USER MOD reduce.3.24.130724 H: found=0, std=0, add=586, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 586 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 522 MET CE :methyl -163:sc= 0 (180deg=-0.0188) USER MOD Single : A 524 LYS NZ :NH3+ -169:sc= 1.21 (180deg=1.19) USER MOD Single : A 526 GLN : amide:sc= 0.875 K(o=0.88,f=-0.12) USER MOD Single : A 528 GLN : amide:sc= 0.552 K(o=0.55,f=-0.062) USER MOD Single : A 529 HIS :FLIP no HD1:sc= -0.282 F(o=-1,f=-0.28) USER MOD Single : A 531 TYR OH : rot -147:sc= 1.26 USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot -41:sc= 0.106 USER MOD Single : A 536 THR OG1 : rot -37:sc= 0.0449 USER MOD Single : A 540 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 558 GLN : amide:sc= -0.0273 X(o=-0.027,f=-0.3) USER MOD Single : A 564 MET CE :methyl 176:sc= -0.56 (180deg=-0.628) USER MOD Single : A 567 LYS NZ :NH3+ -150:sc= 0.0129 (180deg=0) USER MOD Single : A 569 SER OG : rot 180:sc= 0 USER MOD Single : A 572 ASN : amide:sc= 0 X(o=0,f=0.055) USER MOD Single : A 573 GLN : amide:sc=-0.00253 K(o=-0.0025,f=-1.2) USER MOD Single : A 574 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 575 LYS NZ :NH3+ 137:sc= 0.94 (180deg=0.145) USER MOD Single : A 579 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 580 CYS SG : rot 88:sc= -0.0254 USER MOD Single : A 587 ASN : amide:sc= 1.06 K(o=1.1,f=-4.1!) USER MOD Single : A 589 THR OG1 : rot -22:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 517 27.954 15.352 27.356 1.00 0.00 N ATOM 66 CA LEU A 517 27.738 16.749 27.745 1.00 0.00 C ATOM 67 C LEU A 517 26.240 17.094 27.886 1.00 0.00 C ATOM 68 O LEU A 517 25.380 16.364 27.368 1.00 0.00 O ATOM 69 CB LEU A 517 28.446 17.648 26.717 1.00 0.00 C ATOM 70 CG LEU A 517 29.975 17.722 26.889 1.00 0.00 C ATOM 71 CD1 LEU A 517 30.471 18.932 26.115 1.00 0.00 C ATOM 72 CD2 LEU A 517 30.465 17.966 28.317 1.00 0.00 C ATOM 0 HA LEU A 517 28.164 16.919 28.734 1.00 0.00 H new ATOM 0 HB2 LEU A 517 28.222 17.281 25.715 1.00 0.00 H new ATOM 0 HB3 LEU A 517 28.035 18.655 26.787 1.00 0.00 H new ATOM 0 HG LEU A 517 30.344 16.752 26.555 1.00 0.00 H new ATOM 0 HD11 LEU A 517 31.553 19.011 26.218 1.00 0.00 H new ATOM 0 HD12 LEU A 517 30.214 18.821 25.062 1.00 0.00 H new ATOM 0 HD13 LEU A 517 30.002 19.833 26.509 1.00 0.00 H new ATOM 0 HD21 LEU A 517 31.554 18.001 28.327 1.00 0.00 H new ATOM 0 HD22 LEU A 517 30.068 18.914 28.681 1.00 0.00 H new ATOM 0 HD23 LEU A 517 30.122 17.158 28.963 1.00 0.00 H new ATOM 84 N PRO A 518 25.913 18.184 28.607 1.00 0.00 N ATOM 85 CA PRO A 518 24.540 18.558 28.935 1.00 0.00 C ATOM 86 C PRO A 518 23.706 18.972 27.711 1.00 0.00 C ATOM 87 O PRO A 518 24.258 19.320 26.658 1.00 0.00 O ATOM 88 CB PRO A 518 24.647 19.661 29.999 1.00 0.00 C ATOM 89 CG PRO A 518 26.036 20.249 29.797 1.00 0.00 C ATOM 90 CD PRO A 518 26.851 19.077 29.271 1.00 0.00 C ATOM 0 HA PRO A 518 23.991 17.699 29.320 1.00 0.00 H new ATOM 0 HB2 PRO A 518 23.873 20.417 29.867 1.00 0.00 H new ATOM 0 HB3 PRO A 518 24.529 19.256 31.004 1.00 0.00 H new ATOM 0 HG2 PRO A 518 26.021 21.077 29.088 1.00 0.00 H new ATOM 0 HG3 PRO A 518 26.447 20.636 30.730 1.00 0.00 H new ATOM 0 HD2 PRO A 518 27.618 19.419 28.577 1.00 0.00 H new ATOM 0 HD3 PRO A 518 27.364 18.565 30.085 1.00 0.00 H new ATOM 98 N PRO A 519 22.366 18.942 27.830 1.00 0.00 N ATOM 99 CA PRO A 519 21.463 19.329 26.756 1.00 0.00 C ATOM 100 C PRO A 519 21.648 20.816 26.433 1.00 0.00 C ATOM 101 O PRO A 519 21.790 21.656 27.327 1.00 0.00 O ATOM 102 CB PRO A 519 20.053 18.991 27.251 1.00 0.00 C ATOM 103 CG PRO A 519 20.181 19.093 28.770 1.00 0.00 C ATOM 104 CD PRO A 519 21.618 18.653 29.044 1.00 0.00 C ATOM 0 HA PRO A 519 21.659 18.799 25.824 1.00 0.00 H new ATOM 0 HB2 PRO A 519 19.312 19.689 26.862 1.00 0.00 H new ATOM 0 HB3 PRO A 519 19.745 17.993 26.939 1.00 0.00 H new ATOM 0 HG2 PRO A 519 20.000 20.109 29.119 1.00 0.00 H new ATOM 0 HG3 PRO A 519 19.462 18.449 29.276 1.00 0.00 H new ATOM 0 HD2 PRO A 519 22.035 19.190 29.896 1.00 0.00 H new ATOM 0 HD3 PRO A 519 21.661 17.591 29.285 1.00 0.00 H new ATOM 112 N GLY A 520 21.703 21.129 25.143 1.00 0.00 N ATOM 113 CA GLY A 520 21.952 22.476 24.637 1.00 0.00 C ATOM 114 C GLY A 520 23.374 23.022 24.827 1.00 0.00 C ATOM 115 O GLY A 520 23.585 24.166 24.426 1.00 0.00 O ATOM 0 H GLY A 520 21.573 20.439 24.403 1.00 0.00 H new ATOM 0 HA2 GLY A 520 21.720 22.490 23.572 1.00 0.00 H new ATOM 0 HA3 GLY A 520 21.256 23.159 25.124 1.00 0.00 H new ATOM 119 N PHE A 521 24.336 22.270 25.403 1.00 0.00 N ATOM 120 CA PHE A 521 25.716 22.716 25.653 1.00 0.00 C ATOM 121 C PHE A 521 26.361 23.647 24.616 1.00 0.00 C ATOM 122 O PHE A 521 26.259 23.391 23.412 1.00 0.00 O ATOM 123 CB PHE A 521 26.607 21.503 25.972 1.00 0.00 C ATOM 124 CG PHE A 521 28.095 21.790 26.005 1.00 0.00 C ATOM 125 CD1 PHE A 521 28.863 21.739 24.825 1.00 0.00 C ATOM 126 CD2 PHE A 521 28.706 22.115 27.229 1.00 0.00 C ATOM 127 CE1 PHE A 521 30.244 21.995 24.872 1.00 0.00 C ATOM 128 CE2 PHE A 521 30.088 22.376 27.273 1.00 0.00 C ATOM 129 CZ PHE A 521 30.857 22.288 26.102 1.00 0.00 C ATOM 0 H PHE A 521 24.167 21.313 25.713 1.00 0.00 H new ATOM 0 HA PHE A 521 25.633 23.374 26.518 1.00 0.00 H new ATOM 0 HB2 PHE A 521 26.309 21.097 26.939 1.00 0.00 H new ATOM 0 HB3 PHE A 521 26.418 20.728 25.229 1.00 0.00 H new ATOM 0 HD1 PHE A 521 28.390 21.503 23.883 1.00 0.00 H new ATOM 0 HD2 PHE A 521 28.116 22.164 28.133 1.00 0.00 H new ATOM 0 HE1 PHE A 521 30.832 21.967 23.966 1.00 0.00 H new ATOM 0 HE2 PHE A 521 30.557 22.644 28.208 1.00 0.00 H new ATOM 0 HZ PHE A 521 31.924 22.446 26.147 1.00 0.00 H new ATOM 139 N MET A 522 27.048 24.701 25.069 1.00 0.00 N ATOM 140 CA MET A 522 27.714 25.665 24.189 1.00 0.00 C ATOM 141 C MET A 522 29.232 25.447 24.159 1.00 0.00 C ATOM 142 O MET A 522 29.798 25.111 23.112 1.00 0.00 O ATOM 143 CB MET A 522 27.346 27.105 24.589 1.00 0.00 C ATOM 144 CG MET A 522 25.829 27.334 24.604 1.00 0.00 C ATOM 145 SD MET A 522 25.290 29.065 24.471 1.00 0.00 S ATOM 146 CE MET A 522 25.961 29.757 26.006 1.00 0.00 C ATOM 0 H MET A 522 27.158 24.910 26.061 1.00 0.00 H new ATOM 0 HA MET A 522 27.356 25.501 23.173 1.00 0.00 H new ATOM 0 HB2 MET A 522 27.754 27.321 25.576 1.00 0.00 H new ATOM 0 HB3 MET A 522 27.810 27.803 23.893 1.00 0.00 H new ATOM 0 HG2 MET A 522 25.387 26.771 23.782 1.00 0.00 H new ATOM 0 HG3 MET A 522 25.427 26.918 25.527 1.00 0.00 H new ATOM 0 HE1 MET A 522 25.472 30.707 26.221 1.00 0.00 H new ATOM 0 HE2 MET A 522 25.782 29.063 26.827 1.00 0.00 H new ATOM 0 HE3 MET A 522 27.033 29.918 25.895 1.00 0.00 H new ATOM 156 N PHE A 523 29.896 25.648 25.298 1.00 0.00 N ATOM 157 CA PHE A 523 31.356 25.583 25.439 1.00 0.00 C ATOM 158 C PHE A 523 31.803 25.341 26.878 1.00 0.00 C ATOM 159 O PHE A 523 30.979 25.315 27.780 1.00 0.00 O ATOM 160 CB PHE A 523 32.036 26.829 24.843 1.00 0.00 C ATOM 161 CG PHE A 523 31.600 28.165 25.413 1.00 0.00 C ATOM 162 CD1 PHE A 523 30.450 28.818 24.938 1.00 0.00 C ATOM 163 CD2 PHE A 523 32.376 28.776 26.414 1.00 0.00 C ATOM 164 CE1 PHE A 523 30.049 30.043 25.500 1.00 0.00 C ATOM 165 CE2 PHE A 523 31.999 30.018 26.948 1.00 0.00 C ATOM 166 CZ PHE A 523 30.832 30.653 26.495 1.00 0.00 C ATOM 0 H PHE A 523 29.422 25.867 26.174 1.00 0.00 H new ATOM 0 HA PHE A 523 31.680 24.715 24.865 1.00 0.00 H new ATOM 0 HB2 PHE A 523 33.113 26.732 24.982 1.00 0.00 H new ATOM 0 HB3 PHE A 523 31.853 26.839 23.768 1.00 0.00 H new ATOM 0 HD1 PHE A 523 29.872 28.378 24.139 1.00 0.00 H new ATOM 0 HD2 PHE A 523 33.268 28.286 26.774 1.00 0.00 H new ATOM 0 HE1 PHE A 523 29.137 30.516 25.166 1.00 0.00 H new ATOM 0 HE2 PHE A 523 32.607 30.486 27.708 1.00 0.00 H new ATOM 0 HZ PHE A 523 30.537 31.606 26.909 1.00 0.00 H new ATOM 176 N LYS A 524 33.098 25.152 27.122 1.00 0.00 N ATOM 177 CA LYS A 524 33.657 25.048 28.480 1.00 0.00 C ATOM 178 C LYS A 524 34.474 26.290 28.880 1.00 0.00 C ATOM 179 O LYS A 524 34.990 27.026 28.036 1.00 0.00 O ATOM 180 CB LYS A 524 34.501 23.781 28.604 1.00 0.00 C ATOM 181 CG LYS A 524 33.739 22.463 28.527 1.00 0.00 C ATOM 182 CD LYS A 524 34.644 21.326 29.007 1.00 0.00 C ATOM 183 CE LYS A 524 34.094 19.965 28.601 1.00 0.00 C ATOM 184 NZ LYS A 524 35.055 18.882 28.907 1.00 0.00 N ATOM 0 H LYS A 524 33.797 25.066 26.384 1.00 0.00 H new ATOM 0 HA LYS A 524 32.818 24.991 29.173 1.00 0.00 H new ATOM 0 HB2 LYS A 524 35.253 23.790 27.815 1.00 0.00 H new ATOM 0 HB3 LYS A 524 35.035 23.815 29.554 1.00 0.00 H new ATOM 0 HG2 LYS A 524 32.841 22.513 29.143 1.00 0.00 H new ATOM 0 HG3 LYS A 524 33.414 22.277 27.503 1.00 0.00 H new ATOM 0 HD2 LYS A 524 35.643 21.455 28.591 1.00 0.00 H new ATOM 0 HD3 LYS A 524 34.742 21.371 30.092 1.00 0.00 H new ATOM 0 HE2 LYS A 524 33.156 19.779 29.123 1.00 0.00 H new ATOM 0 HE3 LYS A 524 33.870 19.965 27.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 34.739 18.000 28.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 35.995 19.139 28.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 35.107 18.745 29.937 1.00 0.00 H new ATOM 198 N VAL A 525 34.676 26.460 30.183 1.00 0.00 N ATOM 199 CA VAL A 525 35.625 27.400 30.814 1.00 0.00 C ATOM 200 C VAL A 525 36.364 26.703 31.967 1.00 0.00 C ATOM 201 O VAL A 525 35.855 25.719 32.498 1.00 0.00 O ATOM 202 CB VAL A 525 34.924 28.690 31.301 1.00 0.00 C ATOM 203 CG1 VAL A 525 34.136 29.391 30.189 1.00 0.00 C ATOM 204 CG2 VAL A 525 33.950 28.343 32.428 1.00 0.00 C ATOM 0 H VAL A 525 34.157 25.919 30.875 1.00 0.00 H new ATOM 0 HA VAL A 525 36.352 27.702 30.060 1.00 0.00 H new ATOM 0 HB VAL A 525 35.707 29.367 31.642 1.00 0.00 H new ATOM 0 HG11 VAL A 525 33.665 30.290 30.588 1.00 0.00 H new ATOM 0 HG12 VAL A 525 34.813 29.665 29.380 1.00 0.00 H new ATOM 0 HG13 VAL A 525 33.368 28.718 29.807 1.00 0.00 H new ATOM 0 HG21 VAL A 525 33.455 29.251 32.773 1.00 0.00 H new ATOM 0 HG22 VAL A 525 33.203 27.640 32.060 1.00 0.00 H new ATOM 0 HG23 VAL A 525 34.497 27.891 33.255 1.00 0.00 H new ATOM 214 N GLN A 526 37.522 27.208 32.398 1.00 0.00 N ATOM 215 CA GLN A 526 38.211 26.764 33.626 1.00 0.00 C ATOM 216 C GLN A 526 38.451 27.915 34.618 1.00 0.00 C ATOM 217 O GLN A 526 38.986 28.958 34.240 1.00 0.00 O ATOM 218 CB GLN A 526 39.530 26.052 33.273 1.00 0.00 C ATOM 219 CG GLN A 526 40.144 25.400 34.525 1.00 0.00 C ATOM 220 CD GLN A 526 41.396 24.578 34.246 1.00 0.00 C ATOM 221 OE1 GLN A 526 42.194 24.857 33.353 1.00 0.00 O ATOM 222 NE2 GLN A 526 41.645 23.576 35.053 1.00 0.00 N ATOM 0 H GLN A 526 38.020 27.947 31.902 1.00 0.00 H new ATOM 0 HA GLN A 526 37.552 26.056 34.128 1.00 0.00 H new ATOM 0 HB2 GLN A 526 39.348 25.292 32.513 1.00 0.00 H new ATOM 0 HB3 GLN A 526 40.233 26.767 32.847 1.00 0.00 H new ATOM 0 HG2 GLN A 526 40.388 26.180 35.246 1.00 0.00 H new ATOM 0 HG3 GLN A 526 39.397 24.758 34.991 1.00 0.00 H new ATOM 0 HE21 GLN A 526 40.985 23.342 35.795 1.00 0.00 H new ATOM 0 HE22 GLN A 526 42.499 23.030 34.940 1.00 0.00 H new ATOM 231 N ALA A 527 38.103 27.735 35.896 1.00 0.00 N ATOM 232 CA ALA A 527 38.301 28.721 36.963 1.00 0.00 C ATOM 233 C ALA A 527 39.789 29.027 37.218 1.00 0.00 C ATOM 234 O ALA A 527 40.576 28.147 37.557 1.00 0.00 O ATOM 235 CB ALA A 527 37.556 28.239 38.220 1.00 0.00 C ATOM 0 H ALA A 527 37.664 26.876 36.226 1.00 0.00 H new ATOM 0 HA ALA A 527 37.880 29.677 36.653 1.00 0.00 H new ATOM 0 HB1 ALA A 527 37.693 28.962 39.024 1.00 0.00 H new ATOM 0 HB2 ALA A 527 36.493 28.141 37.998 1.00 0.00 H new ATOM 0 HB3 ALA A 527 37.953 27.272 38.530 1.00 0.00 H new ATOM 241 N GLN A 528 40.170 30.295 37.078 1.00 0.00 N ATOM 242 CA GLN A 528 41.498 30.825 37.413 1.00 0.00 C ATOM 243 C GLN A 528 41.616 31.184 38.908 1.00 0.00 C ATOM 244 O GLN A 528 42.718 31.248 39.459 1.00 0.00 O ATOM 245 CB GLN A 528 41.755 32.084 36.562 1.00 0.00 C ATOM 246 CG GLN A 528 41.616 31.927 35.043 1.00 0.00 C ATOM 247 CD GLN A 528 42.436 30.765 34.505 1.00 0.00 C ATOM 248 OE1 GLN A 528 43.656 30.802 34.383 1.00 0.00 O ATOM 249 NE2 GLN A 528 41.794 29.649 34.272 1.00 0.00 N ATOM 0 H GLN A 528 39.542 31.012 36.715 1.00 0.00 H new ATOM 0 HA GLN A 528 42.238 30.054 37.201 1.00 0.00 H new ATOM 0 HB2 GLN A 528 41.065 32.862 36.888 1.00 0.00 H new ATOM 0 HB3 GLN A 528 42.762 32.440 36.777 1.00 0.00 H new ATOM 0 HG2 GLN A 528 40.567 31.776 34.790 1.00 0.00 H new ATOM 0 HG3 GLN A 528 41.932 32.849 34.554 1.00 0.00 H new ATOM 0 HE21 GLN A 528 40.780 29.614 34.372 1.00 0.00 H new ATOM 0 HE22 GLN A 528 42.308 28.814 33.990 1.00 0.00 H new ATOM 258 N HIS A 529 40.471 31.426 39.556 1.00 0.00 N ATOM 259 CA HIS A 529 40.335 32.004 40.895 1.00 0.00 C ATOM 260 C HIS A 529 39.172 31.349 41.668 1.00 0.00 C ATOM 261 O HIS A 529 38.307 30.699 41.080 1.00 0.00 O ATOM 262 CB HIS A 529 40.147 33.525 40.751 1.00 0.00 C ATOM 263 CG HIS A 529 41.292 34.215 40.050 1.00 0.00 C ATOM 264 ND1 HIS A 529 41.287 34.727 38.781 1.00 0.00 N flip ATOM 265 CD2 HIS A 529 42.549 34.436 40.560 1.00 0.00 C flip ATOM 266 CE1 HIS A 529 42.559 35.248 38.514 1.00 0.00 C flip ATOM 267 NE2 HIS A 529 43.291 35.039 39.620 1.00 0.00 N flip ATOM 0 H HIS A 529 39.566 31.212 39.136 1.00 0.00 H new ATOM 0 HA HIS A 529 41.236 31.810 41.477 1.00 0.00 H new ATOM 0 HB2 HIS A 529 39.226 33.718 40.200 1.00 0.00 H new ATOM 0 HB3 HIS A 529 40.023 33.962 41.742 1.00 0.00 H new ATOM 0 HD2 HIS A 529 42.883 34.169 41.552 1.00 0.00 H new ATOM 0 HE1 HIS A 529 42.886 35.723 37.601 1.00 0.00 H new ATOM 0 HE2 HIS A 529 44.271 35.301 39.729 1.00 0.00 H new ATOM 275 N ASP A 530 39.161 31.498 42.991 1.00 0.00 N ATOM 276 CA ASP A 530 38.156 30.955 43.911 1.00 0.00 C ATOM 277 C ASP A 530 36.926 31.850 44.146 1.00 0.00 C ATOM 278 O ASP A 530 37.067 33.001 44.566 1.00 0.00 O ATOM 279 CB ASP A 530 38.861 30.466 45.189 1.00 0.00 C ATOM 280 CG ASP A 530 37.969 30.285 46.418 1.00 0.00 C ATOM 281 OD1 ASP A 530 37.171 29.323 46.431 1.00 0.00 O ATOM 282 OD2 ASP A 530 38.168 30.999 47.431 1.00 0.00 O ATOM 0 H ASP A 530 39.886 32.026 43.477 1.00 0.00 H new ATOM 0 HA ASP A 530 37.690 30.096 43.429 1.00 0.00 H new ATOM 0 HB2 ASP A 530 39.345 29.514 44.972 1.00 0.00 H new ATOM 0 HB3 ASP A 530 39.651 31.175 45.439 1.00 0.00 H new ATOM 287 N TYR A 531 35.725 31.323 43.884 1.00 0.00 N ATOM 288 CA TYR A 531 34.460 32.060 43.977 1.00 0.00 C ATOM 289 C TYR A 531 33.404 31.297 44.789 1.00 0.00 C ATOM 290 O TYR A 531 32.889 30.260 44.364 1.00 0.00 O ATOM 291 CB TYR A 531 33.916 32.403 42.579 1.00 0.00 C ATOM 292 CG TYR A 531 32.666 33.271 42.661 1.00 0.00 C ATOM 293 CD1 TYR A 531 32.811 34.642 42.952 1.00 0.00 C ATOM 294 CD2 TYR A 531 31.374 32.714 42.559 1.00 0.00 C ATOM 295 CE1 TYR A 531 31.675 35.443 43.177 1.00 0.00 C ATOM 296 CE2 TYR A 531 30.234 33.518 42.778 1.00 0.00 C ATOM 297 CZ TYR A 531 30.383 34.882 43.113 1.00 0.00 C ATOM 298 OH TYR A 531 29.306 35.668 43.388 1.00 0.00 O ATOM 0 H TYR A 531 35.603 30.352 43.595 1.00 0.00 H new ATOM 0 HA TYR A 531 34.674 32.988 44.507 1.00 0.00 H new ATOM 0 HB2 TYR A 531 34.684 32.923 42.007 1.00 0.00 H new ATOM 0 HB3 TYR A 531 33.686 31.483 42.042 1.00 0.00 H new ATOM 0 HD1 TYR A 531 33.797 35.080 43.003 1.00 0.00 H new ATOM 0 HD2 TYR A 531 31.256 31.669 42.313 1.00 0.00 H new ATOM 0 HE1 TYR A 531 31.794 36.493 43.400 1.00 0.00 H new ATOM 0 HE2 TYR A 531 29.247 33.089 42.689 1.00 0.00 H new ATOM 0 HH TYR A 531 28.604 35.127 43.806 1.00 0.00 H new ATOM 308 N THR A 532 33.040 31.844 45.946 1.00 0.00 N ATOM 309 CA THR A 532 31.902 31.397 46.759 1.00 0.00 C ATOM 310 C THR A 532 30.578 32.083 46.411 1.00 0.00 C ATOM 311 O THR A 532 30.505 33.311 46.376 1.00 0.00 O ATOM 312 CB THR A 532 32.203 31.385 48.267 1.00 0.00 C ATOM 313 OG1 THR A 532 33.554 31.060 48.532 1.00 0.00 O ATOM 314 CG2 THR A 532 31.327 30.390 49.022 1.00 0.00 C ATOM 0 H THR A 532 33.539 32.632 46.359 1.00 0.00 H new ATOM 0 HA THR A 532 31.753 30.354 46.479 1.00 0.00 H new ATOM 0 HB THR A 532 31.989 32.396 48.612 1.00 0.00 H new ATOM 0 HG1 THR A 532 33.708 31.064 49.500 1.00 0.00 H new ATOM 0 HG21 THR A 532 31.576 30.418 50.083 1.00 0.00 H new ATOM 0 HG22 THR A 532 30.278 30.654 48.889 1.00 0.00 H new ATOM 0 HG23 THR A 532 31.500 29.386 48.635 1.00 0.00 H new ATOM 322 N ALA A 533 29.528 31.303 46.144 1.00 0.00 N ATOM 323 CA ALA A 533 28.239 31.799 45.674 1.00 0.00 C ATOM 324 C ALA A 533 27.428 32.490 46.781 1.00 0.00 C ATOM 325 O ALA A 533 27.226 31.967 47.882 1.00 0.00 O ATOM 326 CB ALA A 533 27.485 30.616 45.056 1.00 0.00 C ATOM 0 H ALA A 533 29.554 30.289 46.252 1.00 0.00 H new ATOM 0 HA ALA A 533 28.399 32.574 44.925 1.00 0.00 H new ATOM 0 HB1 ALA A 533 26.514 30.953 44.693 1.00 0.00 H new ATOM 0 HB2 ALA A 533 28.062 30.211 44.225 1.00 0.00 H new ATOM 0 HB3 ALA A 533 27.342 29.842 45.810 1.00 0.00 H new ATOM 332 N THR A 534 26.913 33.668 46.453 1.00 0.00 N ATOM 333 CA THR A 534 26.135 34.554 47.336 1.00 0.00 C ATOM 334 C THR A 534 24.640 34.644 46.996 1.00 0.00 C ATOM 335 O THR A 534 23.919 35.502 47.495 1.00 0.00 O ATOM 336 CB THR A 534 26.882 35.884 47.538 1.00 0.00 C ATOM 337 OG1 THR A 534 26.438 36.556 48.694 1.00 0.00 O ATOM 338 CG2 THR A 534 26.770 36.817 46.338 1.00 0.00 C ATOM 0 H THR A 534 27.028 34.059 45.518 1.00 0.00 H new ATOM 0 HA THR A 534 26.078 34.094 48.323 1.00 0.00 H new ATOM 0 HB THR A 534 27.931 35.614 47.656 1.00 0.00 H new ATOM 0 HG1 THR A 534 25.463 36.483 48.761 1.00 0.00 H new ATOM 0 HG21 THR A 534 27.317 37.738 46.541 1.00 0.00 H new ATOM 0 HG22 THR A 534 27.192 36.331 45.458 1.00 0.00 H new ATOM 0 HG23 THR A 534 25.721 37.051 46.156 1.00 0.00 H new ATOM 346 N ASP A 535 24.133 33.721 46.174 1.00 0.00 N ATOM 347 CA ASP A 535 22.713 33.606 45.814 1.00 0.00 C ATOM 348 C ASP A 535 22.414 32.123 45.514 1.00 0.00 C ATOM 349 O ASP A 535 23.309 31.345 45.170 1.00 0.00 O ATOM 350 CB ASP A 535 22.462 34.468 44.560 1.00 0.00 C ATOM 351 CG ASP A 535 20.996 34.841 44.322 1.00 0.00 C ATOM 352 OD1 ASP A 535 20.745 35.739 43.480 1.00 0.00 O ATOM 353 OD2 ASP A 535 20.097 34.233 44.936 1.00 0.00 O ATOM 0 H ASP A 535 24.714 33.012 45.727 1.00 0.00 H new ATOM 0 HA ASP A 535 22.067 33.950 46.622 1.00 0.00 H new ATOM 0 HB2 ASP A 535 23.047 35.384 44.643 1.00 0.00 H new ATOM 0 HB3 ASP A 535 22.832 33.931 43.687 1.00 0.00 H new ATOM 358 N THR A 536 21.140 31.735 45.583 1.00 0.00 N ATOM 359 CA THR A 536 20.649 30.440 45.074 1.00 0.00 C ATOM 360 C THR A 536 20.587 30.325 43.542 1.00 0.00 C ATOM 361 O THR A 536 20.409 29.242 42.985 1.00 0.00 O ATOM 362 CB THR A 536 19.365 30.007 45.800 1.00 0.00 C ATOM 363 OG1 THR A 536 19.240 28.602 45.743 1.00 0.00 O ATOM 364 CG2 THR A 536 18.100 30.626 45.208 1.00 0.00 C ATOM 0 H THR A 536 20.407 32.312 45.997 1.00 0.00 H new ATOM 0 HA THR A 536 21.414 29.706 45.326 1.00 0.00 H new ATOM 0 HB THR A 536 19.458 30.359 46.827 1.00 0.00 H new ATOM 0 HG1 THR A 536 19.553 28.281 44.872 1.00 0.00 H new ATOM 0 HG21 THR A 536 17.230 30.280 45.766 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.163 31.712 45.271 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.003 30.328 44.164 1.00 0.00 H new ATOM 372 N ASP A 537 20.768 31.445 42.839 1.00 0.00 N ATOM 373 CA ASP A 537 21.097 31.488 41.407 1.00 0.00 C ATOM 374 C ASP A 537 22.551 31.167 41.031 1.00 0.00 C ATOM 375 O ASP A 537 22.830 30.780 39.895 1.00 0.00 O ATOM 376 CB ASP A 537 20.705 32.857 40.824 1.00 0.00 C ATOM 377 CG ASP A 537 19.202 33.057 40.633 1.00 0.00 C ATOM 378 OD1 ASP A 537 18.801 34.235 40.486 1.00 0.00 O ATOM 379 OD2 ASP A 537 18.438 32.063 40.613 1.00 0.00 O ATOM 0 H ASP A 537 20.689 32.372 43.257 1.00 0.00 H new ATOM 0 HA ASP A 537 20.514 30.677 40.971 1.00 0.00 H new ATOM 0 HB2 ASP A 537 21.082 33.640 41.482 1.00 0.00 H new ATOM 0 HB3 ASP A 537 21.201 32.983 39.862 1.00 0.00 H new ATOM 384 N GLU A 538 23.497 31.377 41.948 1.00 0.00 N ATOM 385 CA GLU A 538 24.924 31.388 41.647 1.00 0.00 C ATOM 386 C GLU A 538 25.591 30.003 41.700 1.00 0.00 C ATOM 387 O GLU A 538 25.144 29.085 42.394 1.00 0.00 O ATOM 388 CB GLU A 538 25.616 32.418 42.551 1.00 0.00 C ATOM 389 CG GLU A 538 25.397 33.857 42.056 1.00 0.00 C ATOM 390 CD GLU A 538 26.046 34.914 42.958 1.00 0.00 C ATOM 391 OE1 GLU A 538 26.966 34.564 43.735 1.00 0.00 O ATOM 392 OE2 GLU A 538 25.648 36.104 42.863 1.00 0.00 O ATOM 0 H GLU A 538 23.288 31.546 42.932 1.00 0.00 H new ATOM 0 HA GLU A 538 25.042 31.686 40.605 1.00 0.00 H new ATOM 0 HB2 GLU A 538 25.235 32.322 43.568 1.00 0.00 H new ATOM 0 HB3 GLU A 538 26.685 32.207 42.590 1.00 0.00 H new ATOM 0 HG2 GLU A 538 25.800 33.952 41.048 1.00 0.00 H new ATOM 0 HG3 GLU A 538 24.327 34.053 41.991 1.00 0.00 H new ATOM 399 N LEU A 539 26.679 29.857 40.941 1.00 0.00 N ATOM 400 CA LEU A 539 27.541 28.677 40.858 1.00 0.00 C ATOM 401 C LEU A 539 28.804 28.884 41.716 1.00 0.00 C ATOM 402 O LEU A 539 29.491 29.897 41.576 1.00 0.00 O ATOM 403 CB LEU A 539 27.914 28.440 39.376 1.00 0.00 C ATOM 404 CG LEU A 539 27.878 26.978 38.897 1.00 0.00 C ATOM 405 CD1 LEU A 539 28.558 26.856 37.546 1.00 0.00 C ATOM 406 CD2 LEU A 539 28.583 25.997 39.826 1.00 0.00 C ATOM 0 H LEU A 539 27.001 30.607 40.330 1.00 0.00 H new ATOM 0 HA LEU A 539 27.016 27.802 41.241 1.00 0.00 H new ATOM 0 HB2 LEU A 539 27.235 29.022 38.753 1.00 0.00 H new ATOM 0 HB3 LEU A 539 28.917 28.832 39.207 1.00 0.00 H new ATOM 0 HG LEU A 539 26.819 26.722 38.862 1.00 0.00 H new ATOM 0 HD11 LEU A 539 28.527 25.818 37.216 1.00 0.00 H new ATOM 0 HD12 LEU A 539 28.040 27.483 36.820 1.00 0.00 H new ATOM 0 HD13 LEU A 539 29.596 27.179 37.630 1.00 0.00 H new ATOM 0 HD21 LEU A 539 28.511 24.990 39.415 1.00 0.00 H new ATOM 0 HD22 LEU A 539 29.632 26.276 39.921 1.00 0.00 H new ATOM 0 HD23 LEU A 539 28.111 26.022 40.808 1.00 0.00 H new ATOM 418 N GLN A 540 29.135 27.929 42.585 1.00 0.00 N ATOM 419 CA GLN A 540 30.384 27.933 43.355 1.00 0.00 C ATOM 420 C GLN A 540 31.545 27.416 42.487 1.00 0.00 C ATOM 421 O GLN A 540 31.428 26.338 41.907 1.00 0.00 O ATOM 422 CB GLN A 540 30.190 27.045 44.594 1.00 0.00 C ATOM 423 CG GLN A 540 31.313 27.221 45.633 1.00 0.00 C ATOM 424 CD GLN A 540 31.301 26.151 46.724 1.00 0.00 C ATOM 425 OE1 GLN A 540 32.105 25.223 46.734 1.00 0.00 O ATOM 426 NE2 GLN A 540 30.321 26.142 47.595 1.00 0.00 N ATOM 0 H GLN A 540 28.540 27.123 42.778 1.00 0.00 H new ATOM 0 HA GLN A 540 30.631 28.948 43.668 1.00 0.00 H new ATOM 0 HB2 GLN A 540 29.232 27.279 45.058 1.00 0.00 H new ATOM 0 HB3 GLN A 540 30.147 26.001 44.284 1.00 0.00 H new ATOM 0 HG2 GLN A 540 32.276 27.200 45.123 1.00 0.00 H new ATOM 0 HG3 GLN A 540 31.219 28.203 46.096 1.00 0.00 H new ATOM 0 HE21 GLN A 540 29.641 26.902 47.606 1.00 0.00 H new ATOM 0 HE22 GLN A 540 30.239 25.375 48.262 1.00 0.00 H new ATOM 435 N LEU A 541 32.671 28.134 42.434 1.00 0.00 N ATOM 436 CA LEU A 541 33.887 27.736 41.706 1.00 0.00 C ATOM 437 C LEU A 541 35.107 27.720 42.637 1.00 0.00 C ATOM 438 O LEU A 541 35.225 28.564 43.527 1.00 0.00 O ATOM 439 CB LEU A 541 34.140 28.675 40.503 1.00 0.00 C ATOM 440 CG LEU A 541 33.007 28.787 39.460 1.00 0.00 C ATOM 441 CD1 LEU A 541 33.438 29.728 38.339 1.00 0.00 C ATOM 442 CD2 LEU A 541 32.677 27.429 38.847 1.00 0.00 C ATOM 0 H LEU A 541 32.768 29.032 42.908 1.00 0.00 H new ATOM 0 HA LEU A 541 33.733 26.725 41.329 1.00 0.00 H new ATOM 0 HB2 LEU A 541 34.347 29.673 40.888 1.00 0.00 H new ATOM 0 HB3 LEU A 541 35.041 28.337 39.991 1.00 0.00 H new ATOM 0 HG LEU A 541 32.122 29.169 39.970 1.00 0.00 H new ATOM 0 HD11 LEU A 541 32.638 29.807 37.603 1.00 0.00 H new ATOM 0 HD12 LEU A 541 33.649 30.714 38.753 1.00 0.00 H new ATOM 0 HD13 LEU A 541 34.335 29.336 37.860 1.00 0.00 H new ATOM 0 HD21 LEU A 541 31.876 27.544 38.117 1.00 0.00 H new ATOM 0 HD22 LEU A 541 33.562 27.028 38.353 1.00 0.00 H new ATOM 0 HD23 LEU A 541 32.357 26.744 39.632 1.00 0.00 H new ATOM 454 N LYS A 542 36.056 26.808 42.404 1.00 0.00 N ATOM 455 CA LYS A 542 37.398 26.825 43.015 1.00 0.00 C ATOM 456 C LYS A 542 38.450 26.995 41.923 1.00 0.00 C ATOM 457 O LYS A 542 38.251 26.522 40.809 1.00 0.00 O ATOM 458 CB LYS A 542 37.604 25.532 43.824 1.00 0.00 C ATOM 459 CG LYS A 542 38.694 25.614 44.909 1.00 0.00 C ATOM 460 CD LYS A 542 40.034 25.001 44.477 1.00 0.00 C ATOM 461 CE LYS A 542 41.171 25.269 45.472 1.00 0.00 C ATOM 462 NZ LYS A 542 40.959 24.588 46.768 1.00 0.00 N ATOM 0 H LYS A 542 35.914 26.019 41.773 1.00 0.00 H new ATOM 0 HA LYS A 542 37.497 27.666 43.702 1.00 0.00 H new ATOM 0 HB2 LYS A 542 36.660 25.262 44.297 1.00 0.00 H new ATOM 0 HB3 LYS A 542 37.857 24.726 43.135 1.00 0.00 H new ATOM 0 HG2 LYS A 542 38.851 26.659 45.177 1.00 0.00 H new ATOM 0 HG3 LYS A 542 38.342 25.104 45.806 1.00 0.00 H new ATOM 0 HD2 LYS A 542 39.912 23.925 44.357 1.00 0.00 H new ATOM 0 HD3 LYS A 542 40.312 25.401 43.502 1.00 0.00 H new ATOM 0 HE2 LYS A 542 42.114 24.936 45.040 1.00 0.00 H new ATOM 0 HE3 LYS A 542 41.258 26.343 45.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 542 41.753 24.800 47.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 542 40.073 24.924 47.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 542 40.902 23.561 46.615 1.00 0.00 H new ATOM 476 N ALA A 543 39.574 27.635 42.235 1.00 0.00 N ATOM 477 CA ALA A 543 40.691 27.791 41.306 1.00 0.00 C ATOM 478 C ALA A 543 41.164 26.429 40.744 1.00 0.00 C ATOM 479 O ALA A 543 41.791 25.628 41.444 1.00 0.00 O ATOM 480 CB ALA A 543 41.811 28.544 42.029 1.00 0.00 C ATOM 0 H ALA A 543 39.737 28.063 43.146 1.00 0.00 H new ATOM 0 HA ALA A 543 40.373 28.368 40.438 1.00 0.00 H new ATOM 0 HB1 ALA A 543 42.657 28.673 41.354 1.00 0.00 H new ATOM 0 HB2 ALA A 543 41.447 29.522 42.345 1.00 0.00 H new ATOM 0 HB3 ALA A 543 42.127 27.974 42.903 1.00 0.00 H new ATOM 486 N GLY A 544 40.830 26.172 39.479 1.00 0.00 N ATOM 487 CA GLY A 544 41.115 24.946 38.731 1.00 0.00 C ATOM 488 C GLY A 544 39.866 24.234 38.196 1.00 0.00 C ATOM 489 O GLY A 544 40.003 23.309 37.398 1.00 0.00 O ATOM 0 H GLY A 544 40.323 26.854 38.915 1.00 0.00 H new ATOM 0 HA2 GLY A 544 41.769 25.188 37.893 1.00 0.00 H new ATOM 0 HA3 GLY A 544 41.664 24.259 39.376 1.00 0.00 H new ATOM 493 N ASP A 545 38.655 24.654 38.580 1.00 0.00 N ATOM 494 CA ASP A 545 37.411 23.953 38.254 1.00 0.00 C ATOM 495 C ASP A 545 36.893 24.191 36.826 1.00 0.00 C ATOM 496 O ASP A 545 36.675 25.339 36.432 1.00 0.00 O ATOM 497 CB ASP A 545 36.345 24.210 39.342 1.00 0.00 C ATOM 498 CG ASP A 545 36.519 23.405 40.644 1.00 0.00 C ATOM 499 OD1 ASP A 545 37.236 22.372 40.672 1.00 0.00 O ATOM 500 OD2 ASP A 545 35.889 23.783 41.663 1.00 0.00 O ATOM 0 H ASP A 545 38.511 25.500 39.132 1.00 0.00 H new ATOM 0 HA ASP A 545 37.647 22.889 38.256 1.00 0.00 H new ATOM 0 HB2 ASP A 545 36.351 25.272 39.588 1.00 0.00 H new ATOM 0 HB3 ASP A 545 35.363 23.985 38.925 1.00 0.00 H new ATOM 505 N VAL A 546 36.683 23.126 36.044 1.00 0.00 N ATOM 506 CA VAL A 546 36.029 23.195 34.726 1.00 0.00 C ATOM 507 C VAL A 546 34.525 23.433 34.844 1.00 0.00 C ATOM 508 O VAL A 546 33.862 22.810 35.677 1.00 0.00 O ATOM 509 CB VAL A 546 36.328 21.990 33.801 1.00 0.00 C ATOM 510 CG1 VAL A 546 36.083 22.328 32.327 1.00 0.00 C ATOM 511 CG2 VAL A 546 37.764 21.473 33.922 1.00 0.00 C ATOM 0 H VAL A 546 36.964 22.182 36.308 1.00 0.00 H new ATOM 0 HA VAL A 546 36.479 24.061 34.241 1.00 0.00 H new ATOM 0 HB VAL A 546 35.641 21.213 34.137 1.00 0.00 H new ATOM 0 HG11 VAL A 546 36.305 21.456 31.712 1.00 0.00 H new ATOM 0 HG12 VAL A 546 35.041 22.615 32.188 1.00 0.00 H new ATOM 0 HG13 VAL A 546 36.729 23.154 32.031 1.00 0.00 H new ATOM 0 HG21 VAL A 546 37.905 20.629 33.247 1.00 0.00 H new ATOM 0 HG22 VAL A 546 38.461 22.269 33.658 1.00 0.00 H new ATOM 0 HG23 VAL A 546 37.950 21.153 34.947 1.00 0.00 H new ATOM 521 N VAL A 547 33.964 24.284 33.990 1.00 0.00 N ATOM 522 CA VAL A 547 32.529 24.579 33.910 1.00 0.00 C ATOM 523 C VAL A 547 32.012 24.452 32.492 1.00 0.00 C ATOM 524 O VAL A 547 32.544 25.065 31.569 1.00 0.00 O ATOM 525 CB VAL A 547 32.100 25.913 34.571 1.00 0.00 C ATOM 526 CG1 VAL A 547 30.677 25.817 35.113 1.00 0.00 C ATOM 527 CG2 VAL A 547 33.026 26.390 35.688 1.00 0.00 C ATOM 0 H VAL A 547 34.512 24.808 33.308 1.00 0.00 H new ATOM 0 HA VAL A 547 32.049 23.811 34.517 1.00 0.00 H new ATOM 0 HB VAL A 547 32.160 26.653 33.773 1.00 0.00 H new ATOM 0 HG11 VAL A 547 30.398 26.765 35.572 1.00 0.00 H new ATOM 0 HG12 VAL A 547 29.991 25.594 34.296 1.00 0.00 H new ATOM 0 HG13 VAL A 547 30.624 25.023 35.858 1.00 0.00 H new ATOM 0 HG21 VAL A 547 32.652 27.330 36.095 1.00 0.00 H new ATOM 0 HG22 VAL A 547 33.059 25.640 36.478 1.00 0.00 H new ATOM 0 HG23 VAL A 547 34.029 26.541 35.289 1.00 0.00 H new ATOM 537 N LEU A 548 30.989 23.628 32.316 1.00 0.00 N ATOM 538 CA LEU A 548 30.302 23.427 31.055 1.00 0.00 C ATOM 539 C LEU A 548 29.294 24.576 30.870 1.00 0.00 C ATOM 540 O LEU A 548 28.212 24.543 31.461 1.00 0.00 O ATOM 541 CB LEU A 548 29.618 22.042 31.074 1.00 0.00 C ATOM 542 CG LEU A 548 30.412 20.828 31.595 1.00 0.00 C ATOM 543 CD1 LEU A 548 29.521 19.602 31.748 1.00 0.00 C ATOM 544 CD2 LEU A 548 31.544 20.439 30.664 1.00 0.00 C ATOM 0 H LEU A 548 30.604 23.064 33.074 1.00 0.00 H new ATOM 0 HA LEU A 548 30.992 23.440 30.212 1.00 0.00 H new ATOM 0 HB2 LEU A 548 28.714 22.129 31.677 1.00 0.00 H new ATOM 0 HB3 LEU A 548 29.301 21.817 30.056 1.00 0.00 H new ATOM 0 HG LEU A 548 30.813 21.138 32.560 1.00 0.00 H new ATOM 0 HD11 LEU A 548 30.114 18.765 32.117 1.00 0.00 H new ATOM 0 HD12 LEU A 548 28.721 19.820 32.455 1.00 0.00 H new ATOM 0 HD13 LEU A 548 29.090 19.343 30.781 1.00 0.00 H new ATOM 0 HD21 LEU A 548 32.073 19.579 31.074 1.00 0.00 H new ATOM 0 HD22 LEU A 548 31.138 20.182 29.685 1.00 0.00 H new ATOM 0 HD23 LEU A 548 32.235 21.276 30.562 1.00 0.00 H new ATOM 556 N VAL A 549 29.649 25.609 30.101 1.00 0.00 N ATOM 557 CA VAL A 549 28.698 26.658 29.666 1.00 0.00 C ATOM 558 C VAL A 549 27.491 26.108 28.883 1.00 0.00 C ATOM 559 O VAL A 549 27.640 25.436 27.856 1.00 0.00 O ATOM 560 CB VAL A 549 29.376 27.818 28.912 1.00 0.00 C ATOM 561 CG1 VAL A 549 28.481 29.061 28.871 1.00 0.00 C ATOM 562 CG2 VAL A 549 30.697 28.203 29.590 1.00 0.00 C ATOM 0 H VAL A 549 30.599 25.749 29.758 1.00 0.00 H new ATOM 0 HA VAL A 549 28.304 27.070 30.595 1.00 0.00 H new ATOM 0 HB VAL A 549 29.559 27.470 27.895 1.00 0.00 H new ATOM 0 HG11 VAL A 549 28.991 29.859 28.332 1.00 0.00 H new ATOM 0 HG12 VAL A 549 27.547 28.820 28.364 1.00 0.00 H new ATOM 0 HG13 VAL A 549 28.268 29.389 29.888 1.00 0.00 H new ATOM 0 HG21 VAL A 549 31.161 29.024 29.043 1.00 0.00 H new ATOM 0 HG22 VAL A 549 30.502 28.515 30.616 1.00 0.00 H new ATOM 0 HG23 VAL A 549 31.368 27.344 29.593 1.00 0.00 H new ATOM 572 N ILE A 550 26.280 26.428 29.347 1.00 0.00 N ATOM 573 CA ILE A 550 24.984 26.051 28.756 1.00 0.00 C ATOM 574 C ILE A 550 24.178 27.332 28.455 1.00 0.00 C ATOM 575 O ILE A 550 24.438 28.375 29.062 1.00 0.00 O ATOM 576 CB ILE A 550 24.197 25.092 29.693 1.00 0.00 C ATOM 577 CG1 ILE A 550 23.776 25.794 31.008 1.00 0.00 C ATOM 578 CG2 ILE A 550 24.952 23.762 29.894 1.00 0.00 C ATOM 579 CD1 ILE A 550 23.276 24.869 32.122 1.00 0.00 C ATOM 0 H ILE A 550 26.166 26.988 30.192 1.00 0.00 H new ATOM 0 HA ILE A 550 25.155 25.511 27.825 1.00 0.00 H new ATOM 0 HB ILE A 550 23.260 24.823 29.206 1.00 0.00 H new ATOM 0 HG12 ILE A 550 24.628 26.360 31.385 1.00 0.00 H new ATOM 0 HG13 ILE A 550 22.991 26.514 30.779 1.00 0.00 H new ATOM 0 HG21 ILE A 550 24.376 23.113 30.554 1.00 0.00 H new ATOM 0 HG22 ILE A 550 25.088 23.271 28.930 1.00 0.00 H new ATOM 0 HG23 ILE A 550 25.926 23.961 30.340 1.00 0.00 H new ATOM 0 HD11 ILE A 550 23.008 25.463 32.996 1.00 0.00 H new ATOM 0 HD12 ILE A 550 22.401 24.321 31.774 1.00 0.00 H new ATOM 0 HD13 ILE A 550 24.063 24.164 32.390 1.00 0.00 H new ATOM 591 N PRO A 551 23.202 27.294 27.530 1.00 0.00 N ATOM 592 CA PRO A 551 22.309 28.423 27.280 1.00 0.00 C ATOM 593 C PRO A 551 21.463 28.714 28.520 1.00 0.00 C ATOM 594 O PRO A 551 21.135 27.814 29.300 1.00 0.00 O ATOM 595 CB PRO A 551 21.454 28.011 26.078 1.00 0.00 C ATOM 596 CG PRO A 551 21.390 26.491 26.204 1.00 0.00 C ATOM 597 CD PRO A 551 22.773 26.145 26.749 1.00 0.00 C ATOM 0 HA PRO A 551 22.851 29.345 27.067 1.00 0.00 H new ATOM 0 HB2 PRO A 551 20.462 28.461 26.116 1.00 0.00 H new ATOM 0 HB3 PRO A 551 21.908 28.319 25.136 1.00 0.00 H new ATOM 0 HG2 PRO A 551 20.596 26.173 26.880 1.00 0.00 H new ATOM 0 HG3 PRO A 551 21.201 26.012 25.243 1.00 0.00 H new ATOM 0 HD2 PRO A 551 22.734 25.248 27.366 1.00 0.00 H new ATOM 0 HD3 PRO A 551 23.472 25.944 25.937 1.00 0.00 H new ATOM 605 N PHE A 552 21.094 29.977 28.714 1.00 0.00 N ATOM 606 CA PHE A 552 20.280 30.361 29.863 1.00 0.00 C ATOM 607 C PHE A 552 18.856 29.809 29.895 1.00 0.00 C ATOM 608 O PHE A 552 18.137 29.865 28.896 1.00 0.00 O ATOM 609 CB PHE A 552 20.299 31.864 30.110 1.00 0.00 C ATOM 610 CG PHE A 552 21.542 32.402 30.796 1.00 0.00 C ATOM 611 CD1 PHE A 552 21.469 32.838 32.131 1.00 0.00 C ATOM 612 CD2 PHE A 552 22.758 32.522 30.094 1.00 0.00 C ATOM 613 CE1 PHE A 552 22.592 33.410 32.752 1.00 0.00 C ATOM 614 CE2 PHE A 552 23.883 33.088 30.719 1.00 0.00 C ATOM 615 CZ PHE A 552 23.799 33.541 32.047 1.00 0.00 C ATOM 0 H PHE A 552 21.344 30.748 28.095 1.00 0.00 H new ATOM 0 HA PHE A 552 20.778 29.862 30.694 1.00 0.00 H new ATOM 0 HB2 PHE A 552 20.186 32.373 29.153 1.00 0.00 H new ATOM 0 HB3 PHE A 552 19.431 32.125 30.715 1.00 0.00 H new ATOM 0 HD1 PHE A 552 20.546 32.733 32.681 1.00 0.00 H new ATOM 0 HD2 PHE A 552 22.826 32.178 29.072 1.00 0.00 H new ATOM 0 HE1 PHE A 552 22.527 33.750 33.775 1.00 0.00 H new ATOM 0 HE2 PHE A 552 24.814 33.175 30.178 1.00 0.00 H new ATOM 0 HZ PHE A 552 24.659 33.988 32.523 1.00 0.00 H new ATOM 700 N GLN A 558 19.109 35.615 32.980 1.00 0.00 N ATOM 701 CA GLN A 558 20.370 36.075 32.399 1.00 0.00 C ATOM 702 C GLN A 558 20.762 37.495 32.819 1.00 0.00 C ATOM 703 O GLN A 558 19.982 38.445 32.686 1.00 0.00 O ATOM 704 CB GLN A 558 20.332 35.919 30.870 1.00 0.00 C ATOM 705 CG GLN A 558 21.702 36.202 30.223 1.00 0.00 C ATOM 706 CD GLN A 558 21.841 35.563 28.837 1.00 0.00 C ATOM 707 OE1 GLN A 558 20.866 35.283 28.149 1.00 0.00 O ATOM 708 NE2 GLN A 558 23.046 35.286 28.379 1.00 0.00 N ATOM 0 HA GLN A 558 21.157 35.438 32.802 1.00 0.00 H new ATOM 0 HB2 GLN A 558 20.014 34.907 30.617 1.00 0.00 H new ATOM 0 HB3 GLN A 558 19.588 36.599 30.455 1.00 0.00 H new ATOM 0 HG2 GLN A 558 21.844 37.279 30.139 1.00 0.00 H new ATOM 0 HG3 GLN A 558 22.492 35.826 30.873 1.00 0.00 H new ATOM 0 HE21 GLN A 558 23.869 35.512 28.938 1.00 0.00 H new ATOM 0 HE22 GLN A 558 23.156 34.846 27.466 1.00 0.00 H new ATOM 717 N ASP A 559 22.022 37.644 33.229 1.00 0.00 N ATOM 718 CA ASP A 559 22.566 38.854 33.851 1.00 0.00 C ATOM 719 C ASP A 559 23.819 39.299 33.057 1.00 0.00 C ATOM 720 O ASP A 559 24.571 38.474 32.527 1.00 0.00 O ATOM 721 CB ASP A 559 22.877 38.563 35.337 1.00 0.00 C ATOM 722 CG ASP A 559 21.738 37.897 36.143 1.00 0.00 C ATOM 723 OD1 ASP A 559 21.992 37.286 37.211 1.00 0.00 O ATOM 724 OD2 ASP A 559 20.566 38.007 35.736 1.00 0.00 O ATOM 0 H ASP A 559 22.716 36.902 33.135 1.00 0.00 H new ATOM 0 HA ASP A 559 21.846 39.672 33.824 1.00 0.00 H new ATOM 0 HB2 ASP A 559 23.756 37.920 35.386 1.00 0.00 H new ATOM 0 HB3 ASP A 559 23.141 39.502 35.824 1.00 0.00 H new ATOM 729 N GLU A 560 24.051 40.607 32.917 1.00 0.00 N ATOM 730 CA GLU A 560 25.100 41.148 32.033 1.00 0.00 C ATOM 731 C GLU A 560 26.509 41.034 32.645 1.00 0.00 C ATOM 732 O GLU A 560 26.724 41.453 33.785 1.00 0.00 O ATOM 733 CB GLU A 560 24.769 42.596 31.646 1.00 0.00 C ATOM 734 CG GLU A 560 25.684 43.124 30.531 1.00 0.00 C ATOM 735 CD GLU A 560 25.270 44.520 30.053 1.00 0.00 C ATOM 736 OE1 GLU A 560 24.957 45.389 30.902 1.00 0.00 O ATOM 737 OE2 GLU A 560 25.272 44.756 28.817 1.00 0.00 O ATOM 0 H GLU A 560 23.520 41.324 33.411 1.00 0.00 H new ATOM 0 HA GLU A 560 25.115 40.538 31.130 1.00 0.00 H new ATOM 0 HB2 GLU A 560 23.731 42.654 31.319 1.00 0.00 H new ATOM 0 HB3 GLU A 560 24.863 43.235 32.524 1.00 0.00 H new ATOM 0 HG2 GLU A 560 26.712 43.156 30.892 1.00 0.00 H new ATOM 0 HG3 GLU A 560 25.663 42.433 29.689 1.00 0.00 H new ATOM 744 N GLY A 561 27.479 40.496 31.896 1.00 0.00 N ATOM 745 CA GLY A 561 28.833 40.184 32.387 1.00 0.00 C ATOM 746 C GLY A 561 28.949 38.854 33.152 1.00 0.00 C ATOM 747 O GLY A 561 30.041 38.486 33.592 1.00 0.00 O ATOM 0 H GLY A 561 27.346 40.260 30.913 1.00 0.00 H new ATOM 0 HA2 GLY A 561 29.516 40.160 31.538 1.00 0.00 H new ATOM 0 HA3 GLY A 561 29.164 40.993 33.039 1.00 0.00 H new ATOM 751 N TRP A 562 27.837 38.131 33.302 1.00 0.00 N ATOM 752 CA TRP A 562 27.731 36.799 33.902 1.00 0.00 C ATOM 753 C TRP A 562 27.590 35.687 32.847 1.00 0.00 C ATOM 754 O TRP A 562 27.235 35.955 31.694 1.00 0.00 O ATOM 755 CB TRP A 562 26.568 36.815 34.908 1.00 0.00 C ATOM 756 CG TRP A 562 26.824 37.567 36.177 1.00 0.00 C ATOM 757 CD1 TRP A 562 26.850 38.912 36.324 1.00 0.00 C ATOM 758 CD2 TRP A 562 27.285 37.037 37.453 1.00 0.00 C ATOM 759 NE1 TRP A 562 27.279 39.235 37.594 1.00 0.00 N ATOM 760 CE2 TRP A 562 27.582 38.120 38.326 1.00 0.00 C ATOM 761 CE3 TRP A 562 27.410 35.742 37.982 1.00 0.00 C ATOM 762 CZ2 TRP A 562 28.020 37.935 39.641 1.00 0.00 C ATOM 763 CZ3 TRP A 562 27.844 35.541 39.302 1.00 0.00 C ATOM 764 CH2 TRP A 562 28.160 36.629 40.129 1.00 0.00 C ATOM 0 H TRP A 562 26.932 38.481 32.989 1.00 0.00 H new ATOM 0 HA TRP A 562 28.656 36.564 34.428 1.00 0.00 H new ATOM 0 HB2 TRP A 562 25.694 37.247 34.420 1.00 0.00 H new ATOM 0 HB3 TRP A 562 26.315 35.785 35.161 1.00 0.00 H new ATOM 0 HD1 TRP A 562 26.576 39.625 35.561 1.00 0.00 H new ATOM 0 HE1 TRP A 562 27.360 40.189 37.945 1.00 0.00 H new ATOM 0 HE3 TRP A 562 27.169 34.889 37.365 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 28.246 38.784 40.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 27.936 34.536 39.686 1.00 0.00 H new ATOM 0 HH2 TRP A 562 28.510 36.461 41.137 1.00 0.00 H new ATOM 775 N LEU A 563 27.835 34.429 33.219 1.00 0.00 N ATOM 776 CA LEU A 563 27.596 33.254 32.365 1.00 0.00 C ATOM 777 C LEU A 563 26.986 32.103 33.176 1.00 0.00 C ATOM 778 O LEU A 563 27.165 32.051 34.389 1.00 0.00 O ATOM 779 CB LEU A 563 28.904 32.821 31.670 1.00 0.00 C ATOM 780 CG LEU A 563 29.140 33.439 30.277 1.00 0.00 C ATOM 781 CD1 LEU A 563 30.475 32.918 29.740 1.00 0.00 C ATOM 782 CD2 LEU A 563 28.069 33.052 29.251 1.00 0.00 C ATOM 0 H LEU A 563 28.211 34.190 34.136 1.00 0.00 H new ATOM 0 HA LEU A 563 26.877 33.527 31.592 1.00 0.00 H new ATOM 0 HB2 LEU A 563 29.743 33.084 32.314 1.00 0.00 H new ATOM 0 HB3 LEU A 563 28.904 31.735 31.573 1.00 0.00 H new ATOM 0 HG LEU A 563 29.118 34.521 30.404 1.00 0.00 H new ATOM 0 HD11 LEU A 563 30.662 33.344 28.754 1.00 0.00 H new ATOM 0 HD12 LEU A 563 31.278 33.208 30.418 1.00 0.00 H new ATOM 0 HD13 LEU A 563 30.438 31.831 29.665 1.00 0.00 H new ATOM 0 HD21 LEU A 563 28.296 33.521 28.294 1.00 0.00 H new ATOM 0 HD22 LEU A 563 28.055 31.969 29.131 1.00 0.00 H new ATOM 0 HD23 LEU A 563 27.093 33.391 29.598 1.00 0.00 H new ATOM 794 N MET A 564 26.255 31.203 32.507 1.00 0.00 N ATOM 795 CA MET A 564 25.581 30.048 33.113 1.00 0.00 C ATOM 796 C MET A 564 26.203 28.728 32.659 1.00 0.00 C ATOM 797 O MET A 564 26.537 28.544 31.491 1.00 0.00 O ATOM 798 CB MET A 564 24.072 30.094 32.816 1.00 0.00 C ATOM 799 CG MET A 564 23.267 28.937 33.429 1.00 0.00 C ATOM 800 SD MET A 564 21.457 29.139 33.402 1.00 0.00 S ATOM 801 CE MET A 564 21.265 30.413 34.677 1.00 0.00 C ATOM 0 H MET A 564 26.112 31.260 31.499 1.00 0.00 H new ATOM 0 HA MET A 564 25.718 30.104 34.193 1.00 0.00 H new ATOM 0 HB2 MET A 564 23.670 31.037 33.187 1.00 0.00 H new ATOM 0 HB3 MET A 564 23.927 30.089 31.736 1.00 0.00 H new ATOM 0 HG2 MET A 564 23.521 28.020 32.898 1.00 0.00 H new ATOM 0 HG3 MET A 564 23.585 28.804 34.463 1.00 0.00 H new ATOM 0 HE1 MET A 564 20.218 30.709 34.741 1.00 0.00 H new ATOM 0 HE2 MET A 564 21.590 30.017 35.639 1.00 0.00 H new ATOM 0 HE3 MET A 564 21.872 31.281 34.419 1.00 0.00 H new ATOM 811 N GLY A 565 26.333 27.788 33.586 1.00 0.00 N ATOM 812 CA GLY A 565 26.867 26.460 33.336 1.00 0.00 C ATOM 813 C GLY A 565 26.678 25.518 34.517 1.00 0.00 C ATOM 814 O GLY A 565 26.065 25.867 35.528 1.00 0.00 O ATOM 0 H GLY A 565 26.062 27.934 34.558 1.00 0.00 H new ATOM 0 HA2 GLY A 565 26.380 26.037 32.458 1.00 0.00 H new ATOM 0 HA3 GLY A 565 27.929 26.538 33.105 1.00 0.00 H new ATOM 818 N VAL A 566 27.244 24.323 34.384 1.00 0.00 N ATOM 819 CA VAL A 566 27.376 23.319 35.448 1.00 0.00 C ATOM 820 C VAL A 566 28.832 22.868 35.532 1.00 0.00 C ATOM 821 O VAL A 566 29.496 22.740 34.501 1.00 0.00 O ATOM 822 CB VAL A 566 26.380 22.158 35.230 1.00 0.00 C ATOM 823 CG1 VAL A 566 26.673 21.361 33.953 1.00 0.00 C ATOM 824 CG2 VAL A 566 26.368 21.180 36.408 1.00 0.00 C ATOM 0 H VAL A 566 27.641 24.009 33.498 1.00 0.00 H new ATOM 0 HA VAL A 566 27.115 23.752 36.414 1.00 0.00 H new ATOM 0 HB VAL A 566 25.405 22.637 35.138 1.00 0.00 H new ATOM 0 HG11 VAL A 566 25.943 20.558 33.850 1.00 0.00 H new ATOM 0 HG12 VAL A 566 26.610 22.022 33.089 1.00 0.00 H new ATOM 0 HG13 VAL A 566 27.675 20.935 34.012 1.00 0.00 H new ATOM 0 HG21 VAL A 566 25.653 20.381 36.210 1.00 0.00 H new ATOM 0 HG22 VAL A 566 27.363 20.754 36.537 1.00 0.00 H new ATOM 0 HG23 VAL A 566 26.079 21.708 37.317 1.00 0.00 H new ATOM 834 N LYS A 567 29.369 22.663 36.736 1.00 0.00 N ATOM 835 CA LYS A 567 30.735 22.162 36.910 1.00 0.00 C ATOM 836 C LYS A 567 30.904 20.794 36.258 1.00 0.00 C ATOM 837 O LYS A 567 30.043 19.932 36.429 1.00 0.00 O ATOM 838 CB LYS A 567 31.085 22.144 38.404 1.00 0.00 C ATOM 839 CG LYS A 567 31.765 23.466 38.798 1.00 0.00 C ATOM 840 CD LYS A 567 32.261 23.443 40.243 1.00 0.00 C ATOM 841 CE LYS A 567 31.089 23.433 41.226 1.00 0.00 C ATOM 842 NZ LYS A 567 31.574 23.340 42.616 1.00 0.00 N ATOM 0 H LYS A 567 28.875 22.837 37.611 1.00 0.00 H new ATOM 0 HA LYS A 567 31.434 22.830 36.407 1.00 0.00 H new ATOM 0 HB2 LYS A 567 30.182 21.999 38.996 1.00 0.00 H new ATOM 0 HB3 LYS A 567 31.747 21.306 38.621 1.00 0.00 H new ATOM 0 HG2 LYS A 567 32.604 23.656 38.129 1.00 0.00 H new ATOM 0 HG3 LYS A 567 31.062 24.289 38.669 1.00 0.00 H new ATOM 0 HD2 LYS A 567 32.882 22.562 40.404 1.00 0.00 H new ATOM 0 HD3 LYS A 567 32.889 24.314 40.429 1.00 0.00 H new ATOM 0 HE2 LYS A 567 30.497 24.340 41.102 1.00 0.00 H new ATOM 0 HE3 LYS A 567 30.432 22.591 41.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 30.869 22.843 43.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 32.471 22.815 42.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 31.724 24.296 42.996 1.00 0.00 H new ATOM 856 N GLU A 568 32.007 20.571 35.539 1.00 0.00 N ATOM 857 CA GLU A 568 32.259 19.254 34.943 1.00 0.00 C ATOM 858 C GLU A 568 32.285 18.169 36.026 1.00 0.00 C ATOM 859 O GLU A 568 31.651 17.145 35.829 1.00 0.00 O ATOM 860 CB GLU A 568 33.519 19.201 34.050 1.00 0.00 C ATOM 861 CG GLU A 568 33.685 17.794 33.427 1.00 0.00 C ATOM 862 CD GLU A 568 34.455 17.697 32.098 1.00 0.00 C ATOM 863 OE1 GLU A 568 35.143 18.649 31.660 1.00 0.00 O ATOM 864 OE2 GLU A 568 34.348 16.632 31.442 1.00 0.00 O ATOM 0 H GLU A 568 32.728 21.269 35.357 1.00 0.00 H new ATOM 0 HA GLU A 568 31.426 19.058 34.269 1.00 0.00 H new ATOM 0 HB2 GLU A 568 33.443 19.948 33.260 1.00 0.00 H new ATOM 0 HB3 GLU A 568 34.401 19.450 34.640 1.00 0.00 H new ATOM 0 HG2 GLU A 568 34.189 17.160 34.156 1.00 0.00 H new ATOM 0 HG3 GLU A 568 32.691 17.374 33.272 1.00 0.00 H new ATOM 871 N SER A 569 32.882 18.411 37.198 1.00 0.00 N ATOM 872 CA SER A 569 32.866 17.470 38.331 1.00 0.00 C ATOM 873 C SER A 569 31.445 17.138 38.817 1.00 0.00 C ATOM 874 O SER A 569 31.100 15.975 39.028 1.00 0.00 O ATOM 875 CB SER A 569 33.646 18.077 39.501 1.00 0.00 C ATOM 876 OG SER A 569 34.986 18.334 39.144 1.00 0.00 O ATOM 0 H SER A 569 33.395 19.271 37.392 1.00 0.00 H new ATOM 0 HA SER A 569 33.322 16.544 37.980 1.00 0.00 H new ATOM 0 HB2 SER A 569 33.168 19.004 39.818 1.00 0.00 H new ATOM 0 HB3 SER A 569 33.618 17.396 40.352 1.00 0.00 H new ATOM 0 HG SER A 569 35.460 18.723 39.909 1.00 0.00 H new ATOM 882 N ASP A 570 30.584 18.153 38.940 1.00 0.00 N ATOM 883 CA ASP A 570 29.161 17.986 39.257 1.00 0.00 C ATOM 884 C ASP A 570 28.342 17.203 38.216 1.00 0.00 C ATOM 885 O ASP A 570 27.439 16.431 38.557 1.00 0.00 O ATOM 886 CB ASP A 570 28.519 19.348 39.587 1.00 0.00 C ATOM 887 CG ASP A 570 28.538 19.768 41.063 1.00 0.00 C ATOM 888 OD1 ASP A 570 29.162 19.091 41.918 1.00 0.00 O ATOM 889 OD2 ASP A 570 27.909 20.807 41.380 1.00 0.00 O ATOM 0 H ASP A 570 30.859 19.128 38.821 1.00 0.00 H new ATOM 0 HA ASP A 570 29.134 17.349 40.141 1.00 0.00 H new ATOM 0 HB2 ASP A 570 29.029 20.116 39.006 1.00 0.00 H new ATOM 0 HB3 ASP A 570 27.483 19.329 39.250 1.00 0.00 H new ATOM 894 N TRP A 571 28.680 17.372 36.939 1.00 0.00 N ATOM 895 CA TRP A 571 28.084 16.645 35.818 1.00 0.00 C ATOM 896 C TRP A 571 28.653 15.227 35.640 1.00 0.00 C ATOM 897 O TRP A 571 27.926 14.301 35.278 1.00 0.00 O ATOM 898 CB TRP A 571 28.220 17.538 34.576 1.00 0.00 C ATOM 899 CG TRP A 571 27.728 16.982 33.278 1.00 0.00 C ATOM 900 CD1 TRP A 571 28.489 16.389 32.332 1.00 0.00 C ATOM 901 CD2 TRP A 571 26.348 16.785 32.848 1.00 0.00 C ATOM 902 NE1 TRP A 571 27.690 15.894 31.323 1.00 0.00 N ATOM 903 CE2 TRP A 571 26.355 16.114 31.589 1.00 0.00 C ATOM 904 CE3 TRP A 571 25.092 17.125 33.393 1.00 0.00 C ATOM 905 CZ2 TRP A 571 25.173 15.802 30.904 1.00 0.00 C ATOM 906 CZ3 TRP A 571 23.901 16.817 32.709 1.00 0.00 C ATOM 907 CH2 TRP A 571 23.937 16.145 31.475 1.00 0.00 C ATOM 0 H TRP A 571 29.396 18.037 36.647 1.00 0.00 H new ATOM 0 HA TRP A 571 27.028 16.454 36.011 1.00 0.00 H new ATOM 0 HB2 TRP A 571 27.686 18.469 34.769 1.00 0.00 H new ATOM 0 HB3 TRP A 571 29.273 17.793 34.457 1.00 0.00 H new ATOM 0 HD1 TRP A 571 29.566 16.314 32.362 1.00 0.00 H new ATOM 0 HE1 TRP A 571 28.041 15.426 30.488 1.00 0.00 H new ATOM 0 HE3 TRP A 571 25.044 17.628 34.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 571 25.212 15.303 29.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 571 22.950 17.100 33.136 1.00 0.00 H new ATOM 0 HH2 TRP A 571 23.017 15.893 30.968 1.00 0.00 H new ATOM 918 N ASN A 572 29.929 15.025 35.976 1.00 0.00 N ATOM 919 CA ASN A 572 30.648 13.751 35.925 1.00 0.00 C ATOM 920 C ASN A 572 30.182 12.787 37.027 1.00 0.00 C ATOM 921 O ASN A 572 30.130 11.582 36.798 1.00 0.00 O ATOM 922 CB ASN A 572 32.158 14.069 35.992 1.00 0.00 C ATOM 923 CG ASN A 572 33.068 12.999 35.431 1.00 0.00 C ATOM 924 OD1 ASN A 572 32.725 11.833 35.305 1.00 0.00 O ATOM 925 ND2 ASN A 572 34.243 13.400 35.012 1.00 0.00 N ATOM 0 H ASN A 572 30.520 15.787 36.309 1.00 0.00 H new ATOM 0 HA ASN A 572 30.434 13.226 34.994 1.00 0.00 H new ATOM 0 HB2 ASN A 572 32.341 14.998 35.453 1.00 0.00 H new ATOM 0 HB3 ASN A 572 32.430 14.245 37.033 1.00 0.00 H new ATOM 0 HD21 ASN A 572 34.882 12.736 34.575 1.00 0.00 H new ATOM 0 HD22 ASN A 572 34.518 14.376 35.123 1.00 0.00 H new ATOM 932 N GLN A 573 29.738 13.294 38.183 1.00 0.00 N ATOM 933 CA GLN A 573 29.095 12.472 39.224 1.00 0.00 C ATOM 934 C GLN A 573 27.591 12.222 38.987 1.00 0.00 C ATOM 935 O GLN A 573 26.924 11.589 39.805 1.00 0.00 O ATOM 936 CB GLN A 573 29.392 13.047 40.617 1.00 0.00 C ATOM 937 CG GLN A 573 30.889 12.916 40.960 1.00 0.00 C ATOM 938 CD GLN A 573 31.226 13.010 42.449 1.00 0.00 C ATOM 939 OE1 GLN A 573 30.375 13.003 43.331 1.00 0.00 O ATOM 940 NE2 GLN A 573 32.495 13.107 42.777 1.00 0.00 N ATOM 0 H GLN A 573 29.812 14.282 38.426 1.00 0.00 H new ATOM 0 HA GLN A 573 29.540 11.479 39.163 1.00 0.00 H new ATOM 0 HB2 GLN A 573 29.098 14.096 40.652 1.00 0.00 H new ATOM 0 HB3 GLN A 573 28.797 12.524 41.365 1.00 0.00 H new ATOM 0 HG2 GLN A 573 31.250 11.959 40.582 1.00 0.00 H new ATOM 0 HG3 GLN A 573 31.436 13.695 40.430 1.00 0.00 H new ATOM 0 HE21 GLN A 573 33.211 13.114 42.050 1.00 0.00 H new ATOM 0 HE22 GLN A 573 32.764 13.176 43.758 1.00 0.00 H new ATOM 949 N HIS A 574 27.053 12.698 37.860 1.00 0.00 N ATOM 950 CA HIS A 574 25.654 12.552 37.434 1.00 0.00 C ATOM 951 C HIS A 574 24.625 13.121 38.437 1.00 0.00 C ATOM 952 O HIS A 574 23.494 12.631 38.545 1.00 0.00 O ATOM 953 CB HIS A 574 25.355 11.109 36.984 1.00 0.00 C ATOM 954 CG HIS A 574 26.369 10.542 36.020 1.00 0.00 C ATOM 955 ND1 HIS A 574 26.690 11.049 34.782 1.00 0.00 N ATOM 956 CD2 HIS A 574 27.080 9.383 36.173 1.00 0.00 C ATOM 957 CE1 HIS A 574 27.608 10.247 34.222 1.00 0.00 C ATOM 958 NE2 HIS A 574 27.888 9.212 35.037 1.00 0.00 N ATOM 0 H HIS A 574 27.608 13.223 37.184 1.00 0.00 H new ATOM 0 HA HIS A 574 25.529 13.188 36.557 1.00 0.00 H new ATOM 0 HB2 HIS A 574 25.308 10.468 37.864 1.00 0.00 H new ATOM 0 HB3 HIS A 574 24.371 11.082 36.517 1.00 0.00 H new ATOM 0 HD2 HIS A 574 27.029 8.715 37.020 1.00 0.00 H new ATOM 0 HE1 HIS A 574 28.059 10.409 33.254 1.00 0.00 H new ATOM 0 HE2 HIS A 574 28.552 8.457 34.864 1.00 0.00 H new ATOM 966 N LYS A 575 25.010 14.161 39.189 1.00 0.00 N ATOM 967 CA LYS A 575 24.131 14.907 40.108 1.00 0.00 C ATOM 968 C LYS A 575 23.065 15.702 39.340 1.00 0.00 C ATOM 969 O LYS A 575 23.231 15.969 38.146 1.00 0.00 O ATOM 970 CB LYS A 575 24.981 15.853 40.971 1.00 0.00 C ATOM 971 CG LYS A 575 26.019 15.169 41.880 1.00 0.00 C ATOM 972 CD LYS A 575 27.229 16.097 42.053 1.00 0.00 C ATOM 973 CE LYS A 575 28.121 15.690 43.224 1.00 0.00 C ATOM 974 NZ LYS A 575 29.315 16.562 43.306 1.00 0.00 N ATOM 0 H LYS A 575 25.965 14.518 39.177 1.00 0.00 H new ATOM 0 HA LYS A 575 23.613 14.193 40.748 1.00 0.00 H new ATOM 0 HB2 LYS A 575 25.502 16.547 40.312 1.00 0.00 H new ATOM 0 HB3 LYS A 575 24.313 16.446 41.595 1.00 0.00 H new ATOM 0 HG2 LYS A 575 25.577 14.943 42.851 1.00 0.00 H new ATOM 0 HG3 LYS A 575 26.333 14.220 41.444 1.00 0.00 H new ATOM 0 HD2 LYS A 575 27.817 16.095 41.135 1.00 0.00 H new ATOM 0 HD3 LYS A 575 26.880 17.118 42.205 1.00 0.00 H new ATOM 0 HE2 LYS A 575 27.557 15.751 44.155 1.00 0.00 H new ATOM 0 HE3 LYS A 575 28.431 14.652 43.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 29.489 16.820 44.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 30.142 16.055 42.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 29.154 17.424 42.747 1.00 0.00 H new ATOM 988 N GLU A 576 21.995 16.107 40.023 1.00 0.00 N ATOM 989 CA GLU A 576 20.854 16.835 39.439 1.00 0.00 C ATOM 990 C GLU A 576 21.243 18.146 38.719 1.00 0.00 C ATOM 991 O GLU A 576 21.528 19.165 39.351 1.00 0.00 O ATOM 992 CB GLU A 576 19.758 17.068 40.501 1.00 0.00 C ATOM 993 CG GLU A 576 20.212 17.805 41.777 1.00 0.00 C ATOM 994 CD GLU A 576 19.206 17.758 42.934 1.00 0.00 C ATOM 995 OE1 GLU A 576 18.106 17.163 42.812 1.00 0.00 O ATOM 996 OE2 GLU A 576 19.511 18.326 44.011 1.00 0.00 O ATOM 0 H GLU A 576 21.889 15.937 41.023 1.00 0.00 H new ATOM 0 HA GLU A 576 20.453 16.193 38.654 1.00 0.00 H new ATOM 0 HB2 GLU A 576 18.949 17.637 40.043 1.00 0.00 H new ATOM 0 HB3 GLU A 576 19.345 16.101 40.789 1.00 0.00 H new ATOM 0 HG2 GLU A 576 21.154 17.373 42.114 1.00 0.00 H new ATOM 0 HG3 GLU A 576 20.410 18.847 41.528 1.00 0.00 H new ATOM 1003 N LEU A 577 21.215 18.136 37.382 1.00 0.00 N ATOM 1004 CA LEU A 577 21.672 19.236 36.518 1.00 0.00 C ATOM 1005 C LEU A 577 20.992 20.566 36.867 1.00 0.00 C ATOM 1006 O LEU A 577 21.654 21.580 37.081 1.00 0.00 O ATOM 1007 CB LEU A 577 21.401 18.824 35.055 1.00 0.00 C ATOM 1008 CG LEU A 577 21.597 19.937 34.002 1.00 0.00 C ATOM 1009 CD1 LEU A 577 23.047 20.406 33.897 1.00 0.00 C ATOM 1010 CD2 LEU A 577 21.116 19.499 32.619 1.00 0.00 C ATOM 0 H LEU A 577 20.863 17.338 36.852 1.00 0.00 H new ATOM 0 HA LEU A 577 22.738 19.405 36.670 1.00 0.00 H new ATOM 0 HB2 LEU A 577 22.057 17.991 34.803 1.00 0.00 H new ATOM 0 HB3 LEU A 577 20.377 18.457 34.983 1.00 0.00 H new ATOM 0 HG LEU A 577 20.991 20.773 34.351 1.00 0.00 H new ATOM 0 HD11 LEU A 577 23.123 21.188 33.142 1.00 0.00 H new ATOM 0 HD12 LEU A 577 23.373 20.799 34.860 1.00 0.00 H new ATOM 0 HD13 LEU A 577 23.682 19.566 33.614 1.00 0.00 H new ATOM 0 HD21 LEU A 577 21.271 20.309 31.906 1.00 0.00 H new ATOM 0 HD22 LEU A 577 21.679 18.622 32.299 1.00 0.00 H new ATOM 0 HD23 LEU A 577 20.055 19.253 32.664 1.00 0.00 H new ATOM 1022 N GLU A 578 19.666 20.533 36.988 1.00 0.00 N ATOM 1023 CA GLU A 578 18.792 21.675 37.263 1.00 0.00 C ATOM 1024 C GLU A 578 19.088 22.418 38.578 1.00 0.00 C ATOM 1025 O GLU A 578 18.690 23.573 38.720 1.00 0.00 O ATOM 1026 CB GLU A 578 17.329 21.196 37.247 1.00 0.00 C ATOM 1027 CG GLU A 578 17.009 20.068 38.251 1.00 0.00 C ATOM 1028 CD GLU A 578 17.147 18.644 37.687 1.00 0.00 C ATOM 1029 OE1 GLU A 578 16.521 17.712 38.251 1.00 0.00 O ATOM 1030 OE2 GLU A 578 17.864 18.407 36.686 1.00 0.00 O ATOM 0 H GLU A 578 19.143 19.662 36.892 1.00 0.00 H new ATOM 0 HA GLU A 578 18.985 22.404 36.476 1.00 0.00 H new ATOM 0 HB2 GLU A 578 16.680 22.046 37.458 1.00 0.00 H new ATOM 0 HB3 GLU A 578 17.085 20.850 36.243 1.00 0.00 H new ATOM 0 HG2 GLU A 578 17.670 20.168 39.112 1.00 0.00 H new ATOM 0 HG3 GLU A 578 15.990 20.203 38.614 1.00 0.00 H new ATOM 1037 N LYS A 579 19.803 21.796 39.526 1.00 0.00 N ATOM 1038 CA LYS A 579 20.198 22.420 40.802 1.00 0.00 C ATOM 1039 C LYS A 579 21.693 22.408 41.107 1.00 0.00 C ATOM 1040 O LYS A 579 22.139 23.084 42.036 1.00 0.00 O ATOM 1041 CB LYS A 579 19.360 21.834 41.947 1.00 0.00 C ATOM 1042 CG LYS A 579 17.919 22.385 42.035 1.00 0.00 C ATOM 1043 CD LYS A 579 17.834 23.908 42.239 1.00 0.00 C ATOM 1044 CE LYS A 579 16.388 24.405 42.380 1.00 0.00 C ATOM 1045 NZ LYS A 579 16.343 25.888 42.417 1.00 0.00 N ATOM 0 H LYS A 579 20.128 20.834 39.430 1.00 0.00 H new ATOM 0 HA LYS A 579 19.981 23.483 40.697 1.00 0.00 H new ATOM 0 HB2 LYS A 579 19.315 20.751 41.830 1.00 0.00 H new ATOM 0 HB3 LYS A 579 19.869 22.031 42.890 1.00 0.00 H new ATOM 0 HG2 LYS A 579 17.386 22.122 41.121 1.00 0.00 H new ATOM 0 HG3 LYS A 579 17.403 21.891 42.858 1.00 0.00 H new ATOM 0 HD2 LYS A 579 18.398 24.183 43.130 1.00 0.00 H new ATOM 0 HD3 LYS A 579 18.306 24.411 41.395 1.00 0.00 H new ATOM 0 HE2 LYS A 579 15.790 24.039 41.546 1.00 0.00 H new ATOM 0 HE3 LYS A 579 15.946 24.000 43.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 15.357 26.203 42.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 16.896 26.232 43.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 16.744 26.270 41.537 1.00 0.00 H new ATOM 1059 N CYS A 580 22.474 21.697 40.307 1.00 0.00 N ATOM 1060 CA CYS A 580 23.920 21.848 40.237 1.00 0.00 C ATOM 1061 C CYS A 580 24.340 23.051 39.372 1.00 0.00 C ATOM 1062 O CYS A 580 25.339 23.705 39.677 1.00 0.00 O ATOM 1063 CB CYS A 580 24.475 20.529 39.709 1.00 0.00 C ATOM 1064 SG CYS A 580 24.273 19.241 40.968 1.00 0.00 S ATOM 0 H CYS A 580 22.112 20.983 39.675 1.00 0.00 H new ATOM 0 HA CYS A 580 24.330 22.063 41.224 1.00 0.00 H new ATOM 0 HB2 CYS A 580 23.955 20.243 38.795 1.00 0.00 H new ATOM 0 HB3 CYS A 580 25.529 20.642 39.454 1.00 0.00 H new ATOM 0 HG CYS A 580 23.103 18.689 40.841 1.00 0.00 H new ATOM 1070 N ARG A 581 23.575 23.392 38.324 1.00 0.00 N ATOM 1071 CA ARG A 581 23.819 24.585 37.494 1.00 0.00 C ATOM 1072 C ARG A 581 23.721 25.888 38.289 1.00 0.00 C ATOM 1073 O ARG A 581 23.033 25.969 39.308 1.00 0.00 O ATOM 1074 CB ARG A 581 22.867 24.612 36.281 1.00 0.00 C ATOM 1075 CG ARG A 581 21.408 24.915 36.667 1.00 0.00 C ATOM 1076 CD ARG A 581 20.485 24.897 35.449 1.00 0.00 C ATOM 1077 NE ARG A 581 19.088 25.121 35.865 1.00 0.00 N ATOM 1078 CZ ARG A 581 17.988 24.939 35.162 1.00 0.00 C ATOM 1079 NH1 ARG A 581 17.964 24.513 33.939 1.00 0.00 N ATOM 1080 NH2 ARG A 581 16.835 25.186 35.694 1.00 0.00 N ATOM 0 H ARG A 581 22.766 22.847 38.026 1.00 0.00 H new ATOM 0 HA ARG A 581 24.846 24.512 37.135 1.00 0.00 H new ATOM 0 HB2 ARG A 581 23.213 25.364 35.572 1.00 0.00 H new ATOM 0 HB3 ARG A 581 22.910 23.649 35.771 1.00 0.00 H new ATOM 0 HG2 ARG A 581 21.064 24.180 37.395 1.00 0.00 H new ATOM 0 HG3 ARG A 581 21.355 25.891 37.150 1.00 0.00 H new ATOM 0 HD2 ARG A 581 20.789 25.668 34.742 1.00 0.00 H new ATOM 0 HD3 ARG A 581 20.570 23.940 34.934 1.00 0.00 H new ATOM 0 HE ARG A 581 18.956 25.460 36.818 1.00 0.00 H new ATOM 0 HH11 ARG A 581 18.836 24.294 33.458 1.00 0.00 H new ATOM 0 HH12 ARG A 581 17.073 24.396 33.457 1.00 0.00 H new ATOM 0 HH21 ARG A 581 16.778 25.521 36.656 1.00 0.00 H new ATOM 0 HH22 ARG A 581 15.983 25.046 35.152 1.00 0.00 H new ATOM 1094 N GLY A 582 24.366 26.925 37.771 1.00 0.00 N ATOM 1095 CA GLY A 582 24.320 28.287 38.308 1.00 0.00 C ATOM 1096 C GLY A 582 24.959 29.317 37.384 1.00 0.00 C ATOM 1097 O GLY A 582 25.565 28.968 36.367 1.00 0.00 O ATOM 0 H GLY A 582 24.954 26.844 36.941 1.00 0.00 H new ATOM 0 HA2 GLY A 582 23.282 28.565 38.489 1.00 0.00 H new ATOM 0 HA3 GLY A 582 24.828 28.308 39.272 1.00 0.00 H new ATOM 1101 N VAL A 583 24.852 30.589 37.771 1.00 0.00 N ATOM 1102 CA VAL A 583 25.575 31.709 37.158 1.00 0.00 C ATOM 1103 C VAL A 583 26.876 32.010 37.894 1.00 0.00 C ATOM 1104 O VAL A 583 26.942 31.958 39.120 1.00 0.00 O ATOM 1105 CB VAL A 583 24.716 32.983 37.012 1.00 0.00 C ATOM 1106 CG1 VAL A 583 23.449 32.717 36.204 1.00 0.00 C ATOM 1107 CG2 VAL A 583 24.312 33.603 38.351 1.00 0.00 C ATOM 0 H VAL A 583 24.245 30.878 38.538 1.00 0.00 H new ATOM 0 HA VAL A 583 25.821 31.384 36.147 1.00 0.00 H new ATOM 0 HB VAL A 583 25.357 33.691 36.487 1.00 0.00 H new ATOM 0 HG11 VAL A 583 22.870 33.637 36.122 1.00 0.00 H new ATOM 0 HG12 VAL A 583 23.720 32.369 35.207 1.00 0.00 H new ATOM 0 HG13 VAL A 583 22.851 31.955 36.705 1.00 0.00 H new ATOM 0 HG21 VAL A 583 23.710 34.494 38.173 1.00 0.00 H new ATOM 0 HG22 VAL A 583 23.731 32.882 38.925 1.00 0.00 H new ATOM 0 HG23 VAL A 583 25.207 33.875 38.911 1.00 0.00 H new ATOM 1117 N PHE A 584 27.912 32.368 37.147 1.00 0.00 N ATOM 1118 CA PHE A 584 29.222 32.763 37.662 1.00 0.00 C ATOM 1119 C PHE A 584 29.794 34.003 36.953 1.00 0.00 C ATOM 1120 O PHE A 584 29.433 34.258 35.796 1.00 0.00 O ATOM 1121 CB PHE A 584 30.193 31.576 37.635 1.00 0.00 C ATOM 1122 CG PHE A 584 30.347 30.929 36.274 1.00 0.00 C ATOM 1123 CD1 PHE A 584 29.440 29.942 35.849 1.00 0.00 C ATOM 1124 CD2 PHE A 584 31.393 31.335 35.424 1.00 0.00 C ATOM 1125 CE1 PHE A 584 29.591 29.344 34.588 1.00 0.00 C ATOM 1126 CE2 PHE A 584 31.537 30.743 34.158 1.00 0.00 C ATOM 1127 CZ PHE A 584 30.645 29.736 33.749 1.00 0.00 C ATOM 0 H PHE A 584 27.864 32.393 36.128 1.00 0.00 H new ATOM 0 HA PHE A 584 29.086 33.061 38.702 1.00 0.00 H new ATOM 0 HB2 PHE A 584 31.171 31.914 37.977 1.00 0.00 H new ATOM 0 HB3 PHE A 584 29.849 30.824 38.345 1.00 0.00 H new ATOM 0 HD1 PHE A 584 28.626 29.644 36.493 1.00 0.00 H new ATOM 0 HD2 PHE A 584 32.084 32.101 35.745 1.00 0.00 H new ATOM 0 HE1 PHE A 584 28.897 28.583 34.264 1.00 0.00 H new ATOM 0 HE2 PHE A 584 32.332 31.061 33.500 1.00 0.00 H new ATOM 0 HZ PHE A 584 30.772 29.263 32.786 1.00 0.00 H new ATOM 1137 N PRO A 585 30.680 34.785 37.601 1.00 0.00 N ATOM 1138 CA PRO A 585 31.420 35.834 36.912 1.00 0.00 C ATOM 1139 C PRO A 585 32.367 35.188 35.902 1.00 0.00 C ATOM 1140 O PRO A 585 33.333 34.523 36.282 1.00 0.00 O ATOM 1141 CB PRO A 585 32.174 36.594 38.003 1.00 0.00 C ATOM 1142 CG PRO A 585 32.338 35.566 39.126 1.00 0.00 C ATOM 1143 CD PRO A 585 31.111 34.675 38.992 1.00 0.00 C ATOM 0 HA PRO A 585 30.779 36.518 36.355 1.00 0.00 H new ATOM 0 HB2 PRO A 585 33.140 36.952 37.645 1.00 0.00 H new ATOM 0 HB3 PRO A 585 31.615 37.467 38.340 1.00 0.00 H new ATOM 0 HG2 PRO A 585 33.260 34.995 39.013 1.00 0.00 H new ATOM 0 HG3 PRO A 585 32.378 36.046 40.104 1.00 0.00 H new ATOM 0 HD2 PRO A 585 31.350 33.642 39.245 1.00 0.00 H new ATOM 0 HD3 PRO A 585 30.321 34.995 39.671 1.00 0.00 H new ATOM 1151 N GLU A 586 32.120 35.392 34.608 1.00 0.00 N ATOM 1152 CA GLU A 586 32.941 34.820 33.530 1.00 0.00 C ATOM 1153 C GLU A 586 34.440 35.141 33.718 1.00 0.00 C ATOM 1154 O GLU A 586 35.296 34.299 33.444 1.00 0.00 O ATOM 1155 CB GLU A 586 32.420 35.351 32.175 1.00 0.00 C ATOM 1156 CG GLU A 586 32.747 36.841 31.953 1.00 0.00 C ATOM 1157 CD GLU A 586 32.056 37.504 30.757 1.00 0.00 C ATOM 1158 OE1 GLU A 586 32.306 38.708 30.506 1.00 0.00 O ATOM 1159 OE2 GLU A 586 31.288 36.855 30.007 1.00 0.00 O ATOM 0 H GLU A 586 31.343 35.960 34.272 1.00 0.00 H new ATOM 0 HA GLU A 586 32.854 33.734 33.555 1.00 0.00 H new ATOM 0 HB2 GLU A 586 32.857 34.763 31.367 1.00 0.00 H new ATOM 0 HB3 GLU A 586 31.340 35.209 32.125 1.00 0.00 H new ATOM 0 HG2 GLU A 586 32.478 37.391 32.855 1.00 0.00 H new ATOM 0 HG3 GLU A 586 33.825 36.942 31.828 1.00 0.00 H new ATOM 1166 N ASN A 587 34.741 36.319 34.279 1.00 0.00 N ATOM 1167 CA ASN A 587 36.073 36.867 34.539 1.00 0.00 C ATOM 1168 C ASN A 587 36.859 36.146 35.656 1.00 0.00 C ATOM 1169 O ASN A 587 38.067 36.356 35.789 1.00 0.00 O ATOM 1170 CB ASN A 587 35.940 38.388 34.778 1.00 0.00 C ATOM 1171 CG ASN A 587 34.891 38.800 35.802 1.00 0.00 C ATOM 1172 OD1 ASN A 587 33.702 38.558 35.643 1.00 0.00 O ATOM 1173 ND2 ASN A 587 35.275 39.493 36.843 1.00 0.00 N ATOM 0 H ASN A 587 34.006 36.957 34.584 1.00 0.00 H new ATOM 0 HA ASN A 587 36.687 36.687 33.657 1.00 0.00 H new ATOM 0 HB2 ASN A 587 36.908 38.774 35.099 1.00 0.00 H new ATOM 0 HB3 ASN A 587 35.704 38.868 33.828 1.00 0.00 H new ATOM 0 HD21 ASN A 587 34.585 39.828 37.516 1.00 0.00 H new ATOM 0 HD22 ASN A 587 36.264 39.699 36.982 1.00 0.00 H new ATOM 1180 N PHE A 588 36.206 35.264 36.422 1.00 0.00 N ATOM 1181 CA PHE A 588 36.862 34.245 37.251 1.00 0.00 C ATOM 1182 C PHE A 588 37.402 33.003 36.525 1.00 0.00 C ATOM 1183 O PHE A 588 38.139 32.213 37.117 1.00 0.00 O ATOM 1184 CB PHE A 588 36.012 33.885 38.482 1.00 0.00 C ATOM 1185 CG PHE A 588 36.086 34.858 39.649 1.00 0.00 C ATOM 1186 CD1 PHE A 588 35.588 36.173 39.541 1.00 0.00 C ATOM 1187 CD2 PHE A 588 36.633 34.430 40.873 1.00 0.00 C ATOM 1188 CE1 PHE A 588 35.639 37.045 40.643 1.00 0.00 C ATOM 1189 CE2 PHE A 588 36.696 35.304 41.972 1.00 0.00 C ATOM 1190 CZ PHE A 588 36.198 36.613 41.858 1.00 0.00 C ATOM 0 H PHE A 588 35.188 35.238 36.484 1.00 0.00 H new ATOM 0 HA PHE A 588 37.776 34.736 37.585 1.00 0.00 H new ATOM 0 HB2 PHE A 588 34.971 33.802 38.169 1.00 0.00 H new ATOM 0 HB3 PHE A 588 36.318 32.900 38.835 1.00 0.00 H new ATOM 0 HD1 PHE A 588 35.165 36.512 38.607 1.00 0.00 H new ATOM 0 HD2 PHE A 588 37.008 33.422 40.969 1.00 0.00 H new ATOM 0 HE1 PHE A 588 35.248 38.048 40.556 1.00 0.00 H new ATOM 0 HE2 PHE A 588 37.127 34.969 42.904 1.00 0.00 H new ATOM 0 HZ PHE A 588 36.245 37.285 42.702 1.00 0.00 H new ATOM 1200 N THR A 589 37.042 32.808 35.252 1.00 0.00 N ATOM 1201 CA THR A 589 37.357 31.631 34.439 1.00 0.00 C ATOM 1202 C THR A 589 37.956 32.019 33.088 1.00 0.00 C ATOM 1203 O THR A 589 37.935 33.188 32.705 1.00 0.00 O ATOM 1204 CB THR A 589 36.094 30.782 34.205 1.00 0.00 C ATOM 1205 OG1 THR A 589 35.151 31.508 33.442 1.00 0.00 O ATOM 1206 CG2 THR A 589 35.401 30.253 35.467 1.00 0.00 C ATOM 0 H THR A 589 36.497 33.500 34.737 1.00 0.00 H new ATOM 0 HA THR A 589 38.096 31.050 34.991 1.00 0.00 H new ATOM 0 HB THR A 589 36.459 29.903 33.674 1.00 0.00 H new ATOM 0 HG1 THR A 589 35.331 32.468 33.526 1.00 0.00 H new ATOM 0 HG21 THR A 589 34.525 29.670 35.184 1.00 0.00 H new ATOM 0 HG22 THR A 589 36.093 29.621 36.024 1.00 0.00 H new ATOM 0 HG23 THR A 589 35.092 31.092 36.091 1.00 0.00 H new ATOM 1214 N GLU A 590 38.461 31.033 32.346 1.00 0.00 N ATOM 1215 CA GLU A 590 38.996 31.212 30.994 1.00 0.00 C ATOM 1216 C GLU A 590 38.416 30.161 30.036 1.00 0.00 C ATOM 1217 O GLU A 590 38.300 28.988 30.387 1.00 0.00 O ATOM 1218 CB GLU A 590 40.535 31.211 31.041 1.00 0.00 C ATOM 1219 CG GLU A 590 41.201 29.827 31.018 1.00 0.00 C ATOM 1220 CD GLU A 590 42.706 29.905 31.290 1.00 0.00 C ATOM 1221 OE1 GLU A 590 43.337 28.837 31.495 1.00 0.00 O ATOM 1222 OE2 GLU A 590 43.287 31.017 31.377 1.00 0.00 O ATOM 0 H GLU A 590 38.511 30.068 32.673 1.00 0.00 H new ATOM 0 HA GLU A 590 38.688 32.180 30.599 1.00 0.00 H new ATOM 0 HB2 GLU A 590 40.906 31.787 30.193 1.00 0.00 H new ATOM 0 HB3 GLU A 590 40.853 31.732 31.944 1.00 0.00 H new ATOM 0 HG2 GLU A 590 40.731 29.187 31.765 1.00 0.00 H new ATOM 0 HG3 GLU A 590 41.033 29.361 30.047 1.00 0.00 H new ATOM 1229 N ARG A 591 38.047 30.584 28.825 1.00 0.00 N ATOM 1230 CA ARG A 591 37.520 29.750 27.732 1.00 0.00 C ATOM 1231 C ARG A 591 38.487 28.617 27.354 1.00 0.00 C ATOM 1232 O ARG A 591 39.688 28.849 27.188 1.00 0.00 O ATOM 1233 CB ARG A 591 37.228 30.688 26.543 1.00 0.00 C ATOM 1234 CG ARG A 591 36.620 30.045 25.287 1.00 0.00 C ATOM 1235 CD ARG A 591 35.168 29.642 25.423 1.00 0.00 C ATOM 1236 NE ARG A 591 34.616 29.275 24.103 1.00 0.00 N ATOM 1237 CZ ARG A 591 33.858 30.007 23.310 1.00 0.00 C ATOM 1238 NH1 ARG A 591 33.501 31.222 23.592 1.00 0.00 N ATOM 1239 NH2 ARG A 591 33.440 29.554 22.166 1.00 0.00 N ATOM 0 H ARG A 591 38.109 31.568 28.562 1.00 0.00 H new ATOM 0 HA ARG A 591 36.605 29.248 28.047 1.00 0.00 H new ATOM 0 HB2 ARG A 591 36.551 31.470 26.886 1.00 0.00 H new ATOM 0 HB3 ARG A 591 38.160 31.175 26.258 1.00 0.00 H new ATOM 0 HG2 ARG A 591 36.713 30.745 24.456 1.00 0.00 H new ATOM 0 HG3 ARG A 591 37.205 29.163 25.028 1.00 0.00 H new ATOM 0 HD2 ARG A 591 35.079 28.800 26.110 1.00 0.00 H new ATOM 0 HD3 ARG A 591 34.593 30.464 25.850 1.00 0.00 H new ATOM 0 HE ARG A 591 34.849 28.342 23.764 1.00 0.00 H new ATOM 0 HH11 ARG A 591 33.808 31.655 24.463 1.00 0.00 H new ATOM 0 HH12 ARG A 591 32.913 31.745 22.943 1.00 0.00 H new ATOM 0 HH21 ARG A 591 33.697 28.614 21.865 1.00 0.00 H new ATOM 0 HH22 ARG A 591 32.855 30.138 21.569 1.00 0.00 H new ATOM 1253 N VAL A 592 37.947 27.412 27.179 1.00 0.00 N ATOM 1254 CA VAL A 592 38.663 26.194 26.736 1.00 0.00 C ATOM 1255 C VAL A 592 37.881 25.535 25.572 1.00 0.00 C ATOM 1256 O VAL A 592 36.669 25.741 25.449 1.00 0.00 O ATOM 1257 CB VAL A 592 38.823 25.200 27.910 1.00 0.00 C ATOM 1258 CG1 VAL A 592 40.002 25.593 28.806 1.00 0.00 C ATOM 1259 CG2 VAL A 592 37.571 25.093 28.781 1.00 0.00 C ATOM 0 H VAL A 592 36.956 27.239 27.347 1.00 0.00 H new ATOM 0 HA VAL A 592 39.659 26.470 26.390 1.00 0.00 H new ATOM 0 HB VAL A 592 39.002 24.229 27.447 1.00 0.00 H new ATOM 0 HG11 VAL A 592 40.092 24.878 29.623 1.00 0.00 H new ATOM 0 HG12 VAL A 592 40.921 25.592 28.220 1.00 0.00 H new ATOM 0 HG13 VAL A 592 39.833 26.590 29.213 1.00 0.00 H new ATOM 0 HG21 VAL A 592 37.748 24.380 29.586 1.00 0.00 H new ATOM 0 HG22 VAL A 592 37.338 26.070 29.205 1.00 0.00 H new ATOM 0 HG23 VAL A 592 36.733 24.753 28.173 1.00 0.00 H new ATOM 1328 N PRO B1731 40.191 39.037 40.144 1.00 0.00 N ATOM 1329 CA PRO B1731 38.954 39.610 39.610 1.00 0.00 C ATOM 1330 C PRO B1731 37.897 39.950 40.676 1.00 0.00 C ATOM 1331 O PRO B1731 37.969 39.521 41.832 1.00 0.00 O ATOM 1332 CB PRO B1731 38.423 38.568 38.616 1.00 0.00 C ATOM 1333 CG PRO B1731 38.972 37.253 39.151 1.00 0.00 C ATOM 1334 CD PRO B1731 40.336 37.664 39.685 1.00 0.00 C ATOM 0 HA PRO B1731 39.167 40.573 39.146 1.00 0.00 H new ATOM 0 HB2 PRO B1731 37.334 38.564 38.583 1.00 0.00 H new ATOM 0 HB3 PRO B1731 38.772 38.766 37.603 1.00 0.00 H new ATOM 0 HG2 PRO B1731 38.338 36.836 39.933 1.00 0.00 H new ATOM 0 HG3 PRO B1731 39.052 36.498 38.369 1.00 0.00 H new ATOM 0 HD2 PRO B1731 40.649 37.011 40.500 1.00 0.00 H new ATOM 0 HD3 PRO B1731 41.097 37.591 38.908 1.00 0.00 H new ATOM 1342 N VAL B1732 36.872 40.692 40.245 1.00 0.00 N ATOM 1343 CA VAL B1732 35.702 41.111 41.041 1.00 0.00 C ATOM 1344 C VAL B1732 34.416 40.783 40.280 1.00 0.00 C ATOM 1345 O VAL B1732 34.313 41.042 39.077 1.00 0.00 O ATOM 1346 CB VAL B1732 35.775 42.615 41.386 1.00 0.00 C ATOM 1347 CG1 VAL B1732 34.567 43.079 42.208 1.00 0.00 C ATOM 1348 CG2 VAL B1732 37.045 42.963 42.173 1.00 0.00 C ATOM 0 H VAL B1732 36.829 41.036 39.286 1.00 0.00 H new ATOM 0 HA VAL B1732 35.703 40.561 41.982 1.00 0.00 H new ATOM 0 HB VAL B1732 35.784 43.131 40.426 1.00 0.00 H new ATOM 0 HG11 VAL B1732 34.662 44.143 42.427 1.00 0.00 H new ATOM 0 HG12 VAL B1732 33.653 42.906 41.641 1.00 0.00 H new ATOM 0 HG13 VAL B1732 34.526 42.519 43.142 1.00 0.00 H new ATOM 0 HG21 VAL B1732 37.055 44.030 42.394 1.00 0.00 H new ATOM 0 HG22 VAL B1732 37.061 42.399 43.106 1.00 0.00 H new ATOM 0 HG23 VAL B1732 37.923 42.707 41.579 1.00 0.00 H new ATOM 1358 N ALA B1733 33.429 40.192 40.956 1.00 0.00 N ATOM 1359 CA ALA B1733 32.156 39.839 40.329 1.00 0.00 C ATOM 1360 C ALA B1733 31.331 41.094 39.951 1.00 0.00 C ATOM 1361 O ALA B1733 31.177 42.000 40.782 1.00 0.00 O ATOM 1362 CB ALA B1733 31.379 38.896 41.247 1.00 0.00 C ATOM 0 H ALA B1733 33.489 39.947 41.944 1.00 0.00 H new ATOM 0 HA ALA B1733 32.359 39.320 39.392 1.00 0.00 H new ATOM 0 HB1 ALA B1733 30.430 38.633 40.779 1.00 0.00 H new ATOM 0 HB2 ALA B1733 31.963 37.991 41.417 1.00 0.00 H new ATOM 0 HB3 ALA B1733 31.189 39.390 42.200 1.00 0.00 H new ATOM 1368 N PRO B1734 30.792 41.174 38.719 1.00 0.00 N ATOM 1369 CA PRO B1734 30.048 42.347 38.272 1.00 0.00 C ATOM 1370 C PRO B1734 28.632 42.402 38.884 1.00 0.00 C ATOM 1371 O PRO B1734 28.153 41.397 39.427 1.00 0.00 O ATOM 1372 CB PRO B1734 30.037 42.260 36.742 1.00 0.00 C ATOM 1373 CG PRO B1734 30.169 40.771 36.438 1.00 0.00 C ATOM 1374 CD PRO B1734 30.864 40.169 37.661 1.00 0.00 C ATOM 0 HA PRO B1734 30.514 43.275 38.604 1.00 0.00 H new ATOM 0 HB2 PRO B1734 29.115 42.668 36.329 1.00 0.00 H new ATOM 0 HB3 PRO B1734 30.860 42.827 36.307 1.00 0.00 H new ATOM 0 HG2 PRO B1734 29.192 40.315 36.276 1.00 0.00 H new ATOM 0 HG3 PRO B1734 30.753 40.605 35.532 1.00 0.00 H new ATOM 0 HD2 PRO B1734 30.374 39.246 37.970 1.00 0.00 H new ATOM 0 HD3 PRO B1734 31.900 39.919 37.434 1.00 0.00 H new ATOM 1382 N PRO B1735 27.931 43.548 38.779 1.00 0.00 N ATOM 1383 CA PRO B1735 26.512 43.675 39.121 1.00 0.00 C ATOM 1384 C PRO B1735 25.647 42.595 38.462 1.00 0.00 C ATOM 1385 O PRO B1735 25.981 42.109 37.378 1.00 0.00 O ATOM 1386 CB PRO B1735 26.105 45.075 38.646 1.00 0.00 C ATOM 1387 CG PRO B1735 27.406 45.866 38.722 1.00 0.00 C ATOM 1388 CD PRO B1735 28.441 44.826 38.300 1.00 0.00 C ATOM 0 HA PRO B1735 26.359 43.541 40.192 1.00 0.00 H new ATOM 0 HB2 PRO B1735 25.706 45.055 37.632 1.00 0.00 H new ATOM 0 HB3 PRO B1735 25.334 45.507 39.284 1.00 0.00 H new ATOM 0 HG2 PRO B1735 27.398 46.727 38.054 1.00 0.00 H new ATOM 0 HG3 PRO B1735 27.595 46.244 39.727 1.00 0.00 H new ATOM 0 HD2 PRO B1735 28.568 44.816 37.217 1.00 0.00 H new ATOM 0 HD3 PRO B1735 29.417 45.046 38.733 1.00 0.00 H new