H new ATOM 455 N ALA A 513 -9.040 -1.647 2.613 1.00 0.00 N ATOM 456 CA ALA A 513 -7.879 -1.698 1.728 1.00 0.00 C ATOM 457 C ALA A 513 -6.706 -2.392 2.415 1.00 0.00 C ATOM 458 O ALA A 513 -5.701 -2.708 1.779 1.00 0.00 O ATOM 459 CB ALA A 513 -7.468 -0.282 1.323 1.00 0.00 C ATOM 0 H ALA A 513 -9.141 -0.774 3.131 1.00 0.00 H new ATOM 0 HA ALA A 513 -8.152 -2.267 0.839 1.00 0.00 H new ATOM 0 HB1 ALA A 513 -6.602 -0.329 0.663 1.00 0.00 H new ATOM 0 HB2 ALA A 513 -8.294 0.202 0.803 1.00 0.00 H new ATOM 0 HB3 ALA A 513 -7.214 0.292 2.214 1.00 0.00 H new ATOM 465 N ALA A 514 -6.838 -2.621 3.717 1.00 0.00 N ATOM 466 CA ALA A 514 -5.778 -3.274 4.479 1.00 0.00 C ATOM 467 C ALA A 514 -5.850 -4.789 4.317 1.00 0.00 C ATOM 468 O ALA A 514 -5.202 -5.532 5.054 1.00 0.00 O ATOM 469 CB ALA A 514 -5.903 -2.912 5.960 1.00 0.00 C ATOM 0 H ALA A 514 -7.661 -2.367 4.264 1.00 0.00 H new ATOM 0 HA ALA A 514 -4.818 -2.927 4.097 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -5.109 -3.403 6.523 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -5.818 -1.832 6.079 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -6.871 -3.243 6.335 1.00 0.00 H new ATOM 475 N SER A 515 -6.640 -5.241 3.347 1.00 0.00 N ATOM 476 CA SER A 515 -6.786 -6.672 3.098 1.00 0.00 C ATOM 477 C SER A 515 -6.882 -7.438 4.415 1.00 0.00 C ATOM 478 O SER A 515 -5.935 -8.110 4.823 1.00 0.00 O ATOM 479 CB SER A 515 -5.592 -7.184 2.293 1.00 0.00 C ATOM 480 OG SER A 515 -5.596 -6.575 1.008 1.00 0.00 O ATOM 0 H SER A 515 -7.185 -4.643 2.725 1.00 0.00 H new ATOM 0 HA SER A 515 -7.703 -6.833 2.531 1.00 0.00 H new ATOM 0 HB2 SER A 515 -4.662 -6.955 2.814 1.00 0.00 H new ATOM 0 HB3 SER A 515 -5.643 -8.268 2.194 1.00 0.00 H new ATOM 0 HG SER A 515 -4.675 -6.491 0.683 1.00 0.00 H new ATOM 486 N THR A 516 -8.030 -7.327 5.076 1.00 0.00 N ATOM 487 CA THR A 516 -8.238 -8.010 6.349 1.00 0.00 C ATOM 488 C THR A 516 -8.748 -9.430 6.122 1.00 0.00 C ATOM 489 O THR A 516 -8.428 -10.342 6.885 1.00 0.00 O ATOM 490 CB THR A 516 -9.246 -7.232 7.198 1.00 0.00 C ATOM 491 OG1 THR A 516 -10.386 -6.919 6.410 1.00 0.00 O ATOM 492 CG2 THR A 516 -8.600 -5.941 7.704 1.00 0.00 C ATOM 0 H THR A 516 -8.825 -6.775 4.755 1.00 0.00 H new ATOM 0 HA THR A 516 -7.283 -8.061 6.872 1.00 0.00 H new ATOM 0 HB THR A 516 -9.551 -7.840 8.050 1.00 0.00 H new ATOM 0 HG1 THR A 516 -11.033 -6.422 6.953 1.00 0.00 H new ATOM 0 HG21 THR A 516 -9.318 -5.387 8.309 1.00 0.00 H new ATOM 0 HG22 THR A 516 -7.727 -6.184 8.310 1.00 0.00 H new ATOM 0 HG23 THR A 516 -8.294 -5.330 6.855 1.00 0.00 H new ATOM 500 N ASP A 517 -9.544 -9.612 5.073 1.00 0.00 N ATOM 501 CA ASP A 517 -10.090 -10.929 4.762 1.00 0.00 C ATOM 502 C ASP A 517 -10.507 -11.011 3.296 1.00 0.00 C ATOM 503 O ASP A 517 -11.283 -11.887 2.912 1.00 0.00 O ATOM 504 CB ASP A 517 -11.298 -11.216 5.655 1.00 0.00 C ATOM 505 CG ASP A 517 -11.799 -12.636 5.414 1.00 0.00 C ATOM 506 OD1 ASP A 517 -11.005 -13.553 5.544 1.00 0.00 O ATOM 507 OD2 ASP A 517 -12.969 -12.785 5.102 1.00 0.00 O ATOM 0 H ASP A 517 -9.824 -8.872 4.429 1.00 0.00 H new ATOM 0 HA ASP A 517 -9.315 -11.673 4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 517 -11.024 -11.091 6.703 1.00 0.00 H new ATOM 0 HB3 ASP A 517 -12.093 -10.501 5.446 1.00 0.00 H new ATOM 512 N LEU A 518 -9.986 -10.096 2.481 1.00 0.00 N ATOM 513 CA LEU A 518 -10.310 -10.076 1.055 1.00 0.00 C ATOM 514 C LEU A 518 -9.027 -10.029 0.223 1.00 0.00 C ATOM 515 O LEU A 518 -7.994 -9.553 0.694 1.00 0.00 O ATOM 516 CB LEU A 518 -11.185 -8.855 0.731 1.00 0.00 C ATOM 517 CG LEU A 518 -10.846 -7.697 1.683 1.00 0.00 C ATOM 518 CD1 LEU A 518 -11.070 -6.361 0.968 1.00 0.00 C ATOM 519 CD2 LEU A 518 -11.747 -7.765 2.921 1.00 0.00 C ATOM 0 H LEU A 518 -9.342 -9.363 2.780 1.00 0.00 H new ATOM 0 HA LEU A 518 -10.859 -10.985 0.808 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -11.024 -8.546 -0.302 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -12.239 -9.117 0.825 1.00 0.00 H new ATOM 0 HG LEU A 518 -9.803 -7.778 1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -10.829 -5.541 1.645 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -10.428 -6.307 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -12.113 -6.283 0.661 1.00 0.00 H new ATOM 0 HD21 LEU A 518 -11.504 -6.943 3.594 1.00 0.00 H new ATOM 0 HD22 LEU A 518 -12.791 -7.688 2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 518 -11.588 -8.713 3.435 1.00 0.00 H new ATOM 531 N PRO A 519 -9.073 -10.512 -0.993 1.00 0.00 N ATOM 532 CA PRO A 519 -7.889 -10.524 -1.896 1.00 0.00 C ATOM 533 C PRO A 519 -7.140 -9.193 -1.871 1.00 0.00 C ATOM 534 O PRO A 519 -7.739 -8.136 -1.669 1.00 0.00 O ATOM 535 CB PRO A 519 -8.471 -10.806 -3.295 1.00 0.00 C ATOM 536 CG PRO A 519 -9.960 -10.934 -3.134 1.00 0.00 C ATOM 537 CD PRO A 519 -10.249 -11.097 -1.641 1.00 0.00 C ATOM 0 HA PRO A 519 -7.157 -11.271 -1.590 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -8.226 -9.998 -3.985 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -8.048 -11.720 -3.711 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -10.465 -10.052 -3.528 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -10.334 -11.792 -3.693 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -11.164 -10.580 -1.352 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -10.376 -12.145 -1.370 1.00 0.00 H new ATOM 545 N ILE A 520 -5.829 -9.253 -2.078 1.00 0.00 N ATOM 546 CA ILE A 520 -5.009 -8.049 -2.078 1.00 0.00 C ATOM 547 C ILE A 520 -5.243 -7.242 -3.351 1.00 0.00 C ATOM 548 O ILE A 520 -4.927 -6.054 -3.411 1.00 0.00 O ATOM 549 CB ILE A 520 -3.530 -8.422 -1.971 1.00 0.00 C ATOM 550 CG1 ILE A 520 -3.182 -9.442 -3.058 1.00 0.00 C ATOM 551 CG2 ILE A 520 -3.254 -9.030 -0.595 1.00 0.00 C ATOM 552 CD1 ILE A 520 -1.672 -9.686 -3.066 1.00 0.00 C ATOM 0 H ILE A 520 -5.315 -10.117 -2.247 1.00 0.00 H new ATOM 0 HA ILE A 520 -5.291 -7.441 -1.219 1.00 0.00 H new ATOM 0 HB ILE A 520 -2.920 -7.528 -2.101 1.00 0.00 H new ATOM 0 HG12 ILE A 520 -3.711 -10.377 -2.876 1.00 0.00 H new ATOM 0 HG13 ILE A 520 -3.507 -9.076 -4.032 1.00 0.00 H new ATOM 0 HG21 ILE A 520 -2.200 -9.296 -0.519 1.00 0.00 H new ATOM 0 HG22 ILE A 520 -3.502 -8.304 0.180 1.00 0.00 H new ATOM 0 HG23 ILE A 520 -3.864 -9.924 -0.463 1.00 0.00 H new ATOM 0 HD11 ILE A 520 -1.425 -10.412 -3.840 1.00 0.00 H new ATOM 0 HD12 ILE A 520 -1.153 -8.749 -3.269 1.00 0.00 H new ATOM 0 HD13 ILE A 520 -1.360 -10.071 -2.095 1.00 0.00 H new ATOM 564 N GLU A 521 -5.797 -7.896 -4.367 1.00 0.00 N ATOM 565 CA GLU A 521 -6.069 -7.228 -5.635 1.00 0.00 C ATOM 566 C GLU A 521 -7.023 -6.056 -5.428 1.00 0.00 C ATOM 567 O GLU A 521 -6.664 -4.903 -5.667 1.00 0.00 O ATOM 568 CB GLU A 521 -6.682 -8.218 -6.627 1.00 0.00 C ATOM 569 CG GLU A 521 -6.670 -7.608 -8.031 1.00 0.00 C ATOM 570 CD GLU A 521 -5.243 -7.567 -8.567 1.00 0.00 C ATOM 571 OE1 GLU A 521 -4.569 -8.580 -8.480 1.00 0.00 O ATOM 572 OE2 GLU A 521 -4.845 -6.524 -9.058 1.00 0.00 O ATOM 0 H GLU A 521 -6.065 -8.880 -4.338 1.00 0.00 H new ATOM 0 HA GLU A 521 -5.128 -6.851 -6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 521 -6.120 -9.152 -6.620 1.00 0.00 H new ATOM 0 HB3 GLU A 521 -7.703 -8.459 -6.332 1.00 0.00 H new ATOM 0 HG2 GLU A 521 -7.301 -8.196 -8.698 1.00 0.00 H new ATOM 0 HG3 GLU A 521 -7.086 -6.601 -8.003 1.00 0.00 H new ATOM 579 N THR A 522 -8.237 -6.358 -4.981 1.00 0.00 N ATOM 580 CA THR A 522 -9.232 -5.318 -4.745 1.00 0.00 C ATOM 581 C THR A 522 -8.644 -4.210 -3.878 1.00 0.00 C ATOM 582 O THR A 522 -8.841 -3.025 -4.148 1.00 0.00 O ATOM 583 CB THR A 522 -10.460 -5.915 -4.053 1.00 0.00 C ATOM 584 OG1 THR A 522 -10.039 -6.769 -2.999 1.00 0.00 O ATOM 585 CG2 THR A 522 -11.279 -6.717 -5.067 1.00 0.00 C ATOM 0 H THR A 522 -8.554 -7.306 -4.776 1.00 0.00 H new ATOM 0 HA THR A 522 -9.529 -4.897 -5.706 1.00 0.00 H new ATOM 0 HB THR A 522 -11.075 -5.112 -3.646 1.00 0.00 H new ATOM 0 HG1 THR A 522 -10.824 -7.151 -2.554 1.00 0.00 H new ATOM 0 HG21 THR A 522 -12.153 -7.142 -4.574 1.00 0.00 H new ATOM 0 HG22 THR A 522 -11.601 -6.060 -5.875 1.00 0.00 H new ATOM 0 HG23 THR A 522 -10.666 -7.521 -5.475 1.00 0.00 H new ATOM 593 N ALA A 523 -7.921 -4.606 -2.837 1.00 0.00 N ATOM 594 CA ALA A 523 -7.306 -3.639 -1.935 1.00 0.00 C ATOM 595 C ALA A 523 -6.303 -2.771 -2.688 1.00 0.00 C ATOM 596 O ALA A 523 -6.358 -1.543 -2.623 1.00 0.00 O ATOM 597 CB ALA A 523 -6.598 -4.372 -0.793 1.00 0.00 C ATOM 0 H ALA A 523 -7.747 -5.582 -2.597 1.00 0.00 H new ATOM 0 HA ALA A 523 -8.087 -2.998 -1.526 1.00 0.00 H new ATOM 0 HB1 ALA A 523 -6.140 -3.645 -0.122 1.00 0.00 H new ATOM 0 HB2 ALA A 523 -7.322 -4.970 -0.240 1.00 0.00 H new ATOM 0 HB3 ALA A 523 -5.826 -5.024 -1.202 1.00 0.00 H new ATOM 603 N ALA A 524 -5.386 -3.417 -3.402 1.00 0.00 N ATOM 604 CA ALA A 524 -4.375 -2.693 -4.164 1.00 0.00 C ATOM 605 C ALA A 524 -5.013 -1.553 -4.953 1.00 0.00 C ATOM 606 O ALA A 524 -4.589 -0.402 -4.849 1.00 0.00 O ATOM 607 CB ALA A 524 -3.665 -3.646 -5.126 1.00 0.00 C ATOM 0 H ALA A 524 -5.322 -4.433 -3.469 1.00 0.00 H new ATOM 0 HA ALA A 524 -3.650 -2.275 -3.465 1.00 0.00 H new ATOM 0 HB1 ALA A 524 -2.912 -3.098 -5.691 1.00 0.00 H new ATOM 0 HB2 ALA A 524 -3.184 -4.444 -4.559 1.00 0.00 H new ATOM 0 HB3 ALA A 524 -4.392 -4.077 -5.814 1.00 0.00 H new ATOM 613 N MET A 525 -6.032 -1.883 -5.739 1.00 0.00 N ATOM 614 CA MET A 525 -6.721 -0.878 -6.540 1.00 0.00 C ATOM 615 C MET A 525 -7.154 0.295 -5.667 1.00 0.00 C ATOM 616 O MET A 525 -7.077 1.451 -6.082 1.00 0.00 O ATOM 617 CB MET A 525 -7.946 -1.497 -7.214 1.00 0.00 C ATOM 618 CG MET A 525 -7.493 -2.435 -8.335 1.00 0.00 C ATOM 619 SD MET A 525 -8.941 -3.066 -9.217 1.00 0.00 S ATOM 620 CE MET A 525 -8.047 -4.013 -10.473 1.00 0.00 C ATOM 0 H MET A 525 -6.397 -2.830 -5.838 1.00 0.00 H new ATOM 0 HA MET A 525 -6.034 -0.514 -7.304 1.00 0.00 H new ATOM 0 HB2 MET A 525 -8.538 -2.047 -6.482 1.00 0.00 H new ATOM 0 HB3 MET A 525 -8.587 -0.713 -7.618 1.00 0.00 H new ATOM 0 HG2 MET A 525 -6.837 -1.904 -9.025 1.00 0.00 H new ATOM 0 HG3 MET A 525 -6.917 -3.263 -7.921 1.00 0.00 H new ATOM 0 HE1 MET A 525 -8.760 -4.497 -11.140 1.00 0.00 H new ATOM 0 HE2 MET A 525 -7.409 -3.342 -11.049 1.00 0.00 H new ATOM 0 HE3 MET A 525 -7.432 -4.771 -9.988 1.00 0.00 H new ATOM 630 N ALA A 526 -7.608 -0.012 -4.457 1.00 0.00 N ATOM 631 CA ALA A 526 -8.050 1.027 -3.534 1.00 0.00 C ATOM 632 C ALA A 526 -6.864 1.867 -3.070 1.00 0.00 C ATOM 633 O ALA A 526 -6.881 3.093 -3.177 1.00 0.00 O ATOM 634 CB ALA A 526 -8.735 0.391 -2.322 1.00 0.00 C ATOM 0 H ALA A 526 -7.679 -0.963 -4.095 1.00 0.00 H new ATOM 0 HA ALA A 526 -8.758 1.673 -4.052 1.00 0.00 H new ATOM 0 HB1 ALA A 526 -9.062 1.173 -1.637 1.00 0.00 H new ATOM 0 HB2 ALA A 526 -9.598 -0.186 -2.653 1.00 0.00 H new ATOM 0 HB3 ALA A 526 -8.033 -0.268 -1.811 1.00 0.00 H new ATOM 640 N SER A 527 -5.836 1.198 -2.559 1.00 0.00 N ATOM 641 CA SER A 527 -4.645 1.893 -2.083 1.00 0.00 C ATOM 642 C SER A 527 -4.090 2.810 -3.169 1.00 0.00 C ATOM 643 O SER A 527 -3.621 3.913 -2.883 1.00 0.00 O ATOM 644 CB SER A 527 -3.577 0.878 -1.676 1.00 0.00 C ATOM 645 OG SER A 527 -4.124 -0.024 -0.723 1.00 0.00 O ATOM 0 H SER A 527 -5.803 0.183 -2.464 1.00 0.00 H new ATOM 0 HA SER A 527 -4.921 2.497 -1.219 1.00 0.00 H new ATOM 0 HB2 SER A 527 -3.226 0.331 -2.551 1.00 0.00 H new ATOM 0 HB3 SER A 527 -2.713 1.391 -1.254 1.00 0.00 H new ATOM 0 HG SER A 527 -3.442 -0.677 -0.462 1.00 0.00 H new ATOM 651 N LEU A 528 -4.144 2.347 -4.413 1.00 0.00 N ATOM 652 CA LEU A 528 -3.643 3.135 -5.533 1.00 0.00 C ATOM 653 C LEU A 528 -4.551 4.331 -5.796 1.00 0.00 C ATOM 654 O LEU A 528 -4.080 5.454 -5.973 1.00 0.00 O ATOM 655 CB LEU A 528 -3.562 2.263 -6.790 1.00 0.00 C ATOM 656 CG LEU A 528 -2.419 1.247 -6.644 1.00 0.00 C ATOM 657 CD1 LEU A 528 -2.738 -0.009 -7.459 1.00 0.00 C ATOM 658 CD2 LEU A 528 -1.112 1.862 -7.156 1.00 0.00 C ATOM 0 H LEU A 528 -4.527 1.437 -4.670 1.00 0.00 H new ATOM 0 HA LEU A 528 -2.648 3.500 -5.280 1.00 0.00 H new ATOM 0 HB2 LEU A 528 -4.507 1.742 -6.944 1.00 0.00 H new ATOM 0 HB3 LEU A 528 -3.396 2.888 -7.667 1.00 0.00 H new ATOM 0 HG LEU A 528 -2.310 0.982 -5.592 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -1.925 -0.728 -7.353 1.00 0.00 H new ATOM 0 HD12 LEU A 528 -3.665 -0.453 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -2.852 0.258 -8.510 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -0.304 1.138 -7.051 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -1.224 2.131 -8.206 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -0.878 2.754 -6.576 1.00 0.00 H new ATOM 670 N ALA A 529 -5.857 4.083 -5.817 1.00 0.00 N ATOM 671 CA ALA A 529 -6.824 5.149 -6.058 1.00 0.00 C ATOM 672 C ALA A 529 -6.615 6.294 -5.072 1.00 0.00 C ATOM 673 O ALA A 529 -6.601 7.463 -5.455 1.00 0.00 O ATOM 674 CB ALA A 529 -8.247 4.605 -5.918 1.00 0.00 C ATOM 0 H ALA A 529 -6.268 3.161 -5.671 1.00 0.00 H new ATOM 0 HA ALA A 529 -6.678 5.525 -7.071 1.00 0.00 H new ATOM 0 HB1 ALA A 529 -8.963 5.407 -6.099 1.00 0.00 H new ATOM 0 HB2 ALA A 529 -8.405 3.807 -6.644 1.00 0.00 H new ATOM 0 HB3 ALA A 529 -8.389 4.213 -4.911 1.00 0.00 H new ATOM 680 N LEU A 530 -6.454 5.948 -3.798 1.00 0.00 N ATOM 681 CA LEU A 530 -6.247 6.955 -2.764 1.00 0.00 C ATOM 682 C LEU A 530 -5.019 7.802 -3.079 1.00 0.00 C ATOM 683 O LEU A 530 -5.098 9.029 -3.132 1.00 0.00 O ATOM 684 CB LEU A 530 -6.065 6.278 -1.405 1.00 0.00 C ATOM 685 CG LEU A 530 -7.338 5.511 -1.033 1.00 0.00 C ATOM 686 CD1 LEU A 530 -7.060 4.621 0.182 1.00 0.00 C ATOM 687 CD2 LEU A 530 -8.466 6.499 -0.700 1.00 0.00 C ATOM 0 H LEU A 530 -6.463 4.986 -3.459 1.00 0.00 H new ATOM 0 HA LEU A 530 -7.123 7.602 -2.734 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -5.215 5.596 -1.439 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -5.844 7.025 -0.643 1.00 0.00 H new ATOM 0 HG LEU A 530 -7.644 4.892 -1.877 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -7.965 4.075 0.448 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -6.267 3.913 -0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -6.750 5.241 1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -9.368 5.946 -0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -8.165 7.125 0.140 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -8.666 7.128 -1.567 1.00 0.00 H new ATOM 699 N ALA A 531 -3.885 7.141 -3.285 1.00 0.00 N ATOM 700 CA ALA A 531 -2.645 7.847 -3.591 1.00 0.00 C ATOM 701 C ALA A 531 -2.890 8.955 -4.614 1.00 0.00 C ATOM 702 O ALA A 531 -2.265 10.014 -4.555 1.00 0.00 O ATOM 703 CB ALA A 531 -1.607 6.865 -4.139 1.00 0.00 C ATOM 0 H ALA A 531 -3.798 6.125 -3.246 1.00 0.00 H new ATOM 0 HA ALA A 531 -2.272 8.297 -2.671 1.00 0.00 H new ATOM 0 HB1 ALA A 531 -0.684 7.399 -4.365 1.00 0.00 H new ATOM 0 HB2 ALA A 531 -1.407 6.094 -3.395 1.00 0.00 H new ATOM 0 HB3 ALA A 531 -1.990 6.401 -5.048 1.00 0.00 H new ATOM 709 N HIS A 532 -3.801 8.704 -5.550 1.00 0.00 N ATOM 710 CA HIS A 532 -4.116 9.689 -6.580 1.00 0.00 C ATOM 711 C HIS A 532 -4.959 10.821 -5.997 1.00 0.00 C ATOM 712 O HIS A 532 -4.938 11.945 -6.497 1.00 0.00 O ATOM 713 CB HIS A 532 -4.873 9.012 -7.734 1.00 0.00 C ATOM 714 CG HIS A 532 -4.134 9.227 -9.029 1.00 0.00 C ATOM 715 ND1 HIS A 532 -3.692 10.478 -9.429 1.00 0.00 N ATOM 716 CD2 HIS A 532 -3.752 8.359 -10.022 1.00 0.00 C ATOM 717 CE1 HIS A 532 -3.075 10.330 -10.615 1.00 0.00 C ATOM 718 NE2 HIS A 532 -3.082 9.058 -11.023 1.00 0.00 N ATOM 0 H HIS A 532 -4.330 7.835 -5.617 1.00 0.00 H new ATOM 0 HA HIS A 532 -3.184 10.109 -6.959 1.00 0.00 H new ATOM 0 HB2 HIS A 532 -4.975 7.945 -7.537 1.00 0.00 H new ATOM 0 HB3 HIS A 532 -5.881 9.421 -7.808 1.00 0.00 H new ATOM 0 HD2 HIS A 532 -3.942 7.296 -10.026 1.00 0.00 H new ATOM 0 HE1 HIS A 532 -2.628 11.141 -11.170 1.00 0.00 H new ATOM 0 HE2 HIS A 532 -2.683 8.680 -11.882 1.00 0.00 H new ATOM 726 N VAL A 533 -5.703 10.514 -4.938 1.00 0.00 N ATOM 727 CA VAL A 533 -6.551 11.511 -4.295 1.00 0.00 C ATOM 728 C VAL A 533 -5.753 12.326 -3.281 1.00 0.00 C ATOM 729 O VAL A 533 -5.995 13.521 -3.104 1.00 0.00 O ATOM 730 CB VAL A 533 -7.721 10.819 -3.588 1.00 0.00 C ATOM 731 CG1 VAL A 533 -8.561 11.863 -2.850 1.00 0.00 C ATOM 732 CG2 VAL A 533 -8.594 10.101 -4.622 1.00 0.00 C ATOM 0 H VAL A 533 -5.736 9.589 -4.510 1.00 0.00 H new ATOM 0 HA VAL A 533 -6.933 12.185 -5.062 1.00 0.00 H new ATOM 0 HB VAL A 533 -7.333 10.093 -2.874 1.00 0.00 H new ATOM 0 HG11 VAL A 533 -9.393 11.371 -2.347 1.00 0.00 H new ATOM 0 HG12 VAL A 533 -7.942 12.373 -2.112 1.00 0.00 H new ATOM 0 HG13 VAL A 533 -8.947 12.590 -3.564 1.00 0.00 H new ATOM 0 HG21 VAL A 533 -9.426 9.609 -4.117 1.00 0.00 H new ATOM 0 HG22 VAL A 533 -8.981 10.826 -5.338 1.00 0.00 H new ATOM 0 HG23 VAL A 533 -7.997 9.356 -5.148 1.00 0.00 H new ATOM 742 N PHE A 534 -4.804 11.674 -2.618 1.00 0.00 N ATOM 743 CA PHE A 534 -3.976 12.348 -1.621 1.00 0.00 C ATOM 744 C PHE A 534 -2.723 12.932 -2.265 1.00 0.00 C ATOM 745 O PHE A 534 -1.895 13.541 -1.589 1.00 0.00 O ATOM 746 CB PHE A 534 -3.579 11.360 -0.519 1.00 0.00 C ATOM 747 CG PHE A 534 -4.706 11.237 0.480 1.00 0.00 C ATOM 748 CD1 PHE A 534 -5.843 10.486 0.162 1.00 0.00 C ATOM 749 CD2 PHE A 534 -4.613 11.876 1.722 1.00 0.00 C ATOM 750 CE1 PHE A 534 -6.889 10.375 1.086 1.00 0.00 C ATOM 751 CE2 PHE A 534 -5.658 11.765 2.647 1.00 0.00 C ATOM 752 CZ PHE A 534 -6.796 11.014 2.329 1.00 0.00 C ATOM 0 H PHE A 534 -4.589 10.686 -2.751 1.00 0.00 H new ATOM 0 HA PHE A 534 -4.555 13.163 -1.186 1.00 0.00 H new ATOM 0 HB2 PHE A 534 -3.356 10.385 -0.953 1.00 0.00 H new ATOM 0 HB3 PHE A 534 -2.672 11.701 -0.020 1.00 0.00 H new ATOM 0 HD1 PHE A 534 -5.914 9.992 -0.796 1.00 0.00 H new ATOM 0 HD2 PHE A 534 -3.735 12.455 1.967 1.00 0.00 H new ATOM 0 HE1 PHE A 534 -7.767 9.797 0.840 1.00 0.00 H new ATOM 0 HE2 PHE A 534 -5.586 12.258 3.605 1.00 0.00 H new ATOM 0 HZ PHE A 534 -7.602 10.927 3.042 1.00 0.00 H new ATOM 762 N VAL A 535 -2.590 12.745 -3.573 1.00 0.00 N ATOM 763 CA VAL A 535 -1.431 13.263 -4.290 1.00 0.00 C ATOM 764 C VAL A 535 -1.215 14.735 -3.953 1.00 0.00 C ATOM 765 O VAL A 535 -0.172 15.308 -4.268 1.00 0.00 O ATOM 766 CB VAL A 535 -1.636 13.107 -5.797 1.00 0.00 C ATOM 767 CG1 VAL A 535 -2.835 13.951 -6.238 1.00 0.00 C ATOM 768 CG2 VAL A 535 -0.382 13.581 -6.535 1.00 0.00 C ATOM 0 H VAL A 535 -3.263 12.244 -4.154 1.00 0.00 H new ATOM 0 HA VAL A 535 -0.551 12.696 -3.985 1.00 0.00 H new ATOM 0 HB VAL A 535 -1.822 12.059 -6.031 1.00 0.00 H new ATOM 0 HG11 VAL A 535 -2.982 13.841 -7.312 1.00 0.00 H new ATOM 0 HG12 VAL A 535 -3.729 13.615 -5.713 1.00 0.00 H new ATOM 0 HG13 VAL A 535 -2.648 14.999 -6.003 1.00 0.00 H new ATOM 0 HG21 VAL A 535 -0.528 13.470 -7.609 1.00 0.00 H new ATOM 0 HG22 VAL A 535 -0.196 14.629 -6.301 1.00 0.00 H new ATOM 0 HG23 VAL A 535 0.473 12.982 -6.221 1.00 0.00 H new ATOM 778 N GLY A 536 -2.209 15.340 -3.306 1.00 0.00 N ATOM 779 CA GLY A 536 -2.125 16.747 -2.922 1.00 0.00 C ATOM 780 C GLY A 536 -2.024 16.890 -1.407 1.00 0.00 C ATOM 781 O GLY A 536 -1.184 17.632 -0.898 1.00 0.00 O ATOM 0 H GLY A 536 -3.079 14.880 -3.038 1.00 0.00 H new ATOM 0 HA2 GLY A 536 -1.256 17.206 -3.394 1.00 0.00 H new ATOM 0 HA3 GLY A 536 -3.004 17.281 -3.284 1.00 0.00 H new ATOM 785 N THR A 537 -2.886 16.172 -0.691 1.00 0.00 N ATOM 786 CA THR A 537 -2.885 16.221 0.766 1.00 0.00 C ATOM 787 C THR A 537 -1.865 15.237 1.330 1.00 0.00 C ATOM 788 O THR A 537 -1.217 14.503 0.582 1.00 0.00 O ATOM 789 CB THR A 537 -4.278 15.879 1.304 1.00 0.00 C ATOM 790 OG1 THR A 537 -4.799 14.768 0.590 1.00 0.00 O ATOM 791 CG2 THR A 537 -5.208 17.081 1.128 1.00 0.00 C ATOM 0 H THR A 537 -3.590 15.553 -1.094 1.00 0.00 H new ATOM 0 HA THR A 537 -2.615 17.230 1.078 1.00 0.00 H new ATOM 0 HB THR A 537 -4.206 15.632 2.363 1.00 0.00 H new ATOM 0 HG1 THR A 537 -4.659 13.950 1.111 1.00 0.00 H new ATOM 0 HG21 THR A 537 -6.198 16.834 1.512 1.00 0.00 H new ATOM 0 HG22 THR A 537 -4.808 17.934 1.677 1.00 0.00 H new ATOM 0 HG23 THR A 537 -5.281 17.332 0.070 1.00 0.00 H new ATOM 799 N CYS A 538 -1.728 15.227 2.651 1.00 0.00 N ATOM 800 CA CYS A 538 -0.783 14.329 3.314 1.00 0.00 C ATOM 801 C CYS A 538 -1.502 13.454 4.335 1.00 0.00 C ATOM 802 O CYS A 538 -2.660 13.700 4.671 1.00 0.00 O ATOM 803 CB CYS A 538 0.306 15.144 4.015 1.00 0.00 C ATOM 804 SG CYS A 538 1.271 16.049 2.781 1.00 0.00 S ATOM 0 H CYS A 538 -2.256 15.827 3.284 1.00 0.00 H new ATOM 0 HA CYS A 538 -0.328 13.688 2.559 1.00 0.00 H new ATOM 0 HB2 CYS A 538 -0.145 15.840 4.722 1.00 0.00 H new ATOM 0 HB3 CYS A 538 0.957 14.484 4.588 1.00 0.00 H new ATOM 0 HG CYS A 538 2.195 16.743 3.376 1.00 0.00 H new ATOM 810 N ASN A 539 -0.806 12.432 4.824 1.00 0.00 N ATOM 811 CA ASN A 539 -1.385 11.522 5.808 1.00 0.00 C ATOM 812 C ASN A 539 -0.488 10.299 5.987 1.00 0.00 C ATOM 813 O ASN A 539 -0.234 9.559 5.035 1.00 0.00 O ATOM 814 CB ASN A 539 -2.786 11.082 5.358 1.00 0.00 C ATOM 815 CG ASN A 539 -3.862 11.870 6.105 1.00 0.00 C ATOM 816 OD1 ASN A 539 -3.579 12.924 6.676 1.00 0.00 O ATOM 817 ND2 ASN A 539 -5.085 11.419 6.134 1.00 0.00 N ATOM 0 H ASN A 539 0.154 12.214 4.557 1.00 0.00 H new ATOM 0 HA ASN A 539 -1.466 12.043 6.762 1.00 0.00 H new ATOM 0 HB2 ASN A 539 -2.894 11.236 4.284 1.00 0.00 H new ATOM 0 HB3 ASN A 539 -2.915 10.015 5.542 1.00 0.00 H new ATOM 0 HD21 ASN A 539 -5.809 11.939 6.630 1.00 0.00 H new ATOM 0 HD22 ASN A 539 -5.318 10.546 5.661 1.00 0.00 H new ATOM 824 N GLY A 540 -0.012 10.093 7.210 1.00 0.00 N ATOM 825 CA GLY A 540 0.855 8.959 7.502 1.00 0.00 C ATOM 826 C GLY A 540 0.050 7.669 7.615 1.00 0.00 C ATOM 827 O GLY A 540 0.544 6.588 7.296 1.00 0.00 O ATOM 0 H GLY A 540 -0.211 10.693 8.011 1.00 0.00 H new ATOM 0 HA2 GLY A 540 1.603 8.857 6.716 1.00 0.00 H new ATOM 0 HA3 GLY A 540 1.393 9.139 8.433 1.00 0.00 H new ATOM 831 N ASP A 541 -1.193 7.791 8.070 1.00 0.00 N ATOM 832 CA ASP A 541 -2.058 6.628 8.220 1.00 0.00 C ATOM 833 C ASP A 541 -2.046 5.783 6.949 1.00 0.00 C ATOM 834 O ASP A 541 -2.183 4.560 7.004 1.00 0.00 O ATOM 835 CB ASP A 541 -3.488 7.076 8.525 1.00 0.00 C ATOM 836 CG ASP A 541 -3.474 8.190 9.566 1.00 0.00 C ATOM 837 OD1 ASP A 541 -2.399 8.515 10.043 1.00 0.00 O ATOM 838 OD2 ASP A 541 -4.538 8.702 9.871 1.00 0.00 O ATOM 0 H ASP A 541 -1.621 8.677 8.339 1.00 0.00 H new ATOM 0 HA ASP A 541 -1.683 6.024 9.047 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -3.971 7.426 7.612 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -4.072 6.232 8.891 1.00 0.00 H new ATOM 843 N ILE A 542 -1.881 6.442 5.809 1.00 0.00 N ATOM 844 CA ILE A 542 -1.852 5.742 4.530 1.00 0.00 C ATOM 845 C ILE A 542 -0.738 4.698 4.515 1.00 0.00 C ATOM 846 O ILE A 542 -0.938 3.571 4.063 1.00 0.00 O ATOM 847 CB ILE A 542 -1.638 6.740 3.391 1.00 0.00 C ATOM 848 CG1 ILE A 542 -2.833 7.694 3.320 1.00 0.00 C ATOM 849 CG2 ILE A 542 -1.510 5.986 2.067 1.00 0.00 C ATOM 850 CD1 ILE A 542 -2.488 8.881 2.420 1.00 0.00 C ATOM 0 H ILE A 542 -1.766 7.453 5.743 1.00 0.00 H new ATOM 0 HA ILE A 542 -2.808 5.237 4.392 1.00 0.00 H new ATOM 0 HB ILE A 542 -0.726 7.309 3.574 1.00 0.00 H new ATOM 0 HG12 ILE A 542 -3.706 7.171 2.930 1.00 0.00 H new ATOM 0 HG13 ILE A 542 -3.091 8.045 4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 542 -1.358 6.698 1.256 1.00 0.00 H new ATOM 0 HG22 ILE A 542 -0.660 5.305 2.117 1.00 0.00 H new ATOM 0 HG23 ILE A 542 -2.421 5.416 1.883 1.00 0.00 H new ATOM 0 HD11 ILE A 542 -3.340 9.559 2.370 1.00 0.00 H new ATOM 0 HD12 ILE A 542 -1.627 9.409 2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 542 -2.251 8.522 1.419 1.00 0.00 H new ATOM 862 N THR A 543 0.434 5.083 5.010 1.00 0.00 N ATOM 863 CA THR A 543 1.573 4.171 5.047 1.00 0.00 C ATOM 864 C THR A 543 1.360 3.087 6.098 1.00 0.00 C ATOM 865 O THR A 543 1.770 1.942 5.914 1.00 0.00 O ATOM 866 CB THR A 543 2.852 4.946 5.368 1.00 0.00 C ATOM 867 OG1 THR A 543 3.006 6.010 4.439 1.00 0.00 O ATOM 868 CG2 THR A 543 4.057 4.007 5.276 1.00 0.00 C ATOM 0 H THR A 543 0.620 6.012 5.388 1.00 0.00 H new ATOM 0 HA THR A 543 1.667 3.700 4.069 1.00 0.00 H new ATOM 0 HB THR A 543 2.787 5.352 6.378 1.00 0.00 H new ATOM 0 HG1 THR A 543 3.824 6.508 4.645 1.00 0.00 H new ATOM 0 HG21 THR A 543 4.968 4.560 5.505 1.00 0.00 H new ATOM 0 HG22 THR A 543 3.938 3.192 5.990 1.00 0.00 H new ATOM 0 HG23 THR A 543 4.124 3.599 4.267 1.00 0.00 H new ATOM 876 N THR A 544 0.720 3.457 7.201 1.00 0.00 N ATOM 877 CA THR A 544 0.461 2.510 8.281 1.00 0.00 C ATOM 878 C THR A 544 -0.186 1.237 7.746 1.00 0.00 C ATOM 879 O THR A 544 0.352 0.142 7.908 1.00 0.00 O ATOM 880 CB THR A 544 -0.458 3.150 9.326 1.00 0.00 C ATOM 881 OG1 THR A 544 0.037 4.439 9.663 1.00 0.00 O ATOM 882 CG2 THR A 544 -0.500 2.274 10.579 1.00 0.00 C ATOM 0 H THR A 544 0.372 4.401 7.372 1.00 0.00 H new ATOM 0 HA THR A 544 1.414 2.249 8.741 1.00 0.00 H new ATOM 0 HB THR A 544 -1.464 3.241 8.917 1.00 0.00 H new ATOM 0 HG1 THR A 544 -0.452 4.785 10.439 1.00 0.00 H new ATOM 0 HG21 THR A 544 -1.154 2.731 11.321 1.00 0.00 H new ATOM 0 HG22 THR A 544 -0.880 1.286 10.320 1.00 0.00 H new ATOM 0 HG23 THR A 544 0.505 2.179 10.991 1.00 0.00 H new ATOM 890 N SER A 545 -1.343 1.388 7.111 1.00 0.00 N ATOM 891 CA SER A 545 -2.055 0.240 6.562 1.00 0.00 C ATOM 892 C SER A 545 -1.219 -0.441 5.485 1.00 0.00 C ATOM 893 O SER A 545 -0.955 -1.641 5.556 1.00 0.00 O ATOM 894 CB SER A 545 -3.388 0.692 5.969 1.00 0.00 C ATOM 895 OG SER A 545 -3.148 1.421 4.774 1.00 0.00 O ATOM 0 H SER A 545 -1.805 2.286 6.964 1.00 0.00 H new ATOM 0 HA SER A 545 -2.239 -0.472 7.366 1.00 0.00 H new ATOM 0 HB2 SER A 545 -4.018 -0.173 5.761 1.00 0.00 H new ATOM 0 HB3 SER A 545 -3.926 1.313 6.685 1.00 0.00 H new ATOM 0 HG SER A 545 -3.713 1.067 4.056 1.00 0.00 H new ATOM 901 N ILE A 546 -0.801 0.335 4.493 1.00 0.00 N ATOM 902 CA ILE A 546 0.012 -0.200 3.408 1.00 0.00 C ATOM 903 C ILE A 546 1.137 -1.066 3.974 1.00 0.00 C ATOM 904 O ILE A 546 1.444 -2.129 3.435 1.00 0.00 O ATOM 905 CB ILE A 546 0.584 0.963 2.575 1.00 0.00 C ATOM 906 CG1 ILE A 546 -0.275 1.170 1.324 1.00 0.00 C ATOM 907 CG2 ILE A 546 2.026 0.669 2.150 1.00 0.00 C ATOM 908 CD1 ILE A 546 0.090 2.502 0.668 1.00 0.00 C ATOM 0 H ILE A 546 -1.010 1.331 4.417 1.00 0.00 H new ATOM 0 HA ILE A 546 -0.606 -0.824 2.763 1.00 0.00 H new ATOM 0 HB ILE A 546 0.574 1.863 3.189 1.00 0.00 H new ATOM 0 HG12 ILE A 546 -0.117 0.351 0.622 1.00 0.00 H new ATOM 0 HG13 ILE A 546 -1.332 1.161 1.590 1.00 0.00 H new ATOM 0 HG21 ILE A 546 2.410 1.503 1.563 1.00 0.00 H new ATOM 0 HG22 ILE A 546 2.646 0.533 3.036 1.00 0.00 H new ATOM 0 HG23 ILE A 546 2.050 -0.239 1.548 1.00 0.00 H new ATOM 0 HD11 ILE A 546 -0.522 2.649 -0.222 1.00 0.00 H new ATOM 0 HD12 ILE A 546 -0.091 3.315 1.371 1.00 0.00 H new ATOM 0 HD13 ILE A 546 1.143 2.493 0.387 1.00 0.00 H new ATOM 920 N MET A 547 1.744 -0.604 5.061 1.00 0.00 N ATOM 921 CA MET A 547 2.830 -1.345 5.688 1.00 0.00 C ATOM 922 C MET A 547 2.355 -2.735 6.100 1.00 0.00 C ATOM 923 O MET A 547 2.941 -3.744 5.709 1.00 0.00 O ATOM 924 CB MET A 547 3.338 -0.590 6.921 1.00 0.00 C ATOM 925 CG MET A 547 4.735 -1.098 7.308 1.00 0.00 C ATOM 926 SD MET A 547 5.993 0.039 6.668 1.00 0.00 S ATOM 927 CE MET A 547 6.678 -1.047 5.392 1.00 0.00 C ATOM 0 H MET A 547 1.505 0.273 5.523 1.00 0.00 H new ATOM 0 HA MET A 547 3.642 -1.446 4.967 1.00 0.00 H new ATOM 0 HB2 MET A 547 3.375 0.479 6.713 1.00 0.00 H new ATOM 0 HB3 MET A 547 2.648 -0.729 7.753 1.00 0.00 H new ATOM 0 HG2 MET A 547 4.818 -1.175 8.392 1.00 0.00 H new ATOM 0 HG3 MET A 547 4.894 -2.098 6.904 1.00 0.00 H new ATOM 0 HE1 MET A 547 7.560 -0.581 4.953 1.00 0.00 H new ATOM 0 HE2 MET A 547 6.956 -2.002 5.838 1.00 0.00 H new ATOM 0 HE3 MET A 547 5.931 -1.213 4.616 1.00 0.00 H new ATOM 937 N ASP A 548 1.286 -2.778 6.889 1.00 0.00 N ATOM 938 CA ASP A 548 0.738 -4.049 7.347 1.00 0.00 C ATOM 939 C ASP A 548 0.582 -5.016 6.178 1.00 0.00 C ATOM 940 O ASP A 548 0.792 -6.220 6.324 1.00 0.00 O ATOM 941 CB ASP A 548 -0.622 -3.822 8.010 1.00 0.00 C ATOM 942 CG ASP A 548 -0.456 -2.974 9.266 1.00 0.00 C ATOM 943 OD1 ASP A 548 0.175 -1.933 9.174 1.00 0.00 O ATOM 944 OD2 ASP A 548 -0.960 -3.376 10.300 1.00 0.00 O ATOM 0 H ASP A 548 0.786 -1.954 7.222 1.00 0.00 H new ATOM 0 HA ASP A 548 1.427 -4.482 8.072 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -1.297 -3.326 7.313 1.00 0.00 H new ATOM 0 HB3 ASP A 548 -1.075 -4.780 8.265 1.00 0.00 H new ATOM 949 N ASN A 549 0.215 -4.481 5.018 1.00 0.00 N ATOM 950 CA ASN A 549 0.037 -5.307 3.829 1.00 0.00 C ATOM 951 C ASN A 549 1.353 -5.975 3.441 1.00 0.00 C ATOM 952 O ASN A 549 1.417 -7.193 3.279 1.00 0.00 O ATOM 953 CB ASN A 549 -0.465 -4.448 2.666 1.00 0.00 C ATOM 954 CG ASN A 549 -1.053 -5.337 1.574 1.00 0.00 C ATOM 955 OD1 ASN A 549 -2.193 -5.133 1.154 1.00 0.00 O ATOM 956 ND2 ASN A 549 -0.341 -6.316 1.089 1.00 0.00 N ATOM 0 H ASN A 549 0.036 -3.487 4.876 1.00 0.00 H new ATOM 0 HA ASN A 549 -0.699 -6.080 4.052 1.00 0.00 H new ATOM 0 HB2 ASN A 549 -1.220 -3.747 3.021 1.00 0.00 H new ATOM 0 HB3 ASN A 549 0.355 -3.855 2.261 1.00 0.00 H new ATOM 0 HD21 ASN A 549 -0.728 -6.915 0.360 1.00 0.00 H new ATOM 0 HD22 ASN A 549 0.603 -6.482 1.439 1.00 0.00 H new ATOM 963 N PHE A 550 2.399 -5.168 3.296 1.00 0.00 N ATOM 964 CA PHE A 550 3.710 -5.692 2.928 1.00 0.00 C ATOM 965 C PHE A 550 4.054 -6.916 3.773 1.00 0.00 C ATOM 966 O PHE A 550 4.489 -7.942 3.249 1.00 0.00 O ATOM 967 CB PHE A 550 4.781 -4.609 3.121 1.00 0.00 C ATOM 968 CG PHE A 550 4.941 -3.815 1.844 1.00 0.00 C ATOM 969 CD1 PHE A 550 5.802 -4.275 0.839 1.00 0.00 C ATOM 970 CD2 PHE A 550 4.233 -2.621 1.665 1.00 0.00 C ATOM 971 CE1 PHE A 550 5.952 -3.541 -0.343 1.00 0.00 C ATOM 972 CE2 PHE A 550 4.384 -1.888 0.482 1.00 0.00 C ATOM 973 CZ PHE A 550 5.244 -2.347 -0.522 1.00 0.00 C ATOM 0 H PHE A 550 2.366 -4.157 3.426 1.00 0.00 H new ATOM 0 HA PHE A 550 3.683 -5.988 1.879 1.00 0.00 H new ATOM 0 HB2 PHE A 550 4.498 -3.947 3.939 1.00 0.00 H new ATOM 0 HB3 PHE A 550 5.730 -5.068 3.396 1.00 0.00 H new ATOM 0 HD1 PHE A 550 6.350 -5.196 0.976 1.00 0.00 H new ATOM 0 HD2 PHE A 550 3.570 -2.265 2.440 1.00 0.00 H new ATOM 0 HE1 PHE A 550 6.615 -3.896 -1.118 1.00 0.00 H new ATOM 0 HE2 PHE A 550 3.836 -0.967 0.344 1.00 0.00 H new ATOM 0 HZ PHE A 550 5.361 -1.781 -1.434 1.00 0.00 H new ATOM 983 N LEU A 551 3.857 -6.804 5.083 1.00 0.00 N ATOM 984 CA LEU A 551 4.151 -7.910 5.986 1.00 0.00 C ATOM 985 C LEU A 551 3.130 -9.031 5.806 1.00 0.00 C ATOM 986 O LEU A 551 3.476 -10.211 5.846 1.00 0.00 O ATOM 987 CB LEU A 551 4.131 -7.423 7.438 1.00 0.00 C ATOM 988 CG LEU A 551 5.446 -6.707 7.759 1.00 0.00 C ATOM 989 CD1 LEU A 551 5.613 -5.502 6.830 1.00 0.00 C ATOM 990 CD2 LEU A 551 5.423 -6.232 9.213 1.00 0.00 C ATOM 0 H LEU A 551 3.498 -5.966 5.540 1.00 0.00 H new ATOM 0 HA LEU A 551 5.143 -8.295 5.749 1.00 0.00 H new ATOM 0 HB2 LEU A 551 3.290 -6.747 7.594 1.00 0.00 H new ATOM 0 HB3 LEU A 551 3.991 -8.267 8.113 1.00 0.00 H new ATOM 0 HG LEU A 551 6.280 -7.394 7.613 1.00 0.00 H new ATOM 0 HD11 LEU A 551 6.549 -4.993 7.059 1.00 0.00 H new ATOM 0 HD12 LEU A 551 5.628 -5.841 5.794 1.00 0.00 H new ATOM 0 HD13 LEU A 551 4.781 -4.813 6.974 1.00 0.00 H new ATOM 0 HD21 LEU A 551 6.358 -5.722 9.444 1.00 0.00 H new ATOM 0 HD22 LEU A 551 4.589 -5.545 9.358 1.00 0.00 H new ATOM 0 HD23 LEU A 551 5.305 -7.090 9.874 1.00 0.00 H new ATOM 1002 N GLU A 552 1.872 -8.650 5.607 1.00 0.00 N ATOM 1003 CA GLU A 552 0.809 -9.630 5.420 1.00 0.00 C ATOM 1004 C GLU A 552 0.922 -10.278 4.043 1.00 0.00 C ATOM 1005 O GLU A 552 0.245 -11.263 3.751 1.00 0.00 O ATOM 1006 CB GLU A 552 -0.557 -8.948 5.560 1.00 0.00 C ATOM 1007 CG GLU A 552 -1.625 -9.994 5.895 1.00 0.00 C ATOM 1008 CD GLU A 552 -1.504 -10.413 7.356 1.00 0.00 C ATOM 1009 OE1 GLU A 552 -0.704 -11.289 7.638 1.00 0.00 O ATOM 1010 OE2 GLU A 552 -2.216 -9.851 8.173 1.00 0.00 O ATOM 0 H GLU A 552 1.566 -7.678 5.571 1.00 0.00 H new ATOM 0 HA GLU A 552 0.907 -10.403 6.182 1.00 0.00 H new ATOM 0 HB2 GLU A 552 -0.518 -8.191 6.343 1.00 0.00 H new ATOM 0 HB3 GLU A 552 -0.815 -8.435 4.633 1.00 0.00 H new ATOM 0 HG2 GLU A 552 -2.618 -9.585 5.706 1.00 0.00 H new ATOM 0 HG3 GLU A 552 -1.510 -10.864 5.248 1.00 0.00 H new ATOM 1017 N ARG A 553 1.786 -9.717 3.201 1.00 0.00 N ATOM 1018 CA ARG A 553 1.984 -10.246 1.856 1.00 0.00 C ATOM 1019 C ARG A 553 2.094 -11.767 1.885 1.00 0.00 C ATOM 1020 O ARG A 553 3.182 -12.315 2.065 1.00 0.00 O ATOM 1021 CB ARG A 553 3.254 -9.651 1.243 1.00 0.00 C ATOM 1022 CG ARG A 553 3.317 -10.006 -0.244 1.00 0.00 C ATOM 1023 CD ARG A 553 4.618 -9.472 -0.843 1.00 0.00 C ATOM 1024 NE ARG A 553 4.657 -9.733 -2.277 1.00 0.00 N ATOM 1025 CZ ARG A 553 5.788 -9.621 -2.966 1.00 0.00 C ATOM 1026 NH1 ARG A 553 6.712 -8.788 -2.571 1.00 0.00 N ATOM 1027 NH2 ARG A 553 5.975 -10.345 -4.035 1.00 0.00 N ATOM 0 H ARG A 553 2.356 -8.902 3.425 1.00 0.00 H new ATOM 0 HA ARG A 553 1.122 -9.970 1.248 1.00 0.00 H new ATOM 0 HB2 ARG A 553 3.259 -8.568 1.370 1.00 0.00 H new ATOM 0 HB3 ARG A 553 4.134 -10.037 1.758 1.00 0.00 H new ATOM 0 HG2 ARG A 553 3.262 -11.087 -0.373 1.00 0.00 H new ATOM 0 HG3 ARG A 553 2.461 -9.579 -0.767 1.00 0.00 H new ATOM 0 HD2 ARG A 553 4.699 -8.401 -0.659 1.00 0.00 H new ATOM 0 HD3 ARG A 553 5.472 -9.944 -0.357 1.00 0.00 H new ATOM 0 HE ARG A 553 3.801 -10.006 -2.760 1.00 0.00 H new ATOM 0 HH11 ARG A 553 6.566 -8.224 -1.734 1.00 0.00 H new ATOM 0 HH12 ARG A 553 7.580 -8.702 -3.099 1.00 0.00 H new ATOM 0 HH21 ARG A 553 5.253 -10.997 -4.342 1.00 0.00 H new ATOM 0 HH22 ARG A 553 6.843 -10.259 -4.564 1.00 0.00 H new ATOM 1041 N THR A 554 0.964 -12.441 1.703 1.00 0.00 N ATOM 1042 CA THR A 554 0.945 -13.900 1.707 1.00 0.00 C ATOM 1043 C THR A 554 1.482 -14.442 0.386 1.00 0.00 C ATOM 1044 O THR A 554 1.571 -13.715 -0.603 1.00 0.00 O ATOM 1045 CB THR A 554 -0.485 -14.401 1.934 1.00 0.00 C ATOM 1046 OG1 THR A 554 -1.098 -13.626 2.954 1.00 0.00 O ATOM 1047 CG2 THR A 554 -0.459 -15.872 2.355 1.00 0.00 C ATOM 0 H THR A 554 0.055 -12.005 1.552 1.00 0.00 H new ATOM 0 HA THR A 554 1.583 -14.257 2.516 1.00 0.00 H new ATOM 0 HB THR A 554 -1.053 -14.304 1.009 1.00 0.00 H new ATOM 0 HG1 THR A 554 -0.481 -12.923 3.246 1.00 0.00 H new ATOM 0 HG21 THR A 554 -1.479 -16.223 2.515 1.00 0.00 H new ATOM 0 HG22 THR A 554 0.010 -16.467 1.571 1.00 0.00 H new ATOM 0 HG23 THR A 554 0.110 -15.976 3.279 1.00 0.00 H new ATOM 1055 N ALA A 555 1.839 -15.722 0.379 1.00 0.00 N ATOM 1056 CA ALA A 555 2.368 -16.352 -0.826 1.00 0.00 C ATOM 1057 C ALA A 555 1.469 -16.071 -2.026 1.00 0.00 C ATOM 1058 O ALA A 555 1.824 -16.377 -3.164 1.00 0.00 O ATOM 1059 CB ALA A 555 2.479 -17.863 -0.616 1.00 0.00 C ATOM 0 H ALA A 555 1.773 -16.340 1.188 1.00 0.00 H new ATOM 0 HA ALA A 555 3.355 -15.935 -1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 555 2.875 -18.328 -1.519 1.00 0.00 H new ATOM 0 HB2 ALA A 555 3.149 -18.066 0.220 1.00 0.00 H new ATOM 0 HB3 ALA A 555 1.493 -18.274 -0.399 1.00 0.00 H new ATOM 1065 N ILE A 556 0.303 -15.488 -1.763 1.00 0.00 N ATOM 1066 CA ILE A 556 -0.648 -15.172 -2.826 1.00 0.00 C ATOM 1067 C ILE A 556 0.029 -14.352 -3.928 1.00 0.00 C ATOM 1068 O ILE A 556 -0.584 -14.042 -4.949 1.00 0.00 O ATOM 1069 CB ILE A 556 -1.850 -14.407 -2.223 1.00 0.00 C ATOM 1070 CG1 ILE A 556 -3.162 -15.109 -2.602 1.00 0.00 C ATOM 1071 CG2 ILE A 556 -1.890 -12.956 -2.724 1.00 0.00 C ATOM 1072 CD1 ILE A 556 -3.363 -16.341 -1.714 1.00 0.00 C ATOM 0 H ILE A 556 -0.006 -15.225 -0.827 1.00 0.00 H new ATOM 0 HA ILE A 556 -1.007 -16.097 -3.278 1.00 0.00 H new ATOM 0 HB ILE A 556 -1.733 -14.399 -1.139 1.00 0.00 H new ATOM 0 HG12 ILE A 556 -4.000 -14.423 -2.484 1.00 0.00 H new ATOM 0 HG13 ILE A 556 -3.138 -15.405 -3.651 1.00 0.00 H new ATOM 0 HG21 ILE A 556 -2.745 -12.443 -2.284 1.00 0.00 H new ATOM 0 HG22 ILE A 556 -0.972 -12.446 -2.434 1.00 0.00 H new ATOM 0 HG23 ILE A 556 -1.982 -12.948 -3.810 1.00 0.00 H new ATOM 0 HD11 ILE A 556 -4.295 -16.837 -1.985 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -2.531 -17.031 -1.855 1.00 0.00 H new ATOM 0 HD13 ILE A 556 -3.407 -16.033 -0.669 1.00 0.00 H new ATOM 1084 N GLU A 557 1.292 -14.003 -3.712 1.00 0.00 N ATOM 1085 CA GLU A 557 2.036 -13.218 -4.690 1.00 0.00 C ATOM 1086 C GLU A 557 2.061 -13.910 -6.053 1.00 0.00 C ATOM 1087 O GLU A 557 2.253 -13.260 -7.079 1.00 0.00 O ATOM 1088 CB GLU A 557 3.471 -13.001 -4.203 1.00 0.00 C ATOM 1089 CG GLU A 557 4.125 -14.356 -3.882 1.00 0.00 C ATOM 1090 CD GLU A 557 5.539 -14.410 -4.456 1.00 0.00 C ATOM 1091 OE1 GLU A 557 5.668 -14.343 -5.668 1.00 0.00 O ATOM 1092 OE2 GLU A 557 6.471 -14.518 -3.677 1.00 0.00 O ATOM 0 H GLU A 557 1.819 -14.249 -2.874 1.00 0.00 H new ATOM 0 HA GLU A 557 1.534 -12.257 -4.800 1.00 0.00 H new ATOM 0 HB2 GLU A 557 4.049 -12.480 -4.967 1.00 0.00 H new ATOM 0 HB3 GLU A 557 3.471 -12.368 -3.316 1.00 0.00 H new ATOM 0 HG2 GLU A 557 4.157 -14.506 -2.803 1.00 0.00 H new ATOM 0 HG3 GLU A 557 3.525 -15.165 -4.298 1.00 0.00 H new ATOM 1099 N LEU A 558 1.877 -15.227 -6.060 1.00 0.00 N ATOM 1100 CA LEU A 558 1.893 -15.976 -7.314 1.00 0.00 C ATOM 1101 C LEU A 558 0.766 -15.510 -8.234 1.00 0.00 C ATOM 1102 O LEU A 558 0.590 -16.038 -9.332 1.00 0.00 O ATOM 1103 CB LEU A 558 1.779 -17.485 -7.041 1.00 0.00 C ATOM 1104 CG LEU A 558 0.317 -17.890 -6.817 1.00 0.00 C ATOM 1105 CD1 LEU A 558 0.252 -19.373 -6.449 1.00 0.00 C ATOM 1106 CD2 LEU A 558 -0.277 -17.062 -5.677 1.00 0.00 C ATOM 0 H LEU A 558 1.717 -15.791 -5.226 1.00 0.00 H new ATOM 0 HA LEU A 558 2.843 -15.787 -7.815 1.00 0.00 H new ATOM 0 HB2 LEU A 558 2.191 -18.043 -7.882 1.00 0.00 H new ATOM 0 HB3 LEU A 558 2.372 -17.746 -6.164 1.00 0.00 H new ATOM 0 HG LEU A 558 -0.251 -17.712 -7.730 1.00 0.00 H new ATOM 0 HD11 LEU A 558 -0.786 -19.663 -6.289 1.00 0.00 H new ATOM 0 HD12 LEU A 558 0.674 -19.968 -7.259 1.00 0.00 H new ATOM 0 HD13 LEU A 558 0.822 -19.547 -5.536 1.00 0.00 H new ATOM 0 HD21 LEU A 558 -1.316 -17.352 -5.520 1.00 0.00 H new ATOM 0 HD22 LEU A 558 0.291 -17.240 -4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 558 -0.230 -16.004 -5.933 1.00 0.00 H new ATOM 1118 N LYS A 559 0.009 -14.516 -7.779 1.00 0.00 N ATOM 1119 CA LYS A 559 -1.095 -13.982 -8.570 1.00 0.00 C ATOM 1120 C LYS A 559 -0.564 -13.135 -9.721 1.00 0.00 C ATOM 1121 O LYS A 559 -0.241 -13.653 -10.791 1.00 0.00 O ATOM 1122 CB LYS A 559 -2.008 -13.127 -7.682 1.00 0.00 C ATOM 1123 CG LYS A 559 -2.930 -14.033 -6.855 1.00 0.00 C ATOM 1124 CD LYS A 559 -4.208 -14.332 -7.644 1.00 0.00 C ATOM 1125 CE LYS A 559 -5.133 -15.216 -6.806 1.00 0.00 C ATOM 1126 NZ LYS A 559 -6.511 -15.166 -7.370 1.00 0.00 N ATOM 0 H LYS A 559 0.138 -14.066 -6.873 1.00 0.00 H new ATOM 0 HA LYS A 559 -1.664 -14.817 -8.979 1.00 0.00 H new ATOM 0 HB2 LYS A 559 -1.406 -12.504 -7.020 1.00 0.00 H new ATOM 0 HB3 LYS A 559 -2.603 -12.454 -8.299 1.00 0.00 H new ATOM 0 HG2 LYS A 559 -2.417 -14.963 -6.610 1.00 0.00 H new ATOM 0 HG3 LYS A 559 -3.180 -13.549 -5.911 1.00 0.00 H new ATOM 0 HD2 LYS A 559 -4.714 -13.402 -7.903 1.00 0.00 H new ATOM 0 HD3 LYS A 559 -3.961 -14.832 -8.581 1.00 0.00 H new ATOM 0 HE2 LYS A 559 -4.767 -16.243 -6.802 1.00 0.00 H new ATOM 0 HE3 LYS A 559 -5.140 -14.876 -5.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 -7.141 -15.767 -6.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 -6.858 -14.186 -7.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 -6.497 -15.511 -8.351 1.00 0.00 H new ATOM 1140 N THR A 560 -0.477 -11.826 -9.493 1.00 0.00 N ATOM 1141 CA THR A 560 0.018 -10.904 -10.513 1.00 0.00 C ATOM 1142 C THR A 560 1.309 -10.239 -10.047 1.00 0.00 C ATOM 1143 O THR A 560 1.864 -10.598 -9.009 1.00 0.00 O ATOM 1144 CB THR A 560 -1.034 -9.832 -10.800 1.00 0.00 C ATOM 1145 OG1 THR A 560 -1.264 -9.069 -9.623 1.00 0.00 O ATOM 1146 CG2 THR A 560 -2.338 -10.497 -11.242 1.00 0.00 C ATOM 0 H THR A 560 -0.742 -11.381 -8.614 1.00 0.00 H new ATOM 0 HA THR A 560 0.219 -11.469 -11.423 1.00 0.00 H new ATOM 0 HB THR A 560 -0.677 -9.177 -11.595 1.00 0.00 H new ATOM 0 HG1 THR A 560 -1.937 -8.380 -9.806 1.00 0.00 H new ATOM 0 HG21 THR A 560 -3.086 -9.731 -11.446 1.00 0.00 H new ATOM 0 HG22 THR A 560 -2.161 -11.081 -12.145 1.00 0.00 H new ATOM 0 HG23 THR A 560 -2.698 -11.154 -10.450 1.00 0.00 H new ATOM 1154 N ASP A 561 1.782 -9.266 -10.822 1.00 0.00 N ATOM 1155 CA ASP A 561 3.011 -8.552 -10.482 1.00 0.00 C ATOM 1156 C ASP A 561 2.693 -7.151 -9.969 1.00 0.00 C ATOM 1157 O ASP A 561 3.473 -6.218 -10.162 1.00 0.00 O ATOM 1158 CB ASP A 561 3.915 -8.454 -11.712 1.00 0.00 C ATOM 1159 CG ASP A 561 3.168 -7.775 -12.855 1.00 0.00 C ATOM 1160 OD1 ASP A 561 3.219 -6.558 -12.931 1.00 0.00 O ATOM 1161 OD2 ASP A 561 2.557 -8.482 -13.641 1.00 0.00 O ATOM 0 H ASP A 561 1.336 -8.955 -11.685 1.00 0.00 H new ATOM 0 HA ASP A 561 3.525 -9.106 -9.696 1.00 0.00 H new ATOM 0 HB2 ASP A 561 4.815 -7.889 -11.468 1.00 0.00 H new ATOM 0 HB3 ASP A 561 4.237 -9.450 -12.017 1.00 0.00 H new ATOM 1166 N TRP A 562 1.544 -7.011 -9.316 1.00 0.00 N ATOM 1167 CA TRP A 562 1.134 -5.718 -8.780 1.00 0.00 C ATOM 1168 C TRP A 562 2.233 -5.130 -7.895 1.00 0.00 C ATOM 1169 O TRP A 562 2.264 -3.924 -7.646 1.00 0.00 O ATOM 1170 CB TRP A 562 -0.163 -5.874 -7.974 1.00 0.00 C ATOM 1171 CG TRP A 562 0.153 -6.225 -6.552 1.00 0.00 C ATOM 1172 CD1 TRP A 562 -0.105 -5.436 -5.484 1.00 0.00 C ATOM 1173 CD2 TRP A 562 0.780 -7.433 -6.027 1.00 0.00 C ATOM 1174 NE1 TRP A 562 0.323 -6.081 -4.337 1.00 0.00 N ATOM 1175 CE2 TRP A 562 0.876 -7.315 -4.620 1.00 0.00 C ATOM 1176 CE3 TRP A 562 1.269 -8.607 -6.627 1.00 0.00 C ATOM 1177 CZ2 TRP A 562 1.437 -8.324 -3.837 1.00 0.00 C ATOM 1178 CZ3 TRP A 562 1.836 -9.624 -5.842 1.00 0.00 C ATOM 1179 CH2 TRP A 562 1.919 -9.483 -4.450 1.00 0.00 C ATOM 0 H TRP A 562 0.885 -7.770 -9.146 1.00 0.00 H new ATOM 0 HA TRP A 562 0.959 -5.036 -9.612 1.00 0.00 H new ATOM 0 HB2 TRP A 562 -0.736 -4.947 -8.009 1.00 0.00 H new ATOM 0 HB3 TRP A 562 -0.785 -6.651 -8.419 1.00 0.00 H new ATOM 0 HD1 TRP A 562 -0.569 -4.462 -5.521 1.00 0.00 H new ATOM 0 HE1 TRP A 562 0.240 -5.693 -3.397 1.00 0.00 H new ATOM 0 HE3 TRP A 562 1.208 -8.727 -7.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 1.498 -8.210 -2.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 2.210 -10.520 -6.314 1.00 0.00 H new ATOM 0 HH2 TRP A 562 2.355 -10.270 -3.852 1.00 0.00 H new ATOM 1190 N VAL A 563 3.127 -5.990 -7.421 1.00 0.00 N ATOM 1191 CA VAL A 563 4.220 -5.548 -6.561 1.00 0.00 C ATOM 1192 C VAL A 563 4.858 -4.276 -7.111 1.00 0.00 C ATOM 1193 O VAL A 563 5.247 -3.389 -6.352 1.00 0.00 O ATOM 1194 CB VAL A 563 5.277 -6.648 -6.455 1.00 0.00 C ATOM 1195 CG1 VAL A 563 5.823 -6.967 -7.847 1.00 0.00 C ATOM 1196 CG2 VAL A 563 6.420 -6.169 -5.556 1.00 0.00 C ATOM 0 H VAL A 563 3.118 -6.991 -7.616 1.00 0.00 H new ATOM 0 HA VAL A 563 3.815 -5.336 -5.571 1.00 0.00 H new ATOM 0 HB VAL A 563 4.828 -7.545 -6.028 1.00 0.00 H new ATOM 0 HG11 VAL A 563 6.576 -7.751 -7.771 1.00 0.00 H new ATOM 0 HG12 VAL A 563 5.009 -7.306 -8.488 1.00 0.00 H new ATOM 0 HG13 VAL A 563 6.273 -6.071 -8.275 1.00 0.00 H new ATOM 0 HG21 VAL A 563 7.175 -6.952 -5.479 1.00 0.00 H new ATOM 0 HG22 VAL A 563 6.869 -5.273 -5.985 1.00 0.00 H new ATOM 0 HG23 VAL A 563 6.031 -5.941 -4.564 1.00 0.00 H new ATOM 1206 N ARG A 564 4.960 -4.193 -8.433 1.00 0.00 N ATOM 1207 CA ARG A 564 5.553 -3.022 -9.069 1.00 0.00 C ATOM 1208 C ARG A 564 4.790 -1.759 -8.677 1.00 0.00 C ATOM 1209 O ARG A 564 5.374 -0.804 -8.167 1.00 0.00 O ATOM 1210 CB ARG A 564 5.530 -3.185 -10.590 1.00 0.00 C ATOM 1211 CG ARG A 564 6.624 -4.168 -11.017 1.00 0.00 C ATOM 1212 CD ARG A 564 6.477 -4.480 -12.507 1.00 0.00 C ATOM 1213 NE ARG A 564 6.012 -3.299 -13.226 1.00 0.00 N ATOM 1214 CZ ARG A 564 6.839 -2.298 -13.510 1.00 0.00 C ATOM 1215 NH1 ARG A 564 7.517 -1.720 -12.556 1.00 0.00 N ATOM 1216 NH2 ARG A 564 6.973 -1.893 -14.743 1.00 0.00 N ATOM 0 H ARG A 564 4.643 -4.915 -9.080 1.00 0.00 H new ATOM 0 HA ARG A 564 6.585 -2.930 -8.731 1.00 0.00 H new ATOM 0 HB2 ARG A 564 4.554 -3.548 -10.912 1.00 0.00 H new ATOM 0 HB3 ARG A 564 5.686 -2.220 -11.072 1.00 0.00 H new ATOM 0 HG2 ARG A 564 7.608 -3.742 -10.819 1.00 0.00 H new ATOM 0 HG3 ARG A 564 6.551 -5.086 -10.434 1.00 0.00 H new ATOM 0 HD2 ARG A 564 7.434 -4.809 -12.913 1.00 0.00 H new ATOM 0 HD3 ARG A 564 5.773 -5.300 -12.646 1.00 0.00 H new ATOM 0 HE ARG A 564 5.036 -3.240 -13.516 1.00 0.00 H new ATOM 0 HH11 ARG A 564 7.412 -2.037 -11.592 1.00 0.00 H new ATOM 0 HH12 ARG A 564 8.152 -0.952 -12.775 1.00 0.00 H new ATOM 0 HH21 ARG A 564 6.443 -2.345 -15.489 1.00 0.00 H new ATOM 0 HH22 ARG A 564 7.608 -1.125 -14.961 1.00 0.00 H new ATOM 1230 N PHE A 565 3.483 -1.764 -8.918 1.00 0.00 N ATOM 1231 CA PHE A 565 2.651 -0.613 -8.585 1.00 0.00 C ATOM 1232 C PHE A 565 2.698 -0.336 -7.086 1.00 0.00 C ATOM 1233 O PHE A 565 2.644 0.816 -6.655 1.00 0.00 O ATOM 1234 CB PHE A 565 1.204 -0.873 -9.013 1.00 0.00 C ATOM 1235 CG PHE A 565 1.077 -0.689 -10.507 1.00 0.00 C ATOM 1236 CD1 PHE A 565 1.174 0.593 -11.064 1.00 0.00 C ATOM 1237 CD2 PHE A 565 0.862 -1.797 -11.335 1.00 0.00 C ATOM 1238 CE1 PHE A 565 1.057 0.765 -12.447 1.00 0.00 C ATOM 1239 CE2 PHE A 565 0.744 -1.624 -12.719 1.00 0.00 C ATOM 1240 CZ PHE A 565 0.841 -0.343 -13.276 1.00 0.00 C ATOM 0 H PHE A 565 2.980 -2.545 -9.339 1.00 0.00 H new ATOM 0 HA PHE A 565 3.036 0.257 -9.117 1.00 0.00 H new ATOM 0 HB2 PHE A 565 0.908 -1.884 -8.734 1.00 0.00 H new ATOM 0 HB3 PHE A 565 0.532 -0.190 -8.494 1.00 0.00 H new ATOM 0 HD1 PHE A 565 1.339 1.448 -10.425 1.00 0.00 H new ATOM 0 HD2 PHE A 565 0.787 -2.785 -10.906 1.00 0.00 H new ATOM 0 HE1 PHE A 565 1.133 1.753 -12.876 1.00 0.00 H new ATOM 0 HE2 PHE A 565 0.578 -2.479 -13.358 1.00 0.00 H new ATOM 0 HZ PHE A 565 0.749 -0.209 -14.344 1.00 0.00 H new ATOM 1250 N LEU A 566 2.798 -1.400 -6.296 1.00 0.00 N ATOM 1251 CA LEU A 566 2.850 -1.258 -4.846 1.00 0.00 C ATOM 1252 C LEU A 566 4.138 -0.556 -4.425 1.00 0.00 C ATOM 1253 O LEU A 566 4.137 0.270 -3.511 1.00 0.00 O ATOM 1254 CB LEU A 566 2.769 -2.640 -4.186 1.00 0.00 C ATOM 1255 CG LEU A 566 2.228 -2.509 -2.756 1.00 0.00 C ATOM 1256 CD1 LEU A 566 0.711 -2.280 -2.784 1.00 0.00 C ATOM 1257 CD2 LEU A 566 2.532 -3.795 -1.981 1.00 0.00 C ATOM 0 H LEU A 566 2.844 -2.362 -6.632 1.00 0.00 H new ATOM 0 HA LEU A 566 2.002 -0.654 -4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 566 2.121 -3.293 -4.770 1.00 0.00 H new ATOM 0 HB3 LEU A 566 3.756 -3.102 -4.169 1.00 0.00 H new ATOM 0 HG LEU A 566 2.707 -1.660 -2.269 1.00 0.00 H new ATOM 0 HD11 LEU A 566 0.338 -2.189 -1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 566 0.491 -1.365 -3.334 1.00 0.00 H new ATOM 0 HD13 LEU A 566 0.225 -3.124 -3.274 1.00 0.00 H new ATOM 0 HD21 LEU A 566 2.149 -3.706 -0.964 1.00 0.00 H new ATOM 0 HD22 LEU A 566 2.054 -4.640 -2.476 1.00 0.00 H new ATOM 0 HD23 LEU A 566 3.610 -3.955 -1.950 1.00 0.00 H new ATOM 1269 N ALA A 567 5.235 -0.886 -5.100 1.00 0.00 N ATOM 1270 CA ALA A 567 6.523 -0.277 -4.792 1.00 0.00 C ATOM 1271 C ALA A 567 6.570 1.158 -5.306 1.00 0.00 C ATOM 1272 O ALA A 567 7.138 2.042 -4.663 1.00 0.00 O ATOM 1273 CB ALA A 567 7.652 -1.087 -5.433 1.00 0.00 C ATOM 0 H ALA A 567 5.258 -1.567 -5.859 1.00 0.00 H new ATOM 0 HA ALA A 567 6.652 -0.270 -3.710 1.00 0.00 H new ATOM 0 HB1 ALA A 567 8.611 -0.625 -5.198 1.00 0.00 H new ATOM 0 HB2 ALA A 567 7.635 -2.105 -5.044 1.00 0.00 H new ATOM 0 HB3 ALA A 567 7.516 -1.109 -6.514 1.00 0.00 H new ATOM 1279 N LEU A 568 5.968 1.381 -6.469 1.00 0.00 N ATOM 1280 CA LEU A 568 5.944 2.712 -7.065 1.00 0.00 C ATOM 1281 C LEU A 568 5.131 3.668 -6.199 1.00 0.00 C ATOM 1282 O LEU A 568 5.419 4.864 -6.138 1.00 0.00 O ATOM 1283 CB LEU A 568 5.333 2.642 -8.468 1.00 0.00 C ATOM 1284 CG LEU A 568 5.688 3.911 -9.256 1.00 0.00 C ATOM 1285 CD1 LEU A 568 7.050 3.739 -9.935 1.00 0.00 C ATOM 1286 CD2 LEU A 568 4.621 4.162 -10.325 1.00 0.00 C ATOM 0 H LEU A 568 5.493 0.662 -7.015 1.00 0.00 H new ATOM 0 HA LEU A 568 6.967 3.082 -7.133 1.00 0.00 H new ATOM 0 HB2 LEU A 568 5.705 1.762 -8.993 1.00 0.00 H new ATOM 0 HB3 LEU A 568 4.250 2.538 -8.398 1.00 0.00 H new ATOM 0 HG LEU A 568 5.730 4.757 -8.570 1.00 0.00 H new ATOM 0 HD11 LEU A 568 7.295 4.643 -10.492 1.00 0.00 H new ATOM 0 HD12 LEU A 568 7.814 3.561 -9.178 1.00 0.00 H new ATOM 0 HD13 LEU A 568 7.011 2.891 -10.618 1.00 0.00 H new ATOM 0 HD21 LEU A 568 4.872 5.063 -10.885 1.00 0.00 H new ATOM 0 HD22 LEU A 568 4.580 3.311 -11.005 1.00 0.00 H new ATOM 0 HD23 LEU A 568 3.650 4.291 -9.847 1.00 0.00 H new ATOM 1298 N ALA A 569 4.115 3.134 -5.528 1.00 0.00 N ATOM 1299 CA ALA A 569 3.268 3.949 -4.665 1.00 0.00 C ATOM 1300 C ALA A 569 4.038 4.389 -3.424 1.00 0.00 C ATOM 1301 O ALA A 569 3.991 5.554 -3.032 1.00 0.00 O ATOM 1302 CB ALA A 569 2.031 3.153 -4.244 1.00 0.00 C ATOM 0 H ALA A 569 3.860 2.147 -5.565 1.00 0.00 H new ATOM 0 HA ALA A 569 2.958 4.834 -5.221 1.00 0.00 H new ATOM 0 HB1 ALA A 569 1.404 3.769 -3.600 1.00 0.00 H new ATOM 0 HB2 ALA A 569 1.466 2.863 -5.130 1.00 0.00 H new ATOM 0 HB3 ALA A 569 2.340 2.259 -3.702 1.00 0.00 H new ATOM 1308 N LEU A 570 4.744 3.445 -2.810 1.00 0.00 N ATOM 1309 CA LEU A 570 5.520 3.740 -1.610 1.00 0.00 C ATOM 1310 C LEU A 570 6.672 4.690 -1.933 1.00 0.00 C ATOM 1311 O LEU A 570 7.237 5.321 -1.039 1.00 0.00 O ATOM 1312 CB LEU A 570 6.074 2.436 -1.018 1.00 0.00 C ATOM 1313 CG LEU A 570 6.191 2.559 0.508 1.00 0.00 C ATOM 1314 CD1 LEU A 570 4.855 2.195 1.160 1.00 0.00 C ATOM 1315 CD2 LEU A 570 7.276 1.604 1.015 1.00 0.00 C ATOM 0 H LEU A 570 4.795 2.475 -3.121 1.00 0.00 H new ATOM 0 HA LEU A 570 4.866 4.222 -0.883 1.00 0.00 H new ATOM 0 HB2 LEU A 570 5.419 1.604 -1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 570 7.051 2.218 -1.449 1.00 0.00 H new ATOM 0 HG LEU A 570 6.453 3.585 0.766 1.00 0.00 H new ATOM 0 HD11 LEU A 570 4.943 2.284 2.243 1.00 0.00 H new ATOM 0 HD12 LEU A 570 4.079 2.872 0.802 1.00 0.00 H new ATOM 0 HD13 LEU A 570 4.591 1.170 0.900 1.00 0.00 H new ATOM 0 HD21 LEU A 570 7.360 1.691 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 570 7.011 0.580 0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 570 8.230 1.861 0.556 1.00 0.00 H new ATOM 1327 N GLY A 571 7.018 4.784 -3.214 1.00 0.00 N ATOM 1328 CA GLY A 571 8.108 5.655 -3.641 1.00 0.00 C ATOM 1329 C GLY A 571 7.626 7.089 -3.832 1.00 0.00 C ATOM 1330 O GLY A 571 8.132 8.015 -3.198 1.00 0.00 O ATOM 0 H GLY A 571 6.563 4.272 -3.969 1.00 0.00 H new ATOM 0 HA2 GLY A 571 8.906 5.633 -2.899 1.00 0.00 H new ATOM 0 HA3 GLY A 571 8.530 5.283 -4.575 1.00 0.00 H new ATOM 1334 N ILE A 572 6.648 7.267 -4.715 1.00 0.00 N ATOM 1335 CA ILE A 572 6.109 8.596 -4.987 1.00 0.00 C ATOM 1336 C ILE A 572 5.416 9.163 -3.751 1.00 0.00 C ATOM 1337 O ILE A 572 5.303 10.379 -3.596 1.00 0.00 O ATOM 1338 CB ILE A 572 5.115 8.525 -6.146 1.00 0.00 C ATOM 1339 CG1 ILE A 572 4.669 9.939 -6.525 1.00 0.00 C ATOM 1340 CG2 ILE A 572 3.896 7.702 -5.724 1.00 0.00 C ATOM 1341 CD1 ILE A 572 3.788 9.878 -7.774 1.00 0.00 C ATOM 0 H ILE A 572 6.215 6.515 -5.251 1.00 0.00 H new ATOM 0 HA ILE A 572 6.936 9.254 -5.255 1.00 0.00 H new ATOM 0 HB ILE A 572 5.593 8.053 -7.004 1.00 0.00 H new ATOM 0 HG12 ILE A 572 4.118 10.392 -5.700 1.00 0.00 H new ATOM 0 HG13 ILE A 572 5.539 10.569 -6.711 1.00 0.00 H new ATOM 0 HG21 ILE A 572 3.187 7.651 -6.551 1.00 0.00 H new ATOM 0 HG22 ILE A 572 4.213 6.694 -5.455 1.00 0.00 H new ATOM 0 HG23 ILE A 572 3.418 8.173 -4.865 1.00 0.00 H new ATOM 0 HD11 ILE A 572 3.470 10.885 -8.044 1.00 0.00 H new ATOM 0 HD12 ILE A 572 4.354 9.443 -8.598 1.00 0.00 H new ATOM 0 HD13 ILE A 572 2.911 9.263 -7.571 1.00 0.00 H new ATOM 1353 N LEU A 573 4.952 8.276 -2.877 1.00 0.00 N ATOM 1354 CA LEU A 573 4.269 8.703 -1.661 1.00 0.00 C ATOM 1355 C LEU A 573 5.047 9.824 -0.976 1.00 0.00 C ATOM 1356 O LEU A 573 4.492 10.880 -0.670 1.00 0.00 O ATOM 1357 CB LEU A 573 4.118 7.515 -0.704 1.00 0.00 C ATOM 1358 CG LEU A 573 3.559 7.989 0.642 1.00 0.00 C ATOM 1359 CD1 LEU A 573 2.274 8.793 0.416 1.00 0.00 C ATOM 1360 CD2 LEU A 573 3.249 6.773 1.517 1.00 0.00 C ATOM 0 H LEU A 573 5.035 7.265 -2.986 1.00 0.00 H new ATOM 0 HA LEU A 573 3.281 9.078 -1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 573 3.453 6.769 -1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 573 5.084 7.033 -0.556 1.00 0.00 H new ATOM 0 HG LEU A 573 4.297 8.621 1.137 1.00 0.00 H new ATOM 0 HD11 LEU A 573 1.881 9.128 1.376 1.00 0.00 H new ATOM 0 HD12 LEU A 573 2.492 9.659 -0.209 1.00 0.00 H new ATOM 0 HD13 LEU A 573 1.534 8.165 -0.080 1.00 0.00 H new ATOM 0 HD21 LEU A 573 2.851 7.106 2.475 1.00 0.00 H new ATOM 0 HD22 LEU A 573 2.512 6.144 1.017 1.00 0.00 H new ATOM 0 HD23 LEU A 573 4.162 6.201 1.682 1.00 0.00 H new ATOM 1372 N TYR A 574 6.334 9.588 -0.739 1.00 0.00 N ATOM 1373 CA TYR A 574 7.178 10.586 -0.089 1.00 0.00 C ATOM 1374 C TYR A 574 7.766 11.544 -1.119 1.00 0.00 C ATOM 1375 O TYR A 574 8.689 12.302 -0.819 1.00 0.00 O ATOM 1376 CB TYR A 574 8.312 9.894 0.670 1.00 0.00 C ATOM 1377 CG TYR A 574 7.770 8.680 1.387 1.00 0.00 C ATOM 1378 CD1 TYR A 574 6.889 8.839 2.462 1.00 0.00 C ATOM 1379 CD2 TYR A 574 8.148 7.395 0.976 1.00 0.00 C ATOM 1380 CE1 TYR A 574 6.387 7.715 3.128 1.00 0.00 C ATOM 1381 CE2 TYR A 574 7.646 6.271 1.642 1.00 0.00 C ATOM 1382 CZ TYR A 574 6.765 6.431 2.718 1.00 0.00 C ATOM 1383 OH TYR A 574 6.270 5.322 3.374 1.00 0.00 O ATOM 0 H TYR A 574 6.813 8.722 -0.985 1.00 0.00 H new ATOM 0 HA TYR A 574 6.564 11.154 0.610 1.00 0.00 H new ATOM 0 HB2 TYR A 574 9.100 9.599 -0.022 1.00 0.00 H new ATOM 0 HB3 TYR A 574 8.758 10.584 1.386 1.00 0.00 H new ATOM 0 HD1 TYR A 574 6.596 9.829 2.778 1.00 0.00 H new ATOM 0 HD2 TYR A 574 8.827 7.272 0.145 1.00 0.00 H new ATOM 0 HE1 TYR A 574 5.708 7.838 3.959 1.00 0.00 H new ATOM 0 HE2 TYR A 574 7.938 5.281 1.326 1.00 0.00 H new ATOM 0 HH TYR A 574 6.632 4.510 2.962 1.00 0.00 H new ATOM 1393 N MET A 575 7.227 11.505 -2.333 1.00 0.00 N ATOM 1394 CA MET A 575 7.709 12.375 -3.401 1.00 0.00 C ATOM 1395 C MET A 575 9.213 12.201 -3.592 1.00 0.00 C ATOM 1396 O MET A 575 9.655 11.456 -4.466 1.00 0.00 O ATOM 1397 CB MET A 575 7.401 13.836 -3.065 1.00 0.00 C ATOM 1398 CG MET A 575 5.894 14.077 -3.167 1.00 0.00 C ATOM 1399 SD MET A 575 5.545 15.832 -2.894 1.00 0.00 S ATOM 1400 CE MET A 575 3.751 15.744 -3.116 1.00 0.00 C ATOM 0 H MET A 575 6.462 10.886 -2.601 1.00 0.00 H new ATOM 0 HA MET A 575 7.201 12.101 -4.326 1.00 0.00 H new ATOM 0 HB2 MET A 575 7.750 14.070 -2.059 1.00 0.00 H new ATOM 0 HB3 MET A 575 7.933 14.497 -3.749 1.00 0.00 H new ATOM 0 HG2 MET A 575 5.531 13.771 -4.148 1.00 0.00 H new ATOM 0 HG3 MET A 575 5.367 13.471 -2.430 1.00 0.00 H new ATOM 0 HE1 MET A 575 3.319 16.737 -2.988 1.00 0.00 H new ATOM 0 HE2 MET A 575 3.526 15.376 -4.117 1.00 0.00 H new ATOM 0 HE3 MET A 575 3.326 15.066 -2.376 1.00 0.00 H new ATOM 1410 N GLY A 576 9.992 12.894 -2.768 1.00 0.00 N ATOM 1411 CA GLY A 576 11.446 12.810 -2.853 1.00 0.00 C ATOM 1412 C GLY A 576 12.089 13.191 -1.525 1.00 0.00 C ATOM 1413 O GLY A 576 12.537 14.323 -1.343 1.00 0.00 O ATOM 0 H GLY A 576 9.644 13.516 -2.038 1.00 0.00 H new ATOM 0 HA2 GLY A 576 11.741 11.797 -3.127 1.00 0.00 H new ATOM 0 HA3 GLY A 576 11.808 13.472 -3.640 1.00 0.00 H new ATOM 1417 N GLN A 577 12.132 12.238 -0.598 1.00 0.00 N ATOM 1418 CA GLN A 577 12.724 12.482 0.714 1.00 0.00 C ATOM 1419 C GLN A 577 13.393 11.217 1.243 1.00 0.00 C ATOM 1420 O GLN A 577 12.753 10.173 1.372 1.00 0.00 O ATOM 1421 CB GLN A 577 11.643 12.937 1.698 1.00 0.00 C ATOM 1422 CG GLN A 577 11.033 14.254 1.215 1.00 0.00 C ATOM 1423 CD GLN A 577 10.104 14.822 2.283 1.00 0.00 C ATOM 1424 OE1 GLN A 577 8.884 14.809 2.117 1.00 0.00 O ATOM 1425 NE2 GLN A 577 10.612 15.321 3.376 1.00 0.00 N ATOM 0 H GLN A 577 11.766 11.295 -0.730 1.00 0.00 H new ATOM 0 HA GLN A 577 13.477 13.264 0.612 1.00 0.00 H new ATOM 0 HB2 GLN A 577 10.869 12.175 1.782 1.00 0.00 H new ATOM 0 HB3 GLN A 577 12.072 13.066 2.692 1.00 0.00 H new ATOM 0 HG2 GLN A 577 11.824 14.970 0.991 1.00 0.00 H new ATOM 0 HG3 GLN A 577 10.480 14.090 0.290 1.00 0.00 H new ATOM 0 HE21 GLN A 577 11.623 15.330 3.511 1.00 0.00 H new ATOM 0 HE22 GLN A 577 9.998 15.702 4.096 1.00 0.00 H new ATOM 1434 N GLY A 578 14.682 11.318 1.547 1.00 0.00 N ATOM 1435 CA GLY A 578 15.428 10.174 2.061 1.00 0.00 C ATOM 1436 C GLY A 578 15.170 9.979 3.551 1.00 0.00 C ATOM 1437 O GLY A 578 15.109 8.850 4.036 1.00 0.00 O ATOM 0 H GLY A 578 15.229 12.173 1.448 1.00 0.00 H new ATOM 0 HA2 GLY A 578 15.141 9.274 1.518 1.00 0.00 H new ATOM 0 HA3 GLY A 578 16.494 10.323 1.889 1.00 0.00 H new ATOM 1441 N GLU A 579 15.023 11.086 4.272 1.00 0.00 N ATOM 1442 CA GLU A 579 14.775 11.024 5.707 1.00 0.00 C ATOM 1443 C GLU A 579 13.625 10.070 6.015 1.00 0.00 C ATOM 1444 O GLU A 579 13.758 9.171 6.846 1.00 0.00 O ATOM 1445 CB GLU A 579 14.438 12.419 6.239 1.00 0.00 C ATOM 1446 CG GLU A 579 15.484 13.420 5.747 1.00 0.00 C ATOM 1447 CD GLU A 579 15.358 14.729 6.520 1.00 0.00 C ATOM 1448 OE1 GLU A 579 14.240 15.103 6.834 1.00 0.00 O ATOM 1449 OE2 GLU A 579 16.381 15.337 6.786 1.00 0.00 O ATOM 0 H GLU A 579 15.071 12.030 3.889 1.00 0.00 H new ATOM 0 HA GLU A 579 15.677 10.655 6.195 1.00 0.00 H new ATOM 0 HB2 GLU A 579 13.446 12.718 5.901 1.00 0.00 H new ATOM 0 HB3 GLU A 579 14.414 12.408 7.329 1.00 0.00 H new ATOM 0 HG2 GLU A 579 16.484 13.007 5.877 1.00 0.00 H new ATOM 0 HG3 GLU A 579 15.351 13.603 4.681 1.00 0.00 H new ATOM 1456 N GLN A 580 12.497 10.273 5.343 1.00 0.00 N ATOM 1457 CA GLN A 580 11.331 9.426 5.556 1.00 0.00 C ATOM 1458 C GLN A 580 11.596 8.009 5.055 1.00 0.00 C ATOM 1459 O GLN A 580 11.331 7.033 5.757 1.00 0.00 O ATOM 1460 CB GLN A 580 10.119 10.010 4.826 1.00 0.00 C ATOM 1461 CG GLN A 580 9.714 11.330 5.486 1.00 0.00 C ATOM 1462 CD GLN A 580 8.653 12.031 4.643 1.00 0.00 C ATOM 1463 OE1 GLN A 580 8.227 13.137 4.975 1.00 0.00 O ATOM 1464 NE2 GLN A 580 8.201 11.451 3.566 1.00 0.00 N ATOM 0 H GLN A 580 12.366 11.011 4.651 1.00 0.00 H new ATOM 0 HA GLN A 580 11.126 9.387 6.626 1.00 0.00 H new ATOM 0 HB2 GLN A 580 10.358 10.175 3.775 1.00 0.00 H new ATOM 0 HB3 GLN A 580 9.288 9.305 4.857 1.00 0.00 H new ATOM 0 HG2 GLN A 580 9.328 11.142 6.488 1.00 0.00 H new ATOM 0 HG3 GLN A 580 10.587 11.974 5.596 1.00 0.00 H new ATOM 0 HE21 GLN A 580 8.556 10.534 3.293 1.00 0.00 H new ATOM 0 HE22 GLN A 580 7.493 11.914 2.996 1.00 0.00 H new ATOM 1473 N VAL A 581 12.120 7.905 3.838 1.00 0.00 N ATOM 1474 CA VAL A 581 12.415 6.601 3.255 1.00 0.00 C ATOM 1475 C VAL A 581 13.510 5.893 4.045 1.00 0.00 C ATOM 1476 O VAL A 581 13.630 4.669 3.997 1.00 0.00 O ATOM 1477 CB VAL A 581 12.859 6.767 1.801 1.00 0.00 C ATOM 1478 CG1 VAL A 581 13.230 5.402 1.220 1.00 0.00 C ATOM 1479 CG2 VAL A 581 11.714 7.373 0.985 1.00 0.00 C ATOM 0 H VAL A 581 12.347 8.700 3.241 1.00 0.00 H new ATOM 0 HA VAL A 581 11.509 5.996 3.292 1.00 0.00 H new ATOM 0 HB VAL A 581 13.726 7.427 1.760 1.00 0.00 H new ATOM 0 HG11 VAL A 581 13.546 5.521 0.184 1.00 0.00 H new ATOM 0 HG12 VAL A 581 14.045 4.969 1.800 1.00 0.00 H new ATOM 0 HG13 VAL A 581 12.364 4.741 1.261 1.00 0.00 H new ATOM 0 HG21 VAL A 581 12.029 7.492 -0.052 1.00 0.00 H new ATOM 0 HG22 VAL A 581 10.848 6.713 1.027 1.00 0.00 H new ATOM 0 HG23 VAL A 581 11.449 8.346 1.397 1.00 0.00 H new ATOM 1489 N ASP A 582 14.308 6.669 4.772 1.00 0.00 N ATOM 1490 CA ASP A 582 15.390 6.101 5.568 1.00 0.00 C ATOM 1491 C ASP A 582 14.834 5.374 6.788 1.00 0.00 C ATOM 1492 O ASP A 582 15.259 4.263 7.108 1.00 0.00 O ATOM 1493 CB ASP A 582 16.343 7.209 6.021 1.00 0.00 C ATOM 1494 CG ASP A 582 17.427 6.627 6.923 1.00 0.00 C ATOM 1495 OD1 ASP A 582 17.669 5.434 6.831 1.00 0.00 O ATOM 1496 OD2 ASP A 582 18.000 7.382 7.690 1.00 0.00 O ATOM 0 H ASP A 582 14.227 7.684 4.826 1.00 0.00 H new ATOM 0 HA ASP A 582 15.933 5.386 4.950 1.00 0.00 H new ATOM 0 HB2 ASP A 582 16.798 7.686 5.153 1.00 0.00 H new ATOM 0 HB3 ASP A 582 15.789 7.981 6.555 1.00 0.00 H new ATOM 1501 N ASP A 583 13.883 6.007 7.466 1.00 0.00 N ATOM 1502 CA ASP A 583 13.276 5.411 8.652 1.00 0.00 C ATOM 1503 C ASP A 583 12.447 4.186 8.274 1.00 0.00 C ATOM 1504 O ASP A 583 12.503 3.157 8.947 1.00 0.00 O ATOM 1505 CB ASP A 583 12.383 6.437 9.352 1.00 0.00 C ATOM 1506 CG ASP A 583 13.232 7.571 9.914 1.00 0.00 C ATOM 1507 OD1 ASP A 583 13.758 7.410 11.004 1.00 0.00 O ATOM 1508 OD2 ASP A 583 13.346 8.587 9.246 1.00 0.00 O ATOM 0 H ASP A 583 13.517 6.926 7.218 1.00 0.00 H new ATOM 0 HA ASP A 583 14.073 5.101 9.328 1.00 0.00 H new ATOM 0 HB2 ASP A 583 11.651 6.834 8.649 1.00 0.00 H new ATOM 0 HB3 ASP A 583 11.825 5.957 10.156 1.00 0.00 H new ATOM 1513 N VAL A 584 11.679 4.307 7.197 1.00 0.00 N ATOM 1514 CA VAL A 584 10.840 3.204 6.741 1.00 0.00 C ATOM 1515 C VAL A 584 11.687 1.967 6.456 1.00 0.00 C ATOM 1516 O VAL A 584 11.385 0.874 6.935 1.00 0.00 O ATOM 1517 CB VAL A 584 10.085 3.612 5.476 1.00 0.00 C ATOM 1518 CG1 VAL A 584 9.279 2.420 4.954 1.00 0.00 C ATOM 1519 CG2 VAL A 584 9.133 4.765 5.802 1.00 0.00 C ATOM 0 H VAL A 584 11.620 5.151 6.627 1.00 0.00 H new ATOM 0 HA VAL A 584 10.126 2.966 7.529 1.00 0.00 H new ATOM 0 HB VAL A 584 10.797 3.930 4.715 1.00 0.00 H new ATOM 0 HG11 VAL A 584 8.741 2.712 4.052 1.00 0.00 H new ATOM 0 HG12 VAL A 584 9.955 1.597 4.723 1.00 0.00 H new ATOM 0 HG13 VAL A 584 8.566 2.102 5.715 1.00 0.00 H new ATOM 0 HG21 VAL A 584 8.594 5.057 4.901 1.00 0.00 H new ATOM 0 HG22 VAL A 584 8.421 4.445 6.563 1.00 0.00 H new ATOM 0 HG23 VAL A 584 9.705 5.615 6.174 1.00 0.00 H new ATOM 1529 N LEU A 585 12.747 2.145 5.675 1.00 0.00 N ATOM 1530 CA LEU A 585 13.628 1.032 5.334 1.00 0.00 C ATOM 1531 C LEU A 585 14.142 0.351 6.599 1.00 0.00 C ATOM 1532 O LEU A 585 14.059 -0.870 6.733 1.00 0.00 O ATOM 1533 CB LEU A 585 14.812 1.534 4.504 1.00 0.00 C ATOM 1534 CG LEU A 585 14.349 1.858 3.079 1.00 0.00 C ATOM 1535 CD1 LEU A 585 15.473 2.578 2.331 1.00 0.00 C ATOM 1536 CD2 LEU A 585 13.988 0.562 2.335 1.00 0.00 C ATOM 0 H LEU A 585 13.016 3.041 5.269 1.00 0.00 H new ATOM 0 HA LEU A 585 13.059 0.309 4.750 1.00 0.00 H new ATOM 0 HB2 LEU A 585 15.242 2.422 4.967 1.00 0.00 H new ATOM 0 HB3 LEU A 585 15.596 0.777 4.478 1.00 0.00 H new ATOM 0 HG LEU A 585 13.469 2.499 3.126 1.00 0.00 H new ATOM 0 HD11 LEU A 585 15.146 2.809 1.317 1.00 0.00 H new ATOM 0 HD12 LEU A 585 15.722 3.503 2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 585 16.353 1.936 2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 585 13.660 0.802 1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 585 14.863 -0.087 2.288 1.00 0.00 H new ATOM 0 HD23 LEU A 585 13.185 0.050 2.865 1.00 0.00 H new ATOM 1548 N GLU A 586 14.672 1.146 7.523 1.00 0.00 N ATOM 1549 CA GLU A 586 15.195 0.601 8.772 1.00 0.00 C ATOM 1550 C GLU A 586 14.226 -0.426 9.352 1.00 0.00 C ATOM 1551 O GLU A 586 14.637 -1.495 9.804 1.00 0.00 O ATOM 1552 CB GLU A 586 15.419 1.728 9.786 1.00 0.00 C ATOM 1553 CG GLU A 586 16.698 2.490 9.432 1.00 0.00 C ATOM 1554 CD GLU A 586 16.898 3.651 10.401 1.00 0.00 C ATOM 1555 OE1 GLU A 586 16.112 4.582 10.351 1.00 0.00 O ATOM 1556 OE2 GLU A 586 17.837 3.592 11.178 1.00 0.00 O ATOM 0 H GLU A 586 14.751 2.159 7.433 1.00 0.00 H new ATOM 0 HA GLU A 586 16.146 0.111 8.563 1.00 0.00 H new ATOM 0 HB2 GLU A 586 14.567 2.407 9.784 1.00 0.00 H new ATOM 0 HB3 GLU A 586 15.496 1.316 10.792 1.00 0.00 H new ATOM 0 HG2 GLU A 586 17.555 1.818 9.475 1.00 0.00 H new ATOM 0 HG3 GLU A 586 16.637 2.865 8.410 1.00 0.00 H new ATOM 1563 N THR A 587 12.939 -0.095 9.330 1.00 0.00 N ATOM 1564 CA THR A 587 11.920 -0.999 9.853 1.00 0.00 C ATOM 1565 C THR A 587 11.951 -2.325 9.101 1.00 0.00 C ATOM 1566 O THR A 587 11.887 -3.396 9.707 1.00 0.00 O ATOM 1567 CB THR A 587 10.536 -0.362 9.712 1.00 0.00 C ATOM 1568 OG1 THR A 587 10.592 0.988 10.154 1.00 0.00 O ATOM 1569 CG2 THR A 587 9.526 -1.138 10.560 1.00 0.00 C ATOM 0 H THR A 587 12.579 0.784 8.959 1.00 0.00 H new ATOM 0 HA THR A 587 12.128 -1.185 10.907 1.00 0.00 H new ATOM 0 HB THR A 587 10.226 -0.391 8.667 1.00 0.00 H new ATOM 0 HG1 THR A 587 9.707 1.399 10.063 1.00 0.00 H new ATOM 0 HG21 THR A 587 8.541 -0.683 10.459 1.00 0.00 H new ATOM 0 HG22 THR A 587 9.485 -2.173 10.220 1.00 0.00 H new ATOM 0 HG23 THR A 587 9.832 -1.111 11.606 1.00 0.00 H new ATOM 1577 N ILE A 588 12.053 -2.247 7.779 1.00 0.00 N ATOM 1578 CA ILE A 588 12.097 -3.447 6.952 1.00 0.00 C ATOM 1579 C ILE A 588 13.387 -4.219 7.206 1.00 0.00 C ATOM 1580 O ILE A 588 13.392 -5.450 7.223 1.00 0.00 O ATOM 1581 CB ILE A 588 12.006 -3.068 5.473 1.00 0.00 C ATOM 1582 CG1 ILE A 588 10.660 -2.390 5.206 1.00 0.00 C ATOM 1583 CG2 ILE A 588 12.121 -4.329 4.614 1.00 0.00 C ATOM 1584 CD1 ILE A 588 10.660 -1.788 3.799 1.00 0.00 C ATOM 0 H ILE A 588 12.107 -1.371 7.259 1.00 0.00 H new ATOM 0 HA ILE A 588 11.249 -4.080 7.213 1.00 0.00 H new ATOM 0 HB ILE A 588 12.816 -2.384 5.222 1.00 0.00 H new ATOM 0 HG12 ILE A 588 9.851 -3.114 5.303 1.00 0.00 H new ATOM 0 HG13 ILE A 588 10.481 -1.610 5.946 1.00 0.00 H new ATOM 0 HG21 ILE A 588 12.056 -4.058 3.560 1.00 0.00 H new ATOM 0 HG22 ILE A 588 13.078 -4.814 4.806 1.00 0.00 H new ATOM 0 HG23 ILE A 588 11.311 -5.014 4.863 1.00 0.00 H new ATOM 0 HD11 ILE A 588 9.701 -1.305 3.610 1.00 0.00 H new ATOM 0 HD12 ILE A 588 11.459 -1.051 3.719 1.00 0.00 H new ATOM 0 HD13 ILE A 588 10.820 -2.578 3.065 1.00 0.00 H new ATOM 1596 N SER A 589 14.479 -3.487 7.405 1.00 0.00 N ATOM 1597 CA SER A 589 15.770 -4.115 7.660 1.00 0.00 C ATOM 1598 C SER A 589 15.651 -5.131 8.791 1.00 0.00 C ATOM 1599 O SER A 589 16.267 -6.195 8.750 1.00 0.00 O ATOM 1600 CB SER A 589 16.804 -3.053 8.033 1.00 0.00 C ATOM 1601 OG SER A 589 18.089 -3.657 8.112 1.00 0.00 O ATOM 0 H SER A 589 14.496 -2.467 7.395 1.00 0.00 H new ATOM 0 HA SER A 589 16.091 -4.628 6.754 1.00 0.00 H new ATOM 0 HB2 SER A 589 16.809 -2.256 7.289 1.00 0.00 H new ATOM 0 HB3 SER A 589 16.545 -2.596 8.988 1.00 0.00 H new ATOM 0 HG SER A 589 18.755 -2.979 8.350 1.00 0.00 H new ATOM 1607 N ALA A 590 14.852 -4.793 9.799 1.00 0.00 N ATOM 1608 CA ALA A 590 14.657 -5.684 10.936 1.00 0.00 C ATOM 1609 C ALA A 590 13.782 -6.870 10.541 1.00 0.00 C ATOM 1610 O ALA A 590 14.049 -8.006 10.930 1.00 0.00 O ATOM 1611 CB ALA A 590 14.003 -4.921 12.090 1.00 0.00 C ATOM 0 H ALA A 590 14.334 -3.916 9.851 1.00 0.00 H new ATOM 0 HA ALA A 590 15.630 -6.057 11.256 1.00 0.00 H new ATOM 0 HB1 ALA A 590 13.860 -5.593 12.936 1.00 0.00 H new ATOM 0 HB2 ALA A 590 14.645 -4.093 12.389 1.00 0.00 H new ATOM 0 HB3 ALA A 590 13.037 -4.533 11.768 1.00 0.00 H new ATOM 1617 N ILE A 591 12.738 -6.595 9.761 1.00 0.00 N ATOM 1618 CA ILE A 591 11.827 -7.646 9.311 1.00 0.00 C ATOM 1619 C ILE A 591 11.703 -7.626 7.791 1.00 0.00 C ATOM 1620 O ILE A 591 11.160 -6.683 7.215 1.00 0.00 O ATOM 1621 CB ILE A 591 10.442 -7.448 9.936 1.00 0.00 C ATOM 1622 CG1 ILE A 591 10.577 -7.293 11.460 1.00 0.00 C ATOM 1623 CG2 ILE A 591 9.568 -8.666 9.621 1.00 0.00 C ATOM 1624 CD1 ILE A 591 10.703 -5.810 11.826 1.00 0.00 C ATOM 0 H ILE A 591 12.503 -5.660 9.429 1.00 0.00 H new ATOM 0 HA ILE A 591 12.231 -8.608 9.625 1.00 0.00 H new ATOM 0 HB ILE A 591 9.983 -6.549 9.524 1.00 0.00 H new ATOM 0 HG12 ILE A 591 9.709 -7.726 11.956 1.00 0.00 H new ATOM 0 HG13 ILE A 591 11.452 -7.839 11.813 1.00 0.00 H new ATOM 0 HG21 ILE A 591 8.581 -8.530 10.064 1.00 0.00 H new ATOM 0 HG22 ILE A 591 9.469 -8.774 8.541 1.00 0.00 H new ATOM 0 HG23 ILE A 591 10.031 -9.562 10.034 1.00 0.00 H new ATOM 0 HD11 ILE A 591 10.798 -5.709 12.907 1.00 0.00 H new ATOM 0 HD12 ILE A 591 11.585 -5.390 11.343 1.00 0.00 H new ATOM 0 HD13 ILE A 591 9.815 -5.275 11.488 1.00 0.00 H new ATOM 1636 N GLU A 592 12.212 -8.672 7.145 1.00 0.00 N ATOM 1637 CA GLU A 592 12.154 -8.761 5.690 1.00 0.00 C ATOM 1638 C GLU A 592 12.229 -10.216 5.237 1.00 0.00 C ATOM 1639 O GLU A 592 12.976 -11.015 5.801 1.00 0.00 O ATOM 1640 CB GLU A 592 13.312 -7.974 5.074 1.00 0.00 C ATOM 1641 CG GLU A 592 14.641 -8.594 5.512 1.00 0.00 C ATOM 1642 CD GLU A 592 15.803 -7.722 5.048 1.00 0.00 C ATOM 1643 OE1 GLU A 592 16.043 -6.705 5.676 1.00 0.00 O ATOM 1644 OE2 GLU A 592 16.437 -8.085 4.071 1.00 0.00 O ATOM 0 H GLU A 592 12.665 -9.463 7.602 1.00 0.00 H new ATOM 0 HA GLU A 592 11.207 -8.338 5.357 1.00 0.00 H new ATOM 0 HB2 GLU A 592 13.235 -7.984 3.987 1.00 0.00 H new ATOM 0 HB3 GLU A 592 13.264 -6.931 5.387 1.00 0.00 H new ATOM 0 HG2 GLU A 592 14.664 -8.697 6.597 1.00 0.00 H new ATOM 0 HG3 GLU A 592 14.739 -9.596 5.095 1.00 0.00 H new ATOM 1651 N HIS A 593 11.451 -10.551 4.212 1.00 0.00 N ATOM 1652 CA HIS A 593 11.438 -11.912 3.686 1.00 0.00 C ATOM 1653 C HIS A 593 12.563 -12.092 2.666 1.00 0.00 C ATOM 1654 O HIS A 593 13.048 -11.119 2.089 1.00 0.00 O ATOM 1655 CB HIS A 593 10.082 -12.199 3.024 1.00 0.00 C ATOM 1656 CG HIS A 593 9.178 -12.904 4.001 1.00 0.00 C ATOM 1657 ND1 HIS A 593 9.071 -12.512 5.325 1.00 0.00 N ATOM 1658 CD2 HIS A 593 8.334 -13.977 3.858 1.00 0.00 C ATOM 1659 CE1 HIS A 593 8.191 -13.336 5.923 1.00 0.00 C ATOM 1660 NE2 HIS A 593 7.713 -14.248 5.074 1.00 0.00 N ATOM 0 H HIS A 593 10.825 -9.904 3.732 1.00 0.00 H new ATOM 0 HA HIS A 593 11.592 -12.612 4.507 1.00 0.00 H new ATOM 0 HB2 HIS A 593 9.622 -11.267 2.696 1.00 0.00 H new ATOM 0 HB3 HIS A 593 10.223 -12.814 2.136 1.00 0.00 H new ATOM 0 HD2 HIS A 593 8.176 -14.527 2.942 1.00 0.00 H new ATOM 0 HE1 HIS A 593 7.906 -13.268 6.963 1.00 0.00 H new ATOM 0 HE2 HIS A 593 7.037 -14.986 5.273 1.00 0.00 H new ATOM 1668 N PRO A 594 12.985 -13.310 2.439 1.00 0.00 N ATOM 1669 CA PRO A 594 14.074 -13.615 1.472 1.00 0.00 C ATOM 1670 C PRO A 594 13.915 -12.833 0.169 1.00 0.00 C ATOM 1671 O PRO A 594 14.897 -12.375 -0.415 1.00 0.00 O ATOM 1672 CB PRO A 594 13.960 -15.133 1.227 1.00 0.00 C ATOM 1673 CG PRO A 594 12.809 -15.624 2.060 1.00 0.00 C ATOM 1674 CD PRO A 594 12.476 -14.529 3.073 1.00 0.00 C ATOM 0 HA PRO A 594 15.051 -13.328 1.860 1.00 0.00 H new ATOM 0 HB2 PRO A 594 13.789 -15.342 0.171 1.00 0.00 H new ATOM 0 HB3 PRO A 594 14.883 -15.640 1.507 1.00 0.00 H new ATOM 0 HG2 PRO A 594 11.945 -15.840 1.431 1.00 0.00 H new ATOM 0 HG3 PRO A 594 13.072 -16.551 2.570 1.00 0.00 H new ATOM 0 HD2 PRO A 594 11.404 -14.467 3.259 1.00 0.00 H new ATOM 0 HD3 PRO A 594 12.956 -14.712 4.034 1.00 0.00 H new ATOM 1682 N MET A 595 12.672 -12.685 -0.279 1.00 0.00 N ATOM 1683 CA MET A 595 12.397 -11.956 -1.513 1.00 0.00 C ATOM 1684 C MET A 595 12.368 -10.452 -1.255 1.00 0.00 C ATOM 1685 O MET A 595 12.878 -9.666 -2.053 1.00 0.00 O ATOM 1686 CB MET A 595 11.051 -12.401 -2.091 1.00 0.00 C ATOM 1687 CG MET A 595 11.116 -13.887 -2.450 1.00 0.00 C ATOM 1688 SD MET A 595 11.062 -14.878 -0.936 1.00 0.00 S ATOM 1689 CE MET A 595 10.242 -16.328 -1.642 1.00 0.00 C ATOM 0 H MET A 595 11.845 -13.057 0.189 1.00 0.00 H new ATOM 0 HA MET A 595 13.192 -12.175 -2.226 1.00 0.00 H new ATOM 0 HB2 MET A 595 10.256 -12.226 -1.366 1.00 0.00 H new ATOM 0 HB3 MET A 595 10.811 -11.812 -2.976 1.00 0.00 H new ATOM 0 HG2 MET A 595 10.282 -14.152 -3.100 1.00 0.00 H new ATOM 0 HG3 MET A 595 12.031 -14.099 -3.003 1.00 0.00 H new ATOM 0 HE1 MET A 595 10.105 -17.082 -0.867 1.00 0.00 H new ATOM 0 HE2 MET A 595 9.270 -16.038 -2.041 1.00 0.00 H new ATOM 0 HE3 MET A 595 10.856 -16.739 -2.444 1.00 0.00 H new ATOM 1699 N THR A 596 11.766 -10.060 -0.136 1.00 0.00 N ATOM 1700 CA THR A 596 11.676 -8.647 0.218 1.00 0.00 C ATOM 1701 C THR A 596 13.012 -7.947 -0.011 1.00 0.00 C ATOM 1702 O THR A 596 13.054 -6.756 -0.320 1.00 0.00 O ATOM 1703 CB THR A 596 11.268 -8.502 1.686 1.00 0.00 C ATOM 1704 OG1 THR A 596 9.969 -9.050 1.871 1.00 0.00 O ATOM 1705 CG2 THR A 596 11.258 -7.022 2.072 1.00 0.00 C ATOM 0 H THR A 596 11.336 -10.695 0.537 1.00 0.00 H new ATOM 0 HA THR A 596 10.923 -8.182 -0.418 1.00 0.00 H new ATOM 0 HB THR A 596 11.981 -9.034 2.315 1.00 0.00 H new ATOM 0 HG1 THR A 596 9.577 -8.691 2.694 1.00 0.00 H new ATOM 0 HG21 THR A 596 10.967 -6.921 3.118 1.00 0.00 H new ATOM 0 HG22 THR A 596 12.254 -6.602 1.930 1.00 0.00 H new ATOM 0 HG23 THR A 596 10.546 -6.487 1.444 1.00 0.00 H new ATOM 1713 N SER A 597 14.101 -8.694 0.142 1.00 0.00 N ATOM 1714 CA SER A 597 15.433 -8.134 -0.049 1.00 0.00 C ATOM 1715 C SER A 597 15.510 -7.364 -1.365 1.00 0.00 C ATOM 1716 O SER A 597 16.112 -6.292 -1.433 1.00 0.00 O ATOM 1717 CB SER A 597 16.475 -9.253 -0.051 1.00 0.00 C ATOM 1718 OG SER A 597 17.708 -8.746 -0.543 1.00 0.00 O ATOM 0 H SER A 597 14.087 -9.682 0.396 1.00 0.00 H new ATOM 0 HA SER A 597 15.637 -7.448 0.773 1.00 0.00 H new ATOM 0 HB2 SER A 597 16.606 -9.645 0.958 1.00 0.00 H new ATOM 0 HB3 SER A 597 16.135 -10.081 -0.673 1.00 0.00 H new ATOM 0 HG SER A 597 18.378 -9.461 -0.544 1.00 0.00 H new ATOM 1724 N ALA A 598 14.899 -7.917 -2.407 1.00 0.00 N ATOM 1725 CA ALA A 598 14.908 -7.274 -3.715 1.00 0.00 C ATOM 1726 C ALA A 598 14.241 -5.903 -3.644 1.00 0.00 C ATOM 1727 O ALA A 598 14.658 -4.964 -4.322 1.00 0.00 O ATOM 1728 CB ALA A 598 14.171 -8.147 -4.733 1.00 0.00 C ATOM 0 H ALA A 598 14.395 -8.803 -2.372 1.00 0.00 H new ATOM 0 HA ALA A 598 15.945 -7.147 -4.027 1.00 0.00 H new ATOM 0 HB1 ALA A 598 14.183 -7.659 -5.707 1.00 0.00 H new ATOM 0 HB2 ALA A 598 14.665 -9.116 -4.807 1.00 0.00 H new ATOM 0 HB3 ALA A 598 13.139 -8.289 -4.411 1.00 0.00 H new ATOM 1734 N ILE A 599 13.204 -5.796 -2.821 1.00 0.00 N ATOM 1735 CA ILE A 599 12.485 -4.536 -2.672 1.00 0.00 C ATOM 1736 C ILE A 599 13.357 -3.500 -1.969 1.00 0.00 C ATOM 1737 O ILE A 599 13.412 -2.341 -2.380 1.00 0.00 O ATOM 1738 CB ILE A 599 11.204 -4.761 -1.865 1.00 0.00 C ATOM 1739 CG1 ILE A 599 10.416 -5.918 -2.482 1.00 0.00 C ATOM 1740 CG2 ILE A 599 10.351 -3.492 -1.893 1.00 0.00 C ATOM 1741 CD1 ILE A 599 9.155 -6.178 -1.653 1.00 0.00 C ATOM 0 H ILE A 599 12.844 -6.561 -2.250 1.00 0.00 H new ATOM 0 HA ILE A 599 12.230 -4.164 -3.664 1.00 0.00 H new ATOM 0 HB ILE A 599 11.461 -5.001 -0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 599 10.145 -5.679 -3.510 1.00 0.00 H new ATOM 0 HG13 ILE A 599 11.034 -6.816 -2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 599 9.439 -3.654 -1.318 1.00 0.00 H new ATOM 0 HG22 ILE A 599 10.913 -2.666 -1.457 1.00 0.00 H new ATOM 0 HG23 ILE A 599 10.092 -3.250 -2.924 1.00 0.00 H new ATOM 0 HD11 ILE A 599 8.594 -7.002 -2.093 1.00 0.00 H new ATOM 0 HD12 ILE A 599 9.437 -6.435 -0.632 1.00 0.00 H new ATOM 0 HD13 ILE A 599 8.535 -5.282 -1.643 1.00 0.00 H new ATOM 1753 N GLU A 600 14.036 -3.924 -0.909 1.00 0.00 N ATOM 1754 CA GLU A 600 14.901 -3.022 -0.157 1.00 0.00 C ATOM 1755 C GLU A 600 15.894 -2.330 -1.086 1.00 0.00 C ATOM 1756 O GLU A 600 16.175 -1.140 -0.935 1.00 0.00 O ATOM 1757 CB GLU A 600 15.661 -3.801 0.916 1.00 0.00 C ATOM 1758 CG GLU A 600 14.669 -4.377 1.928 1.00 0.00 C ATOM 1759 CD GLU A 600 15.420 -5.102 3.039 1.00 0.00 C ATOM 1760 OE1 GLU A 600 15.944 -6.170 2.774 1.00 0.00 O ATOM 1761 OE2 GLU A 600 15.458 -4.579 4.141 1.00 0.00 O ATOM 0 H GLU A 600 14.005 -4.879 -0.553 1.00 0.00 H new ATOM 0 HA GLU A 600 14.278 -2.264 0.317 1.00 0.00 H new ATOM 0 HB2 GLU A 600 16.237 -4.605 0.457 1.00 0.00 H new ATOM 0 HB3 GLU A 600 16.372 -3.147 1.420 1.00 0.00 H new ATOM 0 HG2 GLU A 600 14.062 -3.577 2.351 1.00 0.00 H new ATOM 0 HG3 GLU A 600 13.987 -5.066 1.430 1.00 0.00 H new ATOM 1768 N VAL A 601 16.422 -3.082 -2.047 1.00 0.00 N ATOM 1769 CA VAL A 601 17.383 -2.528 -2.994 1.00 0.00 C ATOM 1770 C VAL A 601 16.673 -1.684 -4.047 1.00 0.00 C ATOM 1771 O VAL A 601 17.267 -0.780 -4.635 1.00 0.00 O ATOM 1772 CB VAL A 601 18.152 -3.660 -3.678 1.00 0.00 C ATOM 1773 CG1 VAL A 601 19.198 -3.068 -4.625 1.00 0.00 C ATOM 1774 CG2 VAL A 601 18.851 -4.514 -2.618 1.00 0.00 C ATOM 0 H VAL A 601 16.203 -4.068 -2.190 1.00 0.00 H new ATOM 0 HA VAL A 601 18.080 -1.893 -2.447 1.00 0.00 H new ATOM 0 HB VAL A 601 17.457 -4.279 -4.245 1.00 0.00 H new ATOM 0 HG11 VAL A 601 19.746 -3.875 -5.112 1.00 0.00 H new ATOM 0 HG12 VAL A 601 18.702 -2.459 -5.380 1.00 0.00 H new ATOM 0 HG13 VAL A 601 19.893 -2.448 -4.058 1.00 0.00 H new ATOM 0 HG21 VAL A 601 19.399 -5.321 -3.104 1.00 0.00 H new ATOM 0 HG22 VAL A 601 19.545 -3.894 -2.051 1.00 0.00 H new ATOM 0 HG23 VAL A 601 18.107 -4.936 -1.943 1.00 0.00 H new ATOM 1784 N LEU A 602 15.401 -1.986 -4.280 1.00 0.00 N ATOM 1785 CA LEU A 602 14.618 -1.247 -5.265 1.00 0.00 C ATOM 1786 C LEU A 602 14.294 0.151 -4.748 1.00 0.00 C ATOM 1787 O LEU A 602 14.812 1.146 -5.253 1.00 0.00 O ATOM 1788 CB LEU A 602 13.321 -2.002 -5.570 1.00 0.00 C ATOM 1789 CG LEU A 602 12.483 -1.222 -6.590 1.00 0.00 C ATOM 1790 CD1 LEU A 602 13.277 -1.041 -7.889 1.00 0.00 C ATOM 1791 CD2 LEU A 602 11.197 -2.001 -6.884 1.00 0.00 C ATOM 0 H LEU A 602 14.892 -2.731 -3.805 1.00 0.00 H new ATOM 0 HA LEU A 602 15.204 -1.154 -6.179 1.00 0.00 H new ATOM 0 HB2 LEU A 602 13.552 -2.993 -5.960 1.00 0.00 H new ATOM 0 HB3 LEU A 602 12.750 -2.145 -4.652 1.00 0.00 H new ATOM 0 HG LEU A 602 12.238 -0.241 -6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 602 12.675 -0.486 -8.609 1.00 0.00 H new ATOM 0 HD12 LEU A 602 14.194 -0.490 -7.681 1.00 0.00 H new ATOM 0 HD13 LEU A 602 13.527 -2.018 -8.302 1.00 0.00 H new ATOM 0 HD21 LEU A 602 10.596 -1.451 -7.609 1.00 0.00 H new ATOM 0 HD22 LEU A 602 11.450 -2.980 -7.290 1.00 0.00 H new ATOM 0 HD23 LEU A 602 10.629 -2.126 -5.962 1.00 0.00 H new ATOM 1803 N VAL A 603 13.431 0.215 -3.739 1.00 0.00 N ATOM 1804 CA VAL A 603 13.043 1.496 -3.160 1.00 0.00 C ATOM 1805 C VAL A 603 14.275 2.274 -2.708 1.00 0.00 C ATOM 1806 O VAL A 603 14.271 3.505 -2.693 1.00 0.00 O ATOM 1807 CB VAL A 603 12.115 1.268 -1.966 1.00 0.00 C ATOM 1808 CG1 VAL A 603 11.607 2.616 -1.449 1.00 0.00 C ATOM 1809 CG2 VAL A 603 10.925 0.410 -2.403 1.00 0.00 C ATOM 0 H VAL A 603 12.990 -0.598 -3.308 1.00 0.00 H new ATOM 0 HA VAL A 603 12.520 2.075 -3.921 1.00 0.00 H new ATOM 0 HB VAL A 603 12.662 0.757 -1.173 1.00 0.00 H new ATOM 0 HG11 VAL A 603 10.946 2.453 -0.598 1.00 0.00 H new ATOM 0 HG12 VAL A 603 12.453 3.229 -1.139 1.00 0.00 H new ATOM 0 HG13 VAL A 603 11.060 3.127 -2.241 1.00 0.00 H new ATOM 0 HG21 VAL A 603 10.263 0.247 -1.553 1.00 0.00 H new ATOM 0 HG22 VAL A 603 10.379 0.922 -3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 603 11.285 -0.550 -2.772 1.00 0.00 H new ATOM 1819 N GLY A 604 15.325 1.548 -2.342 1.00 0.00 N ATOM 1820 CA GLY A 604 16.559 2.181 -1.891 1.00 0.00 C ATOM 1821 C GLY A 604 17.150 3.063 -2.985 1.00 0.00 C ATOM 1822 O GLY A 604 17.304 4.272 -2.807 1.00 0.00 O ATOM 0 H GLY A 604 15.347 0.528 -2.348 1.00 0.00 H new ATOM 0 HA2 GLY A 604 16.361 2.780 -1.002 1.00 0.00 H new ATOM 0 HA3 GLY A 604 17.281 1.416 -1.605 1.00 0.00 H new ATOM 1826 N SER A 605 17.479 2.451 -4.118 1.00 0.00 N ATOM 1827 CA SER A 605 18.052 3.192 -5.236 1.00 0.00 C ATOM 1828 C SER A 605 17.194 4.408 -5.570 1.00 0.00 C ATOM 1829 O SER A 605 17.711 5.460 -5.943 1.00 0.00 O ATOM 1830 CB SER A 605 18.155 2.286 -6.464 1.00 0.00 C ATOM 1831 OG SER A 605 16.855 2.056 -6.989 1.00 0.00 O ATOM 0 H SER A 605 17.360 1.452 -4.286 1.00 0.00 H new ATOM 0 HA SER A 605 19.047 3.532 -4.950 1.00 0.00 H new ATOM 0 HB2 SER A 605 18.788 2.750 -7.220 1.00 0.00 H new ATOM 0 HB3 SER A 605 18.623 1.339 -6.193 1.00 0.00 H new ATOM 0 HG SER A 605 16.263 1.745 -6.272 1.00 0.00 H new ATOM 1837 N CYS A 606 15.881 4.255 -5.433 1.00 0.00 N ATOM 1838 CA CYS A 606 14.959 5.348 -5.723 1.00 0.00 C ATOM 1839 C CYS A 606 14.916 6.334 -4.559 1.00 0.00 C ATOM 1840 O CYS A 606 13.874 6.520 -3.930 1.00 0.00 O ATOM 1841 CB CYS A 606 13.556 4.793 -5.977 1.00 0.00 C ATOM 1842 SG CYS A 606 12.440 6.152 -6.410 1.00 0.00 S ATOM 0 H CYS A 606 15.434 3.392 -5.125 1.00 0.00 H new ATOM 0 HA CYS A 606 15.310 5.869 -6.614 1.00 0.00 H new ATOM 0 HB2 CYS A 606 13.584 4.060 -6.783 1.00 0.00 H new ATOM 0 HB3 CYS A 606 13.191 4.277 -5.089 1.00 0.00 H new ATOM 0 HG CYS A 606 12.589 7.123 -5.559 1.00 0.00 H new ATOM 1848 N ALA A 607 16.053 6.962 -4.279 1.00 0.00 N ATOM 1849 CA ALA A 607 16.133 7.926 -3.188 1.00 0.00 C ATOM 1850 C ALA A 607 17.341 8.839 -3.365 1.00 0.00 C ATOM 1851 O ALA A 607 18.230 8.561 -4.170 1.00 0.00 O ATOM 1852 CB ALA A 607 16.236 7.192 -1.850 1.00 0.00 C ATOM 0 H ALA A 607 16.926 6.822 -4.788 1.00 0.00 H new ATOM 0 HA ALA A 607 15.229 8.535 -3.200 1.00 0.00 H new ATOM 0 HB1 ALA A 607 16.295 7.919 -1.040 1.00 0.00 H new ATOM 0 HB2 ALA A 607 15.356 6.564 -1.711 1.00 0.00 H new ATOM 0 HB3 ALA A 607 17.130 6.569 -1.845 1.00 0.00 H new