USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 547 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 55 THR OG1 : rot -43:sc= 1.67 USER MOD Set 1.2: A 57 SER OG : rot -43:sc= 0.478 USER MOD Set 2.1: A 22 THR OG1 : rot -51:sc= 1.24 USER MOD Set 2.2: A 25 ASN : amide:sc= 1.45 K(o=2.7,f=-5.7!) USER MOD Set 3.1: A 6 LYS NZ :NH3+ -129:sc= 0.0106 (180deg=-0.047) USER MOD Set 3.2: A 12 THR OG1 : rot 180:sc= 0.0101 USER MOD Set 4.1: A 1 MET CE :methyl 165:sc= -0.543 (180deg=-0.892) USER MOD Set 4.2: A 65 SER OG : rot -140:sc= 0 USER MOD Single : A 1 MET N :NH3+ -162:sc= 1.23 (180deg=1.21) USER MOD Single : A 2 GLN : amide:sc= 0.0667 K(o=0.067,f=-3!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -96:sc= 0.0727 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 159:sc= 1.36 (180deg=0.773) USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 0.682 (180deg=0.642) USER MOD Single : A 31 GLN : amide:sc= -0.082 X(o=-0.082,f=-0.34) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 41 GLN : amide:sc= 1.72 K(o=1.7,f=-1.6) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.0576 X(o=-0.058,f=-0.058) USER MOD Single : A 59 TYR OH : rot -158:sc= 0.904 USER MOD Single : A 60 ASN : amide:sc= -0.0425 X(o=-0.043,f=-0.041) USER MOD Single : A 62 GLN : amide:sc= -0.0103 K(o=-0.01,f=-0.9) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 53:sc= 1.26 USER MOD Single : A 68 HIS : no HD1:sc= -0.0203 X(o=-0.02,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.914 51.207 20.818 1.00 0.00 N ATOM 2 CA MET A 1 33.424 51.226 22.198 1.00 0.00 C ATOM 3 C MET A 1 34.873 51.717 22.207 1.00 0.00 C ATOM 4 O MET A 1 35.684 51.258 21.406 1.00 0.00 O ATOM 5 CB MET A 1 33.277 49.853 22.846 1.00 0.00 C ATOM 6 CG MET A 1 33.978 49.743 24.198 1.00 0.00 C ATOM 7 SD MET A 1 33.490 48.284 25.150 1.00 0.00 S ATOM 8 CE MET A 1 34.780 48.366 26.417 1.00 0.00 C ATOM 0 H1 MET A 1 31.875 51.174 20.832 1.00 0.00 H new ATOM 0 H2 MET A 1 33.227 52.065 20.321 1.00 0.00 H new ATOM 0 H3 MET A 1 33.280 50.368 20.324 1.00 0.00 H new ATOM 0 HA MET A 1 32.832 51.921 22.793 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.218 49.632 22.975 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.681 49.097 22.173 1.00 0.00 H new ATOM 0 HG2 MET A 1 35.056 49.718 24.038 1.00 0.00 H new ATOM 0 HG3 MET A 1 33.763 50.637 24.783 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.511 47.719 27.252 1.00 0.00 H new ATOM 0 HE2 MET A 1 35.728 48.036 25.993 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.878 49.393 26.770 1.00 0.00 H new ATOM 20 N GLN A 2 35.214 52.606 23.135 1.00 0.00 N ATOM 21 CA GLN A 2 36.565 53.089 23.344 1.00 0.00 C ATOM 22 C GLN A 2 37.316 52.253 24.382 1.00 0.00 C ATOM 23 O GLN A 2 36.731 51.806 25.365 1.00 0.00 O ATOM 24 CB GLN A 2 36.577 54.578 23.678 1.00 0.00 C ATOM 25 CG GLN A 2 35.728 54.985 24.879 1.00 0.00 C ATOM 26 CD GLN A 2 34.270 55.271 24.512 1.00 0.00 C ATOM 27 OE1 GLN A 2 33.410 54.394 24.532 1.00 0.00 O ATOM 28 NE2 GLN A 2 33.941 56.497 24.117 1.00 0.00 N ATOM 0 H GLN A 2 34.537 53.018 23.777 1.00 0.00 H new ATOM 0 HA GLN A 2 37.105 52.969 22.405 1.00 0.00 H new ATOM 0 HB2 GLN A 2 37.607 54.884 23.862 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.231 55.132 22.805 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.760 54.191 25.625 1.00 0.00 H new ATOM 0 HG3 GLN A 2 36.162 55.873 25.339 1.00 0.00 H new ATOM 0 HE21 GLN A 2 34.647 57.233 24.097 1.00 0.00 H new ATOM 0 HE22 GLN A 2 32.983 56.702 23.834 1.00 0.00 H new ATOM 37 N ILE A 3 38.617 52.075 24.167 1.00 0.00 N ATOM 38 CA ILE A 3 39.534 51.394 25.059 1.00 0.00 C ATOM 39 C ILE A 3 40.856 52.152 25.191 1.00 0.00 C ATOM 40 O ILE A 3 41.385 52.681 24.216 1.00 0.00 O ATOM 41 CB ILE A 3 39.755 49.941 24.648 1.00 0.00 C ATOM 42 CG1 ILE A 3 40.225 49.781 23.205 1.00 0.00 C ATOM 43 CG2 ILE A 3 38.500 49.116 24.916 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.653 48.368 22.821 1.00 0.00 C ATOM 0 H ILE A 3 39.076 52.420 23.324 1.00 0.00 H new ATOM 0 HA ILE A 3 39.069 51.378 26.045 1.00 0.00 H new ATOM 0 HB ILE A 3 40.569 49.563 25.266 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.421 50.095 22.540 1.00 0.00 H new ATOM 0 HG13 ILE A 3 41.062 50.458 23.034 1.00 0.00 H new ATOM 0 HG21 ILE A 3 38.674 48.082 24.618 1.00 0.00 H new ATOM 0 HG22 ILE A 3 38.261 49.152 25.979 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.667 49.524 24.343 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.970 48.355 21.778 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.481 48.053 23.456 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.814 47.685 22.954 1.00 0.00 H new ATOM 56 N PHE A 4 41.408 52.193 26.400 1.00 0.00 N ATOM 57 CA PHE A 4 42.622 52.921 26.710 1.00 0.00 C ATOM 58 C PHE A 4 43.806 51.971 26.900 1.00 0.00 C ATOM 59 O PHE A 4 43.912 51.311 27.931 1.00 0.00 O ATOM 60 CB PHE A 4 42.390 53.799 27.936 1.00 0.00 C ATOM 61 CG PHE A 4 41.082 54.554 27.970 1.00 0.00 C ATOM 62 CD1 PHE A 4 40.736 55.412 26.920 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.207 54.394 29.052 1.00 0.00 C ATOM 64 CE1 PHE A 4 39.515 56.095 26.940 1.00 0.00 C ATOM 65 CE2 PHE A 4 38.988 55.084 29.080 1.00 0.00 C ATOM 66 CZ PHE A 4 38.638 55.927 28.019 1.00 0.00 C ATOM 0 H PHE A 4 41.011 51.709 27.205 1.00 0.00 H new ATOM 0 HA PHE A 4 42.876 53.566 25.869 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.448 53.171 28.825 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.205 54.520 28.002 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.414 55.548 26.091 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.473 53.737 29.867 1.00 0.00 H new ATOM 0 HE1 PHE A 4 39.249 56.751 26.124 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.319 54.966 29.920 1.00 0.00 H new ATOM 0 HZ PHE A 4 37.692 56.448 28.032 1.00 0.00 H new ATOM 76 N VAL A 5 44.705 51.870 25.925 1.00 0.00 N ATOM 77 CA VAL A 5 45.826 50.952 25.950 1.00 0.00 C ATOM 78 C VAL A 5 47.076 51.649 26.491 1.00 0.00 C ATOM 79 O VAL A 5 47.593 52.572 25.866 1.00 0.00 O ATOM 80 CB VAL A 5 46.088 50.340 24.577 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.195 49.293 24.657 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.846 49.658 24.008 1.00 0.00 C ATOM 0 H VAL A 5 44.668 52.439 25.079 1.00 0.00 H new ATOM 0 HA VAL A 5 45.570 50.132 26.621 1.00 0.00 H new ATOM 0 HB VAL A 5 46.380 51.163 23.925 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.367 48.869 23.668 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.112 49.760 25.016 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.898 48.501 25.345 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.078 49.237 23.030 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.528 48.861 24.680 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.044 50.389 23.907 1.00 0.00 H new ATOM 92 N LYS A 6 47.582 51.196 27.635 1.00 0.00 N ATOM 93 CA LYS A 6 48.805 51.689 28.236 1.00 0.00 C ATOM 94 C LYS A 6 50.013 50.986 27.613 1.00 0.00 C ATOM 95 O LYS A 6 50.245 49.804 27.855 1.00 0.00 O ATOM 96 CB LYS A 6 48.720 51.580 29.756 1.00 0.00 C ATOM 97 CG LYS A 6 49.780 52.430 30.452 1.00 0.00 C ATOM 98 CD LYS A 6 49.526 52.493 31.955 1.00 0.00 C ATOM 99 CE LYS A 6 50.312 53.582 32.679 1.00 0.00 C ATOM 100 NZ LYS A 6 49.879 54.942 32.324 1.00 0.00 N ATOM 0 H LYS A 6 47.137 50.457 28.179 1.00 0.00 H new ATOM 0 HA LYS A 6 48.939 52.750 28.024 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.730 51.893 30.087 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.840 50.538 30.052 1.00 0.00 H new ATOM 0 HG2 LYS A 6 50.769 52.012 30.263 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.775 53.437 30.036 1.00 0.00 H new ATOM 0 HD2 LYS A 6 48.462 52.655 32.125 1.00 0.00 H new ATOM 0 HD3 LYS A 6 49.776 51.527 32.395 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.206 53.443 33.755 1.00 0.00 H new ATOM 0 HE3 LYS A 6 51.371 53.472 32.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 50.707 55.510 32.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 49.214 54.897 31.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 49.410 55.381 33.141 1.00 0.00 H new ATOM 168 N LYS A 11 52.796 55.636 28.313 1.00 0.00 N ATOM 169 CA LYS A 11 51.860 56.486 27.606 1.00 0.00 C ATOM 170 C LYS A 11 50.581 55.711 27.280 1.00 0.00 C ATOM 171 O LYS A 11 50.673 54.565 26.848 1.00 0.00 O ATOM 172 CB LYS A 11 52.534 57.046 26.356 1.00 0.00 C ATOM 173 CG LYS A 11 51.687 58.048 25.577 1.00 0.00 C ATOM 174 CD LYS A 11 52.461 58.604 24.386 1.00 0.00 C ATOM 175 CE LYS A 11 51.628 59.643 23.640 1.00 0.00 C ATOM 176 NZ LYS A 11 52.427 60.392 22.658 1.00 0.00 N ATOM 0 HA LYS A 11 51.568 57.327 28.235 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.468 57.527 26.646 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.793 56.218 25.696 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.774 57.566 25.229 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.386 58.864 26.234 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.392 59.055 24.729 1.00 0.00 H new ATOM 0 HD3 LYS A 11 52.730 57.793 23.710 1.00 0.00 H new ATOM 0 HE2 LYS A 11 50.801 59.147 23.131 1.00 0.00 H new ATOM 0 HE3 LYS A 11 51.190 60.338 24.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 51.822 61.086 22.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.201 60.887 23.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 52.824 59.733 21.958 1.00 0.00 H new ATOM 190 N THR A 12 49.407 56.320 27.420 1.00 0.00 N ATOM 191 CA THR A 12 48.136 55.657 27.212 1.00 0.00 C ATOM 192 C THR A 12 47.427 56.200 25.969 1.00 0.00 C ATOM 193 O THR A 12 47.144 57.393 25.887 1.00 0.00 O ATOM 194 CB THR A 12 47.253 55.730 28.454 1.00 0.00 C ATOM 195 OG1 THR A 12 47.961 55.243 29.572 1.00 0.00 O ATOM 196 CG2 THR A 12 46.021 54.840 28.313 1.00 0.00 C ATOM 0 H THR A 12 49.317 57.301 27.685 1.00 0.00 H new ATOM 0 HA THR A 12 48.338 54.601 27.033 1.00 0.00 H new ATOM 0 HB THR A 12 46.961 56.773 28.575 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.391 55.293 30.368 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.413 54.915 29.215 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.435 55.163 27.452 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.334 53.806 28.171 1.00 0.00 H new ATOM 204 N ILE A 13 47.117 55.329 25.013 1.00 0.00 N ATOM 205 CA ILE A 13 46.476 55.663 23.757 1.00 0.00 C ATOM 206 C ILE A 13 45.020 55.193 23.727 1.00 0.00 C ATOM 207 O ILE A 13 44.718 54.060 24.094 1.00 0.00 O ATOM 208 CB ILE A 13 47.281 55.163 22.561 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.487 53.651 22.538 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.608 55.914 22.497 1.00 0.00 C ATOM 211 CD1 ILE A 13 48.218 53.112 21.311 1.00 0.00 C ATOM 0 H ILE A 13 47.316 54.333 25.101 1.00 0.00 H new ATOM 0 HA ILE A 13 46.453 56.750 23.677 1.00 0.00 H new ATOM 0 HB ILE A 13 46.694 55.373 21.667 1.00 0.00 H new ATOM 0 HG12 ILE A 13 48.045 53.363 23.429 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.513 53.167 22.602 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.186 55.559 21.644 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.417 56.982 22.388 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.170 55.738 23.414 1.00 0.00 H new ATOM 0 HD11 ILE A 13 48.314 52.029 21.391 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.653 53.361 20.413 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.210 53.560 21.252 1.00 0.00 H new ATOM 223 N THR A 14 44.112 56.051 23.271 1.00 0.00 N ATOM 224 CA THR A 14 42.714 55.724 23.074 1.00 0.00 C ATOM 225 C THR A 14 42.500 55.124 21.683 1.00 0.00 C ATOM 226 O THR A 14 42.799 55.770 20.681 1.00 0.00 O ATOM 227 CB THR A 14 41.835 56.958 23.259 1.00 0.00 C ATOM 228 OG1 THR A 14 41.972 57.499 24.553 1.00 0.00 O ATOM 229 CG2 THR A 14 40.350 56.642 23.100 1.00 0.00 C ATOM 0 H THR A 14 44.339 57.014 23.024 1.00 0.00 H new ATOM 0 HA THR A 14 42.428 54.986 23.824 1.00 0.00 H new ATOM 0 HB THR A 14 42.167 57.657 22.492 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.253 57.160 25.127 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.767 57.552 23.241 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.167 56.245 22.101 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.054 55.903 23.844 1.00 0.00 H new ATOM 237 N LEU A 15 41.962 53.910 21.616 1.00 0.00 N ATOM 238 CA LEU A 15 41.579 53.224 20.398 1.00 0.00 C ATOM 239 C LEU A 15 40.107 52.808 20.453 1.00 0.00 C ATOM 240 O LEU A 15 39.518 52.708 21.526 1.00 0.00 O ATOM 241 CB LEU A 15 42.495 52.026 20.163 1.00 0.00 C ATOM 242 CG LEU A 15 43.948 52.372 19.853 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.777 51.095 19.762 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.112 53.122 18.534 1.00 0.00 C ATOM 0 H LEU A 15 41.775 53.356 22.452 1.00 0.00 H new ATOM 0 HA LEU A 15 41.693 53.905 19.555 1.00 0.00 H new ATOM 0 HB2 LEU A 15 42.470 51.391 21.048 1.00 0.00 H new ATOM 0 HB3 LEU A 15 42.094 51.438 19.337 1.00 0.00 H new ATOM 0 HG LEU A 15 44.287 53.016 20.664 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.814 51.349 19.540 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.729 50.562 20.711 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.382 50.460 18.969 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.167 53.340 18.368 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.736 52.507 17.716 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.550 54.055 18.574 1.00 0.00 H new ATOM 256 N GLU A 16 39.502 52.586 19.289 1.00 0.00 N ATOM 257 CA GLU A 16 38.078 52.353 19.153 1.00 0.00 C ATOM 258 C GLU A 16 37.779 51.032 18.442 1.00 0.00 C ATOM 259 O GLU A 16 38.299 50.751 17.365 1.00 0.00 O ATOM 260 CB GLU A 16 37.437 53.537 18.437 1.00 0.00 C ATOM 261 CG GLU A 16 37.490 54.833 19.239 1.00 0.00 C ATOM 262 CD GLU A 16 36.935 56.031 18.464 1.00 0.00 C ATOM 263 OE1 GLU A 16 37.092 57.178 18.934 1.00 0.00 O ATOM 264 OE2 GLU A 16 36.334 55.861 17.382 1.00 0.00 O ATOM 0 H GLU A 16 40.003 52.564 18.401 1.00 0.00 H new ATOM 0 HA GLU A 16 37.644 52.266 20.149 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.939 53.689 17.482 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.397 53.298 18.216 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.923 54.708 20.161 1.00 0.00 H new ATOM 0 HG3 GLU A 16 38.522 55.037 19.524 1.00 0.00 H new ATOM 271 N VAL A 17 36.916 50.216 19.041 1.00 0.00 N ATOM 272 CA VAL A 17 36.612 48.845 18.682 1.00 0.00 C ATOM 273 C VAL A 17 35.116 48.548 18.809 1.00 0.00 C ATOM 274 O VAL A 17 34.407 49.211 19.564 1.00 0.00 O ATOM 275 CB VAL A 17 37.473 47.928 19.545 1.00 0.00 C ATOM 276 CG1 VAL A 17 37.115 47.957 21.028 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.494 46.485 19.046 1.00 0.00 C ATOM 0 H VAL A 17 36.374 50.524 19.848 1.00 0.00 H new ATOM 0 HA VAL A 17 36.850 48.669 17.633 1.00 0.00 H new ATOM 0 HB VAL A 17 38.476 48.343 19.444 1.00 0.00 H new ATOM 0 HG11 VAL A 17 37.771 47.279 21.574 1.00 0.00 H new ATOM 0 HG12 VAL A 17 37.238 48.970 21.412 1.00 0.00 H new ATOM 0 HG13 VAL A 17 36.079 47.643 21.159 1.00 0.00 H new ATOM 0 HG21 VAL A 17 38.123 45.883 19.701 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.480 46.085 19.048 1.00 0.00 H new ATOM 0 HG23 VAL A 17 37.894 46.456 18.032 1.00 0.00 H new ATOM 287 N GLU A 18 34.608 47.551 18.090 1.00 0.00 N ATOM 288 CA GLU A 18 33.246 47.064 18.184 1.00 0.00 C ATOM 289 C GLU A 18 33.200 45.579 18.546 1.00 0.00 C ATOM 290 O GLU A 18 34.165 44.871 18.264 1.00 0.00 O ATOM 291 CB GLU A 18 32.499 47.342 16.884 1.00 0.00 C ATOM 292 CG GLU A 18 32.327 48.820 16.545 1.00 0.00 C ATOM 293 CD GLU A 18 31.523 49.633 17.562 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.577 49.110 18.191 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.780 50.847 17.707 1.00 0.00 O ATOM 0 H GLU A 18 35.161 47.043 17.400 1.00 0.00 H new ATOM 0 HA GLU A 18 32.748 47.601 18.991 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.030 46.856 16.066 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.513 46.881 16.943 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.314 49.270 16.443 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.839 48.899 15.574 1.00 0.00 H new ATOM 302 N PRO A 19 32.126 45.062 19.133 1.00 0.00 N ATOM 303 CA PRO A 19 32.035 43.707 19.642 1.00 0.00 C ATOM 304 C PRO A 19 32.467 42.566 18.719 1.00 0.00 C ATOM 305 O PRO A 19 32.920 41.532 19.205 1.00 0.00 O ATOM 306 CB PRO A 19 30.573 43.517 20.035 1.00 0.00 C ATOM 307 CG PRO A 19 30.169 44.913 20.500 1.00 0.00 C ATOM 308 CD PRO A 19 30.942 45.799 19.527 1.00 0.00 C ATOM 0 HA PRO A 19 32.753 43.632 20.458 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.968 43.179 19.194 1.00 0.00 H new ATOM 0 HB3 PRO A 19 30.459 42.777 20.827 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.093 45.072 20.432 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.453 45.098 21.536 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.331 46.041 18.657 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.214 46.743 19.998 1.00 0.00 H new ATOM 316 N SER A 20 32.343 42.735 17.406 1.00 0.00 N ATOM 317 CA SER A 20 32.653 41.733 16.406 1.00 0.00 C ATOM 318 C SER A 20 34.080 41.794 15.860 1.00 0.00 C ATOM 319 O SER A 20 34.461 40.916 15.090 1.00 0.00 O ATOM 320 CB SER A 20 31.646 41.803 15.261 1.00 0.00 C ATOM 321 OG SER A 20 30.314 41.796 15.725 1.00 0.00 O ATOM 0 H SER A 20 32.011 43.609 17.000 1.00 0.00 H new ATOM 0 HA SER A 20 32.580 40.775 16.920 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.822 42.708 14.679 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.800 40.957 14.591 1.00 0.00 H new ATOM 0 HG SER A 20 29.701 41.844 14.962 1.00 0.00 H new ATOM 327 N ASP A 21 34.879 42.791 16.232 1.00 0.00 N ATOM 328 CA ASP A 21 36.274 42.892 15.853 1.00 0.00 C ATOM 329 C ASP A 21 37.126 41.835 16.559 1.00 0.00 C ATOM 330 O ASP A 21 36.822 41.450 17.686 1.00 0.00 O ATOM 331 CB ASP A 21 36.816 44.278 16.189 1.00 0.00 C ATOM 332 CG ASP A 21 36.212 45.417 15.365 1.00 0.00 C ATOM 333 OD1 ASP A 21 35.927 45.219 14.163 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.129 46.561 15.860 1.00 0.00 O ATOM 0 H ASP A 21 34.562 43.564 16.817 1.00 0.00 H new ATOM 0 HA ASP A 21 36.332 42.723 14.778 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.637 44.477 17.246 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.896 44.276 16.044 1.00 0.00 H new ATOM 339 N THR A 22 38.216 41.390 15.940 1.00 0.00 N ATOM 340 CA THR A 22 39.171 40.502 16.573 1.00 0.00 C ATOM 341 C THR A 22 40.273 41.254 17.322 1.00 0.00 C ATOM 342 O THR A 22 40.576 42.403 17.011 1.00 0.00 O ATOM 343 CB THR A 22 39.807 39.477 15.638 1.00 0.00 C ATOM 344 OG1 THR A 22 40.752 40.056 14.765 1.00 0.00 O ATOM 345 CG2 THR A 22 38.807 38.698 14.791 1.00 0.00 C ATOM 0 H THR A 22 38.458 41.640 14.981 1.00 0.00 H new ATOM 0 HA THR A 22 38.561 39.950 17.288 1.00 0.00 H new ATOM 0 HB THR A 22 40.297 38.783 16.321 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.349 40.824 14.310 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.341 37.992 14.155 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.123 38.154 15.443 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.241 39.390 14.168 1.00 0.00 H new ATOM 353 N ILE A 23 40.939 40.580 18.257 1.00 0.00 N ATOM 354 CA ILE A 23 42.056 41.155 18.979 1.00 0.00 C ATOM 355 C ILE A 23 43.211 41.527 18.048 1.00 0.00 C ATOM 356 O ILE A 23 43.832 42.569 18.256 1.00 0.00 O ATOM 357 CB ILE A 23 42.467 40.240 20.129 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.315 39.918 21.076 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.644 40.803 20.921 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.535 41.107 21.630 1.00 0.00 C ATOM 0 H ILE A 23 40.715 39.623 18.530 1.00 0.00 H new ATOM 0 HA ILE A 23 41.738 42.099 19.422 1.00 0.00 H new ATOM 0 HB ILE A 23 42.778 39.309 19.655 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.616 39.265 20.553 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.713 39.350 21.917 1.00 0.00 H new ATOM 0 HG21 ILE A 23 43.900 40.117 21.729 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.503 40.923 20.261 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.371 41.771 21.340 1.00 0.00 H new ATOM 0 HD11 ILE A 23 39.744 40.748 22.289 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.209 41.755 22.191 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.094 41.669 20.806 1.00 0.00 H new ATOM 372 N GLU A 24 43.470 40.786 16.975 1.00 0.00 N ATOM 373 CA GLU A 24 44.464 41.193 16.002 1.00 0.00 C ATOM 374 C GLU A 24 44.092 42.477 15.258 1.00 0.00 C ATOM 375 O GLU A 24 44.989 43.272 14.985 1.00 0.00 O ATOM 376 CB GLU A 24 44.823 40.052 15.054 1.00 0.00 C ATOM 377 CG GLU A 24 46.049 40.403 14.214 1.00 0.00 C ATOM 378 CD GLU A 24 46.608 39.206 13.444 1.00 0.00 C ATOM 379 OE1 GLU A 24 45.979 38.786 12.448 1.00 0.00 O ATOM 380 OE2 GLU A 24 47.706 38.719 13.791 1.00 0.00 O ATOM 0 H GLU A 24 43.004 39.904 16.762 1.00 0.00 H new ATOM 0 HA GLU A 24 45.363 41.438 16.567 1.00 0.00 H new ATOM 0 HB2 GLU A 24 45.018 39.146 15.627 1.00 0.00 H new ATOM 0 HB3 GLU A 24 43.978 39.839 14.399 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.786 41.191 13.508 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.826 40.804 14.865 1.00 0.00 H new ATOM 387 N ASN A 25 42.815 42.758 15.015 1.00 0.00 N ATOM 388 CA ASN A 25 42.417 44.037 14.462 1.00 0.00 C ATOM 389 C ASN A 25 42.803 45.198 15.378 1.00 0.00 C ATOM 390 O ASN A 25 43.193 46.250 14.873 1.00 0.00 O ATOM 391 CB ASN A 25 40.921 44.096 14.162 1.00 0.00 C ATOM 392 CG ASN A 25 40.407 43.092 13.127 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.665 42.168 13.450 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.748 43.254 11.852 1.00 0.00 N ATOM 0 H ASN A 25 42.044 42.115 15.194 1.00 0.00 H new ATOM 0 HA ASN A 25 42.959 44.138 13.522 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.377 43.939 15.093 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.679 45.101 13.816 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.393 42.611 11.144 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.364 44.021 11.582 1.00 0.00 H new ATOM 401 N VAL A 26 42.768 45.017 16.696 1.00 0.00 N ATOM 402 CA VAL A 26 43.197 46.016 17.653 1.00 0.00 C ATOM 403 C VAL A 26 44.721 46.147 17.659 1.00 0.00 C ATOM 404 O VAL A 26 45.240 47.258 17.563 1.00 0.00 O ATOM 405 CB VAL A 26 42.679 45.721 19.058 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.011 46.856 20.023 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.168 45.508 19.098 1.00 0.00 C ATOM 0 H VAL A 26 42.434 44.156 17.129 1.00 0.00 H new ATOM 0 HA VAL A 26 42.767 46.967 17.338 1.00 0.00 H new ATOM 0 HB VAL A 26 43.179 44.801 19.361 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.628 46.614 21.015 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.092 46.986 20.073 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.550 47.779 19.671 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.857 45.302 20.122 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.664 46.406 18.739 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.903 44.664 18.461 1.00 0.00 H new ATOM 417 N LYS A 27 45.456 45.040 17.700 1.00 0.00 N ATOM 418 CA LYS A 27 46.905 45.052 17.655 1.00 0.00 C ATOM 419 C LYS A 27 47.454 45.651 16.359 1.00 0.00 C ATOM 420 O LYS A 27 48.479 46.330 16.388 1.00 0.00 O ATOM 421 CB LYS A 27 47.467 43.658 17.919 1.00 0.00 C ATOM 422 CG LYS A 27 47.135 43.139 19.315 1.00 0.00 C ATOM 423 CD LYS A 27 48.017 41.982 19.777 1.00 0.00 C ATOM 424 CE LYS A 27 48.087 40.828 18.780 1.00 0.00 C ATOM 425 NZ LYS A 27 49.127 39.851 19.134 1.00 0.00 N ATOM 0 H LYS A 27 45.055 44.105 17.766 1.00 0.00 H new ATOM 0 HA LYS A 27 47.243 45.711 18.455 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.072 42.966 17.176 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.549 43.678 17.792 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.228 43.959 20.027 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.094 42.817 19.333 1.00 0.00 H new ATOM 0 HD2 LYS A 27 49.025 42.355 19.959 1.00 0.00 H new ATOM 0 HD3 LYS A 27 47.640 41.606 20.728 1.00 0.00 H new ATOM 0 HE2 LYS A 27 47.120 40.327 18.738 1.00 0.00 H new ATOM 0 HE3 LYS A 27 48.285 41.222 17.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.920 38.942 18.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 50.053 40.199 18.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.144 39.721 20.166 1.00 0.00 H new ATOM 439 N ALA A 28 46.752 45.493 15.242 1.00 0.00 N ATOM 440 CA ALA A 28 47.070 46.156 13.994 1.00 0.00 C ATOM 441 C ALA A 28 46.957 47.679 14.095 1.00 0.00 C ATOM 442 O ALA A 28 47.859 48.366 13.623 1.00 0.00 O ATOM 443 CB ALA A 28 46.188 45.585 12.888 1.00 0.00 C ATOM 0 H ALA A 28 45.932 44.889 15.183 1.00 0.00 H new ATOM 0 HA ALA A 28 48.114 45.961 13.751 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.421 46.079 11.945 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.372 44.515 12.792 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.140 45.752 13.136 1.00 0.00 H new ATOM 449 N LYS A 29 45.949 48.220 14.772 1.00 0.00 N ATOM 450 CA LYS A 29 45.840 49.644 15.018 1.00 0.00 C ATOM 451 C LYS A 29 46.973 50.178 15.896 1.00 0.00 C ATOM 452 O LYS A 29 47.445 51.290 15.670 1.00 0.00 O ATOM 453 CB LYS A 29 44.494 50.021 15.630 1.00 0.00 C ATOM 454 CG LYS A 29 43.304 49.787 14.702 1.00 0.00 C ATOM 455 CD LYS A 29 42.044 50.473 15.219 1.00 0.00 C ATOM 456 CE LYS A 29 40.827 49.979 14.443 1.00 0.00 C ATOM 457 NZ LYS A 29 39.629 50.776 14.747 1.00 0.00 N ATOM 0 H LYS A 29 45.182 47.674 15.166 1.00 0.00 H new ATOM 0 HA LYS A 29 45.921 50.114 14.038 1.00 0.00 H new ATOM 0 HB2 LYS A 29 44.348 49.445 16.544 1.00 0.00 H new ATOM 0 HB3 LYS A 29 44.518 51.073 15.916 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.540 50.161 13.706 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.122 48.717 14.605 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.917 50.266 16.282 1.00 0.00 H new ATOM 0 HD3 LYS A 29 42.139 51.554 15.114 1.00 0.00 H new ATOM 0 HE2 LYS A 29 41.034 50.025 13.374 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.640 48.933 14.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.858 50.502 14.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.338 50.605 15.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.842 51.786 14.620 1.00 0.00 H new ATOM 471 N ILE A 30 47.447 49.378 16.847 1.00 0.00 N ATOM 472 CA ILE A 30 48.585 49.684 17.690 1.00 0.00 C ATOM 473 C ILE A 30 49.884 49.757 16.885 1.00 0.00 C ATOM 474 O ILE A 30 50.734 50.580 17.220 1.00 0.00 O ATOM 475 CB ILE A 30 48.670 48.721 18.869 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.454 48.881 19.776 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.948 48.916 19.681 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.317 47.814 20.859 1.00 0.00 C ATOM 0 H ILE A 30 47.031 48.470 17.054 1.00 0.00 H new ATOM 0 HA ILE A 30 48.436 50.679 18.109 1.00 0.00 H new ATOM 0 HB ILE A 30 48.688 47.712 18.457 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.501 49.859 20.254 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.555 48.870 19.160 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.964 48.208 20.510 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.815 48.746 19.042 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.979 49.933 20.072 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.424 48.011 21.453 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.234 46.832 20.394 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.195 47.836 21.505 1.00 0.00 H new ATOM 490 N GLN A 31 50.052 49.013 15.795 1.00 0.00 N ATOM 491 CA GLN A 31 51.241 49.106 14.972 1.00 0.00 C ATOM 492 C GLN A 31 51.379 50.476 14.306 1.00 0.00 C ATOM 493 O GLN A 31 52.480 51.018 14.250 1.00 0.00 O ATOM 494 CB GLN A 31 51.273 47.968 13.956 1.00 0.00 C ATOM 495 CG GLN A 31 52.647 47.828 13.308 1.00 0.00 C ATOM 496 CD GLN A 31 52.747 46.694 12.285 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.768 46.123 11.811 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.955 46.336 11.859 1.00 0.00 N ATOM 0 H GLN A 31 49.367 48.333 15.464 1.00 0.00 H new ATOM 0 HA GLN A 31 52.108 49.001 15.624 1.00 0.00 H new ATOM 0 HB2 GLN A 31 51.006 47.033 14.449 1.00 0.00 H new ATOM 0 HB3 GLN A 31 50.524 48.147 13.185 1.00 0.00 H new ATOM 0 HG2 GLN A 31 52.902 48.768 12.818 1.00 0.00 H new ATOM 0 HG3 GLN A 31 53.389 47.664 14.089 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.785 46.794 12.236 1.00 0.00 H new ATOM 0 HE22 GLN A 31 54.051 45.604 11.156 1.00 0.00 H new ATOM 507 N ASP A 32 50.282 51.103 13.890 1.00 0.00 N ATOM 508 CA ASP A 32 50.293 52.452 13.361 1.00 0.00 C ATOM 509 C ASP A 32 50.629 53.523 14.400 1.00 0.00 C ATOM 510 O ASP A 32 51.107 54.592 14.026 1.00 0.00 O ATOM 511 CB ASP A 32 48.958 52.752 12.685 1.00 0.00 C ATOM 512 CG ASP A 32 48.792 52.028 11.348 1.00 0.00 C ATOM 513 OD1 ASP A 32 49.672 52.170 10.471 1.00 0.00 O ATOM 514 OD2 ASP A 32 47.786 51.312 11.157 1.00 0.00 O ATOM 0 H ASP A 32 49.354 50.680 13.913 1.00 0.00 H new ATOM 0 HA ASP A 32 51.100 52.494 12.629 1.00 0.00 H new ATOM 0 HB2 ASP A 32 48.146 52.463 13.352 1.00 0.00 H new ATOM 0 HB3 ASP A 32 48.871 53.827 12.524 1.00 0.00 H new ATOM 519 N LYS A 33 50.438 53.254 15.689 1.00 0.00 N ATOM 520 CA LYS A 33 50.801 54.133 16.782 1.00 0.00 C ATOM 521 C LYS A 33 52.215 53.914 17.323 1.00 0.00 C ATOM 522 O LYS A 33 52.931 54.890 17.530 1.00 0.00 O ATOM 523 CB LYS A 33 49.774 54.036 17.905 1.00 0.00 C ATOM 524 CG LYS A 33 48.652 55.066 17.811 1.00 0.00 C ATOM 525 CD LYS A 33 49.137 56.483 18.103 1.00 0.00 C ATOM 526 CE LYS A 33 48.008 57.442 18.471 1.00 0.00 C ATOM 527 NZ LYS A 33 47.191 57.874 17.326 1.00 0.00 N ATOM 0 H LYS A 33 50.010 52.384 16.006 1.00 0.00 H new ATOM 0 HA LYS A 33 50.801 55.141 16.366 1.00 0.00 H new ATOM 0 HB2 LYS A 33 49.338 53.037 17.899 1.00 0.00 H new ATOM 0 HB3 LYS A 33 50.284 54.156 18.861 1.00 0.00 H new ATOM 0 HG2 LYS A 33 48.215 55.033 16.813 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.862 54.803 18.514 1.00 0.00 H new ATOM 0 HD2 LYS A 33 49.859 56.452 18.919 1.00 0.00 H new ATOM 0 HD3 LYS A 33 49.661 56.868 17.228 1.00 0.00 H new ATOM 0 HE2 LYS A 33 47.361 56.961 19.204 1.00 0.00 H new ATOM 0 HE3 LYS A 33 48.435 58.322 18.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 46.447 58.522 17.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 47.794 58.362 16.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 46.753 57.043 16.879 1.00 0.00 H new ATOM 541 N GLU A 34 52.612 52.669 17.574 1.00 0.00 N ATOM 542 CA GLU A 34 53.804 52.311 18.315 1.00 0.00 C ATOM 543 C GLU A 34 54.885 51.598 17.500 1.00 0.00 C ATOM 544 O GLU A 34 56.002 51.436 17.986 1.00 0.00 O ATOM 545 CB GLU A 34 53.408 51.467 19.523 1.00 0.00 C ATOM 546 CG GLU A 34 52.651 52.240 20.599 1.00 0.00 C ATOM 547 CD GLU A 34 53.538 53.324 21.215 1.00 0.00 C ATOM 548 OE1 GLU A 34 54.421 52.989 22.034 1.00 0.00 O ATOM 549 OE2 GLU A 34 53.397 54.512 20.850 1.00 0.00 O ATOM 0 H GLU A 34 52.088 51.856 17.252 1.00 0.00 H new ATOM 0 HA GLU A 34 54.262 53.251 18.623 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.790 50.635 19.185 1.00 0.00 H new ATOM 0 HB3 GLU A 34 54.308 51.037 19.964 1.00 0.00 H new ATOM 0 HG2 GLU A 34 51.760 52.695 20.167 1.00 0.00 H new ATOM 0 HG3 GLU A 34 52.314 51.554 21.376 1.00 0.00 H new ATOM 556 N GLY A 35 54.588 51.167 16.278 1.00 0.00 N ATOM 557 CA GLY A 35 55.551 50.516 15.413 1.00 0.00 C ATOM 558 C GLY A 35 56.012 49.139 15.895 1.00 0.00 C ATOM 559 O GLY A 35 57.089 48.694 15.504 1.00 0.00 O ATOM 0 H GLY A 35 53.662 51.263 15.862 1.00 0.00 H new ATOM 0 HA2 GLY A 35 55.115 50.411 14.420 1.00 0.00 H new ATOM 0 HA3 GLY A 35 56.423 51.162 15.312 1.00 0.00 H new ATOM 563 N ILE A 36 55.237 48.470 16.744 1.00 0.00 N ATOM 564 CA ILE A 36 55.499 47.126 17.218 1.00 0.00 C ATOM 565 C ILE A 36 54.692 46.149 16.360 1.00 0.00 C ATOM 566 O ILE A 36 53.471 46.278 16.339 1.00 0.00 O ATOM 567 CB ILE A 36 55.174 46.976 18.701 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.899 48.015 19.552 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.535 45.569 19.168 1.00 0.00 C ATOM 570 CD1 ILE A 36 55.529 47.999 21.032 1.00 0.00 C ATOM 0 H ILE A 36 54.381 48.868 17.131 1.00 0.00 H new ATOM 0 HA ILE A 36 56.562 46.906 17.121 1.00 0.00 H new ATOM 0 HB ILE A 36 54.104 47.142 18.826 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.973 47.855 19.458 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.688 49.006 19.150 1.00 0.00 H new ATOM 0 HG21 ILE A 36 55.301 45.466 20.228 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.962 44.838 18.597 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.600 45.396 19.013 1.00 0.00 H new ATOM 0 HD11 ILE A 36 56.093 48.770 21.556 1.00 0.00 H new ATOM 0 HD12 ILE A 36 54.462 48.192 21.142 1.00 0.00 H new ATOM 0 HD13 ILE A 36 55.767 47.024 21.456 1.00 0.00 H new ATOM 582 N PRO A 37 55.293 45.174 15.683 1.00 0.00 N ATOM 583 CA PRO A 37 54.557 44.188 14.919 1.00 0.00 C ATOM 584 C PRO A 37 53.619 43.358 15.799 1.00 0.00 C ATOM 585 O PRO A 37 54.046 42.902 16.857 1.00 0.00 O ATOM 586 CB PRO A 37 55.598 43.329 14.208 1.00 0.00 C ATOM 587 CG PRO A 37 56.823 44.237 14.144 1.00 0.00 C ATOM 588 CD PRO A 37 56.715 45.036 15.439 1.00 0.00 C ATOM 0 HA PRO A 37 53.900 44.671 14.195 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.806 42.412 14.759 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.264 43.034 13.213 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.749 43.665 14.097 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.803 44.883 13.266 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.208 44.519 16.263 1.00 0.00 H new ATOM 0 HD3 PRO A 37 57.194 46.010 15.342 1.00 0.00 H new ATOM 596 N PRO A 38 52.365 43.130 15.419 1.00 0.00 N ATOM 597 CA PRO A 38 51.386 42.457 16.249 1.00 0.00 C ATOM 598 C PRO A 38 51.791 41.084 16.788 1.00 0.00 C ATOM 599 O PRO A 38 51.450 40.771 17.926 1.00 0.00 O ATOM 600 CB PRO A 38 50.121 42.356 15.402 1.00 0.00 C ATOM 601 CG PRO A 38 50.203 43.634 14.573 1.00 0.00 C ATOM 602 CD PRO A 38 51.697 43.719 14.276 1.00 0.00 C ATOM 0 HA PRO A 38 51.256 43.043 17.159 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.116 41.462 14.778 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.220 42.322 16.014 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.608 43.569 13.662 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.846 44.503 15.125 1.00 0.00 H new ATOM 0 HD2 PRO A 38 51.944 43.182 13.360 1.00 0.00 H new ATOM 0 HD3 PRO A 38 52.008 44.754 14.133 1.00 0.00 H new ATOM 610 N ASP A 39 52.580 40.302 16.055 1.00 0.00 N ATOM 611 CA ASP A 39 53.029 38.987 16.463 1.00 0.00 C ATOM 612 C ASP A 39 54.089 39.000 17.567 1.00 0.00 C ATOM 613 O ASP A 39 54.439 37.944 18.086 1.00 0.00 O ATOM 614 CB ASP A 39 53.492 38.201 15.239 1.00 0.00 C ATOM 615 CG ASP A 39 52.341 37.894 14.279 1.00 0.00 C ATOM 616 OD1 ASP A 39 51.742 36.803 14.390 1.00 0.00 O ATOM 617 OD2 ASP A 39 52.031 38.734 13.406 1.00 0.00 O ATOM 0 H ASP A 39 52.930 40.579 15.138 1.00 0.00 H new ATOM 0 HA ASP A 39 52.173 38.486 16.915 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.259 38.769 14.713 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.952 37.267 15.562 1.00 0.00 H new ATOM 622 N GLN A 40 54.567 40.176 17.964 1.00 0.00 N ATOM 623 CA GLN A 40 55.358 40.407 19.155 1.00 0.00 C ATOM 624 C GLN A 40 54.623 41.186 20.248 1.00 0.00 C ATOM 625 O GLN A 40 55.063 41.172 21.395 1.00 0.00 O ATOM 626 CB GLN A 40 56.676 41.085 18.791 1.00 0.00 C ATOM 627 CG GLN A 40 57.614 40.201 17.975 1.00 0.00 C ATOM 628 CD GLN A 40 57.459 40.370 16.461 1.00 0.00 C ATOM 629 OE1 GLN A 40 56.809 39.583 15.776 1.00 0.00 O ATOM 630 NE2 GLN A 40 58.070 41.398 15.882 1.00 0.00 N ATOM 0 H GLN A 40 54.402 41.031 17.434 1.00 0.00 H new ATOM 0 HA GLN A 40 55.559 39.425 19.584 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.464 41.993 18.227 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.183 41.390 19.707 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.644 40.426 18.253 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.434 39.158 18.235 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.610 42.054 16.446 1.00 0.00 H new ATOM 0 HE22 GLN A 40 57.999 41.531 14.873 1.00 0.00 H new ATOM 639 N GLN A 41 53.494 41.823 19.949 1.00 0.00 N ATOM 640 CA GLN A 41 52.651 42.464 20.938 1.00 0.00 C ATOM 641 C GLN A 41 51.851 41.425 21.726 1.00 0.00 C ATOM 642 O GLN A 41 51.348 40.468 21.141 1.00 0.00 O ATOM 643 CB GLN A 41 51.631 43.384 20.273 1.00 0.00 C ATOM 644 CG GLN A 41 52.109 44.625 19.526 1.00 0.00 C ATOM 645 CD GLN A 41 50.914 45.357 18.912 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.817 45.390 19.464 1.00 0.00 O ATOM 647 NE2 GLN A 41 51.034 45.935 17.720 1.00 0.00 N ATOM 0 H GLN A 41 53.139 41.906 18.996 1.00 0.00 H new ATOM 0 HA GLN A 41 53.314 43.028 21.594 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.058 42.780 19.569 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.938 43.716 21.046 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.641 45.288 20.208 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.813 44.341 18.744 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.932 45.924 17.236 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.228 46.389 17.290 1.00 0.00 H new ATOM 656 N ARG A 42 51.625 41.647 23.017 1.00 0.00 N ATOM 657 CA ARG A 42 50.544 41.046 23.772 1.00 0.00 C ATOM 658 C ARG A 42 49.745 42.109 24.527 1.00 0.00 C ATOM 659 O ARG A 42 50.311 43.115 24.950 1.00 0.00 O ATOM 660 CB ARG A 42 51.043 39.973 24.736 1.00 0.00 C ATOM 661 CG ARG A 42 51.432 38.656 24.071 1.00 0.00 C ATOM 662 CD ARG A 42 52.887 38.592 23.616 1.00 0.00 C ATOM 663 NE ARG A 42 53.161 37.312 22.962 1.00 0.00 N ATOM 664 CZ ARG A 42 52.820 36.969 21.713 1.00 0.00 C ATOM 665 NH1 ARG A 42 52.240 37.819 20.855 1.00 0.00 N ATOM 666 NH2 ARG A 42 53.055 35.720 21.285 1.00 0.00 N ATOM 0 H ARG A 42 52.208 42.268 23.578 1.00 0.00 H new ATOM 0 HA ARG A 42 49.887 40.560 23.051 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.906 40.361 25.277 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.266 39.777 25.475 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.245 37.840 24.769 1.00 0.00 H new ATOM 0 HG3 ARG A 42 50.786 38.492 23.209 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.096 39.411 22.928 1.00 0.00 H new ATOM 0 HD3 ARG A 42 53.549 38.719 24.473 1.00 0.00 H new ATOM 0 HE ARG A 42 53.661 36.612 23.511 1.00 0.00 H new ATOM 0 HH11 ARG A 42 52.039 38.777 21.143 1.00 0.00 H new ATOM 0 HH12 ARG A 42 52.000 37.509 19.914 1.00 0.00 H new ATOM 0 HH21 ARG A 42 53.490 35.040 21.909 1.00 0.00 H new ATOM 0 HH22 ARG A 42 52.799 35.450 20.335 1.00 0.00 H new ATOM 680 N LEU A 43 48.451 41.868 24.721 1.00 0.00 N ATOM 681 CA LEU A 43 47.536 42.731 25.440 1.00 0.00 C ATOM 682 C LEU A 43 46.940 42.025 26.659 1.00 0.00 C ATOM 683 O LEU A 43 46.556 40.859 26.582 1.00 0.00 O ATOM 684 CB LEU A 43 46.426 43.218 24.511 1.00 0.00 C ATOM 685 CG LEU A 43 46.869 44.147 23.384 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.662 44.507 22.521 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.476 45.446 23.906 1.00 0.00 C ATOM 0 H LEU A 43 47.998 41.027 24.363 1.00 0.00 H new ATOM 0 HA LEU A 43 48.101 43.591 25.798 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.938 42.349 24.070 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.676 43.735 25.110 1.00 0.00 H new ATOM 0 HG LEU A 43 47.628 43.615 22.811 1.00 0.00 H new ATOM 0 HD11 LEU A 43 45.976 45.171 21.715 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.234 43.599 22.097 1.00 0.00 H new ATOM 0 HD13 LEU A 43 44.913 45.009 23.134 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.775 46.072 23.065 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.738 45.976 24.508 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.349 45.219 24.518 1.00 0.00 H new ATOM 699 N ILE A 44 46.850 42.754 27.767 1.00 0.00 N ATOM 700 CA ILE A 44 46.383 42.268 29.050 1.00 0.00 C ATOM 701 C ILE A 44 45.184 43.097 29.514 1.00 0.00 C ATOM 702 O ILE A 44 45.277 44.314 29.662 1.00 0.00 O ATOM 703 CB ILE A 44 47.497 42.249 30.093 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.768 41.580 29.577 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.005 41.544 31.354 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.945 41.597 30.548 1.00 0.00 C ATOM 0 H ILE A 44 47.113 43.739 27.791 1.00 0.00 H new ATOM 0 HA ILE A 44 46.062 41.233 28.929 1.00 0.00 H new ATOM 0 HB ILE A 44 47.753 43.284 30.321 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.539 40.545 29.325 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.071 42.073 28.653 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.802 41.531 32.098 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.142 42.076 31.755 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.719 40.521 31.111 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.800 41.099 30.092 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.208 42.628 30.782 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.668 41.076 31.464 1.00 0.00 H new ATOM 718 N PHE A 45 44.070 42.423 29.785 1.00 0.00 N ATOM 719 CA PHE A 45 42.816 42.960 30.271 1.00 0.00 C ATOM 720 C PHE A 45 42.355 42.169 31.498 1.00 0.00 C ATOM 721 O PHE A 45 42.455 40.945 31.508 1.00 0.00 O ATOM 722 CB PHE A 45 41.771 42.884 29.162 1.00 0.00 C ATOM 723 CG PHE A 45 40.364 43.205 29.608 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.045 44.498 30.040 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.386 42.203 29.631 1.00 0.00 C ATOM 726 CE1 PHE A 45 38.757 44.782 30.510 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.096 42.488 30.096 1.00 0.00 C ATOM 728 CZ PHE A 45 37.779 43.780 30.534 1.00 0.00 C ATOM 0 H PHE A 45 44.024 41.412 29.659 1.00 0.00 H new ATOM 0 HA PHE A 45 42.950 44.002 30.561 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.053 43.573 28.366 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.784 41.881 28.735 1.00 0.00 H new ATOM 0 HD1 PHE A 45 40.793 45.277 30.011 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.627 41.207 29.289 1.00 0.00 H new ATOM 0 HE1 PHE A 45 38.517 45.777 30.855 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.346 41.711 30.117 1.00 0.00 H new ATOM 0 HZ PHE A 45 36.784 44.003 30.889 1.00 0.00 H new ATOM 738 N ALA A 46 41.842 42.832 32.530 1.00 0.00 N ATOM 739 CA ALA A 46 41.350 42.202 33.740 1.00 0.00 C ATOM 740 C ALA A 46 42.312 41.197 34.377 1.00 0.00 C ATOM 741 O ALA A 46 41.900 40.175 34.922 1.00 0.00 O ATOM 742 CB ALA A 46 39.948 41.661 33.479 1.00 0.00 C ATOM 0 H ALA A 46 41.757 43.848 32.543 1.00 0.00 H new ATOM 0 HA ALA A 46 41.286 42.963 34.517 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.568 41.185 34.383 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.288 42.481 33.196 1.00 0.00 H new ATOM 0 HB3 ALA A 46 39.985 40.930 32.671 1.00 0.00 H new ATOM 748 N GLY A 47 43.614 41.455 34.288 1.00 0.00 N ATOM 749 CA GLY A 47 44.680 40.592 34.757 1.00 0.00 C ATOM 750 C GLY A 47 45.088 39.452 33.823 1.00 0.00 C ATOM 751 O GLY A 47 46.116 38.836 34.097 1.00 0.00 O ATOM 0 H GLY A 47 43.965 42.314 33.866 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.559 41.207 34.950 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.377 40.161 35.711 1.00 0.00 H new ATOM 755 N LYS A 48 44.372 39.165 32.739 1.00 0.00 N ATOM 756 CA LYS A 48 44.640 38.063 31.839 1.00 0.00 C ATOM 757 C LYS A 48 45.022 38.506 30.425 1.00 0.00 C ATOM 758 O LYS A 48 44.565 39.535 29.933 1.00 0.00 O ATOM 759 CB LYS A 48 43.505 37.042 31.866 1.00 0.00 C ATOM 760 CG LYS A 48 42.214 37.477 31.180 1.00 0.00 C ATOM 761 CD LYS A 48 41.081 36.464 31.322 1.00 0.00 C ATOM 762 CE LYS A 48 41.435 35.098 30.741 1.00 0.00 C ATOM 763 NZ LYS A 48 40.313 34.154 30.854 1.00 0.00 N ATOM 0 H LYS A 48 43.562 39.717 32.459 1.00 0.00 H new ATOM 0 HA LYS A 48 45.532 37.561 32.213 1.00 0.00 H new ATOM 0 HB2 LYS A 48 43.855 36.123 31.395 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.281 36.802 32.905 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.893 38.431 31.598 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.412 37.643 30.121 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.830 36.352 32.377 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.192 36.847 30.822 1.00 0.00 H new ATOM 0 HE2 LYS A 48 41.714 35.209 29.693 1.00 0.00 H new ATOM 0 HE3 LYS A 48 42.304 34.695 31.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 40.589 33.237 30.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 40.064 34.030 31.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 39.492 34.527 30.337 1.00 0.00 H new ATOM 777 N GLN A 49 45.865 37.714 29.769 1.00 0.00 N ATOM 778 CA GLN A 49 46.296 37.938 28.403 1.00 0.00 C ATOM 779 C GLN A 49 45.189 37.604 27.400 1.00 0.00 C ATOM 780 O GLN A 49 44.411 36.675 27.607 1.00 0.00 O ATOM 781 CB GLN A 49 47.574 37.138 28.169 1.00 0.00 C ATOM 782 CG GLN A 49 48.344 37.574 26.927 1.00 0.00 C ATOM 783 CD GLN A 49 49.677 36.829 26.844 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.673 37.211 27.454 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.746 35.716 26.118 1.00 0.00 N ATOM 0 H GLN A 49 46.275 36.879 30.188 1.00 0.00 H new ATOM 0 HA GLN A 49 46.511 38.995 28.246 1.00 0.00 H new ATOM 0 HB2 GLN A 49 48.220 37.237 29.041 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.321 36.082 28.078 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.751 37.375 26.034 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.521 38.649 26.959 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.926 35.389 25.607 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.619 35.190 26.072 1.00 0.00 H new ATOM 794 N LEU A 50 45.122 38.352 26.303 1.00 0.00 N ATOM 795 CA LEU A 50 44.179 38.148 25.222 1.00 0.00 C ATOM 796 C LEU A 50 44.762 37.303 24.088 1.00 0.00 C ATOM 797 O LEU A 50 45.975 37.141 23.977 1.00 0.00 O ATOM 798 CB LEU A 50 43.666 39.506 24.749 1.00 0.00 C ATOM 799 CG LEU A 50 42.969 40.353 25.810 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.521 41.677 25.197 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.735 39.670 26.392 1.00 0.00 C ATOM 0 H LEU A 50 45.746 39.142 26.142 1.00 0.00 H new ATOM 0 HA LEU A 50 43.334 37.568 25.592 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.507 40.074 24.351 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.972 39.345 23.924 1.00 0.00 H new ATOM 0 HG LEU A 50 43.692 40.504 26.611 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.024 42.280 25.957 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.390 42.215 24.818 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.829 41.483 24.378 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.280 40.318 27.141 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.017 39.476 25.595 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.026 38.727 26.856 1.00 0.00 H new ATOM 813 N GLU A 51 43.899 36.761 23.234 1.00 0.00 N ATOM 814 CA GLU A 51 44.220 35.883 22.126 1.00 0.00 C ATOM 815 C GLU A 51 43.637 36.367 20.796 1.00 0.00 C ATOM 816 O GLU A 51 42.531 36.902 20.749 1.00 0.00 O ATOM 817 CB GLU A 51 43.727 34.467 22.407 1.00 0.00 C ATOM 818 CG GLU A 51 44.358 33.859 23.657 1.00 0.00 C ATOM 819 CD GLU A 51 44.005 32.376 23.783 1.00 0.00 C ATOM 820 OE1 GLU A 51 44.950 31.559 23.821 1.00 0.00 O ATOM 821 OE2 GLU A 51 42.803 32.039 23.834 1.00 0.00 O ATOM 0 H GLU A 51 42.897 36.937 23.306 1.00 0.00 H new ATOM 0 HA GLU A 51 45.306 35.891 22.033 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.643 34.481 22.522 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.948 33.833 21.548 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.441 33.977 23.616 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.012 34.395 24.541 1.00 0.00 H new ATOM 828 N ASP A 52 44.374 36.149 19.711 1.00 0.00 N ATOM 829 CA ASP A 52 44.302 36.930 18.492 1.00 0.00 C ATOM 830 C ASP A 52 43.101 36.649 17.587 1.00 0.00 C ATOM 831 O ASP A 52 42.612 37.569 16.938 1.00 0.00 O ATOM 832 CB ASP A 52 45.593 36.743 17.698 1.00 0.00 C ATOM 833 CG ASP A 52 46.831 37.385 18.327 1.00 0.00 C ATOM 834 OD1 ASP A 52 46.719 38.133 19.322 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.943 37.177 17.795 1.00 0.00 O ATOM 0 H ASP A 52 45.060 35.396 19.660 1.00 0.00 H new ATOM 0 HA ASP A 52 44.168 37.960 18.822 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.777 35.676 17.576 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.453 37.158 16.700 1.00 0.00 H new ATOM 840 N GLY A 53 42.622 35.410 17.520 1.00 0.00 N ATOM 841 CA GLY A 53 41.530 34.993 16.664 1.00 0.00 C ATOM 842 C GLY A 53 40.133 35.192 17.256 1.00 0.00 C ATOM 843 O GLY A 53 39.140 35.074 16.540 1.00 0.00 O ATOM 0 H GLY A 53 43.000 34.647 18.082 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.593 35.544 15.726 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.659 33.938 16.423 1.00 0.00 H new ATOM 847 N ARG A 54 40.038 35.494 18.547 1.00 0.00 N ATOM 848 CA ARG A 54 38.791 35.692 19.257 1.00 0.00 C ATOM 849 C ARG A 54 38.223 37.085 18.976 1.00 0.00 C ATOM 850 O ARG A 54 38.985 38.014 18.719 1.00 0.00 O ATOM 851 CB ARG A 54 39.000 35.500 20.757 1.00 0.00 C ATOM 852 CG ARG A 54 39.278 34.089 21.268 1.00 0.00 C ATOM 853 CD ARG A 54 40.549 33.446 20.720 1.00 0.00 C ATOM 854 NE ARG A 54 41.020 32.358 21.578 1.00 0.00 N ATOM 855 CZ ARG A 54 40.787 31.045 21.452 1.00 0.00 C ATOM 856 NH1 ARG A 54 40.033 30.508 20.483 1.00 0.00 N ATOM 857 NH2 ARG A 54 41.312 30.219 22.367 1.00 0.00 N ATOM 0 H ARG A 54 40.858 35.610 19.143 1.00 0.00 H new ATOM 0 HA ARG A 54 38.074 34.951 18.904 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.832 36.135 21.062 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.111 35.871 21.268 1.00 0.00 H new ATOM 0 HG2 ARG A 54 39.343 34.118 22.356 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.429 33.453 21.016 1.00 0.00 H new ATOM 0 HD2 ARG A 54 40.359 33.062 19.717 1.00 0.00 H new ATOM 0 HD3 ARG A 54 41.329 34.202 20.630 1.00 0.00 H new ATOM 0 HE ARG A 54 41.598 32.634 22.372 1.00 0.00 H new ATOM 0 HH11 ARG A 54 39.597 31.109 19.784 1.00 0.00 H new ATOM 0 HH12 ARG A 54 39.896 29.498 20.444 1.00 0.00 H new ATOM 0 HH21 ARG A 54 41.871 30.595 23.132 1.00 0.00 H new ATOM 0 HH22 ARG A 54 41.152 29.214 22.298 1.00 0.00 H new ATOM 871 N THR A 55 36.905 37.238 19.065 1.00 0.00 N ATOM 872 CA THR A 55 36.243 38.522 18.953 1.00 0.00 C ATOM 873 C THR A 55 36.173 39.242 20.303 1.00 0.00 C ATOM 874 O THR A 55 36.240 38.597 21.348 1.00 0.00 O ATOM 875 CB THR A 55 34.855 38.432 18.326 1.00 0.00 C ATOM 876 OG1 THR A 55 33.905 37.797 19.153 1.00 0.00 O ATOM 877 CG2 THR A 55 34.871 37.726 16.972 1.00 0.00 C ATOM 0 H THR A 55 36.264 36.460 19.219 1.00 0.00 H new ATOM 0 HA THR A 55 36.861 39.110 18.274 1.00 0.00 H new ATOM 0 HB THR A 55 34.555 39.471 18.191 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.307 37.002 19.562 1.00 0.00 H new ATOM 0 HG21 THR A 55 33.859 37.689 16.569 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.515 38.273 16.284 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.250 36.712 17.095 1.00 0.00 H new ATOM 885 N LEU A 56 35.999 40.560 20.310 1.00 0.00 N ATOM 886 CA LEU A 56 35.846 41.331 21.526 1.00 0.00 C ATOM 887 C LEU A 56 34.716 40.798 22.410 1.00 0.00 C ATOM 888 O LEU A 56 34.877 40.682 23.623 1.00 0.00 O ATOM 889 CB LEU A 56 35.614 42.788 21.136 1.00 0.00 C ATOM 890 CG LEU A 56 35.821 43.772 22.284 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.296 44.139 22.412 1.00 0.00 C ATOM 892 CD2 LEU A 56 35.009 45.043 22.049 1.00 0.00 C ATOM 0 H LEU A 56 35.961 41.123 19.460 1.00 0.00 H new ATOM 0 HA LEU A 56 36.753 41.245 22.124 1.00 0.00 H new ATOM 0 HB2 LEU A 56 36.289 43.048 20.320 1.00 0.00 H new ATOM 0 HB3 LEU A 56 34.598 42.896 20.756 1.00 0.00 H new ATOM 0 HG LEU A 56 35.486 43.293 23.204 1.00 0.00 H new ATOM 0 HD11 LEU A 56 37.426 44.841 23.235 1.00 0.00 H new ATOM 0 HD12 LEU A 56 37.879 43.239 22.607 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.638 44.599 21.485 1.00 0.00 H new ATOM 0 HD21 LEU A 56 35.168 45.734 22.877 1.00 0.00 H new ATOM 0 HD22 LEU A 56 35.328 45.512 21.118 1.00 0.00 H new ATOM 0 HD23 LEU A 56 33.950 44.792 21.984 1.00 0.00 H new ATOM 904 N SER A 57 33.605 40.388 21.806 1.00 0.00 N ATOM 905 CA SER A 57 32.459 39.805 22.474 1.00 0.00 C ATOM 906 C SER A 57 32.716 38.480 23.194 1.00 0.00 C ATOM 907 O SER A 57 31.901 38.075 24.020 1.00 0.00 O ATOM 908 CB SER A 57 31.303 39.644 21.491 1.00 0.00 C ATOM 909 OG SER A 57 31.483 38.566 20.600 1.00 0.00 O ATOM 0 H SER A 57 33.479 40.458 20.796 1.00 0.00 H new ATOM 0 HA SER A 57 32.208 40.513 23.264 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.378 39.497 22.048 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.188 40.565 20.920 1.00 0.00 H new ATOM 0 HG SER A 57 32.410 38.555 20.283 1.00 0.00 H new ATOM 915 N ASP A 58 33.834 37.807 22.937 1.00 0.00 N ATOM 916 CA ASP A 58 34.225 36.581 23.602 1.00 0.00 C ATOM 917 C ASP A 58 34.831 36.802 24.990 1.00 0.00 C ATOM 918 O ASP A 58 35.074 35.830 25.701 1.00 0.00 O ATOM 919 CB ASP A 58 35.184 35.786 22.721 1.00 0.00 C ATOM 920 CG ASP A 58 34.516 35.231 21.462 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.628 34.365 21.620 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.911 35.594 20.333 1.00 0.00 O ATOM 0 H ASP A 58 34.510 38.115 22.237 1.00 0.00 H new ATOM 0 HA ASP A 58 33.309 36.011 23.759 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.018 36.425 22.432 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.601 34.961 23.299 1.00 0.00 H new ATOM 927 N TYR A 59 35.059 38.044 25.407 1.00 0.00 N ATOM 928 CA TYR A 59 35.780 38.389 26.616 1.00 0.00 C ATOM 929 C TYR A 59 35.001 39.187 27.662 1.00 0.00 C ATOM 930 O TYR A 59 35.584 39.518 28.693 1.00 0.00 O ATOM 931 CB TYR A 59 37.057 39.132 26.234 1.00 0.00 C ATOM 932 CG TYR A 59 38.047 38.346 25.409 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.878 37.404 26.027 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.173 38.611 24.040 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.875 36.757 25.288 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.167 37.971 23.290 1.00 0.00 C ATOM 937 CZ TYR A 59 40.033 37.055 23.919 1.00 0.00 C ATOM 938 OH TYR A 59 41.043 36.461 23.222 1.00 0.00 O ATOM 0 H TYR A 59 34.734 38.862 24.891 1.00 0.00 H new ATOM 0 HA TYR A 59 35.990 37.440 27.109 1.00 0.00 H new ATOM 0 HB2 TYR A 59 36.782 40.030 25.681 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.552 39.460 27.148 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.750 37.176 27.075 1.00 0.00 H new ATOM 0 HD2 TYR A 59 37.503 39.310 23.562 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.520 36.033 25.764 1.00 0.00 H new ATOM 0 HE2 TYR A 59 39.269 38.178 22.235 1.00 0.00 H new ATOM 0 HH TYR A 59 41.248 36.994 22.425 1.00 0.00 H new ATOM 948 N ASN A 60 33.724 39.500 27.465 1.00 0.00 N ATOM 949 CA ASN A 60 32.940 40.333 28.355 1.00 0.00 C ATOM 950 C ASN A 60 33.592 41.691 28.622 1.00 0.00 C ATOM 951 O ASN A 60 33.823 42.096 29.760 1.00 0.00 O ATOM 952 CB ASN A 60 32.485 39.541 29.577 1.00 0.00 C ATOM 953 CG ASN A 60 31.486 40.309 30.445 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.766 40.646 31.593 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.285 40.588 29.946 1.00 0.00 N ATOM 0 H ASN A 60 33.196 39.169 26.657 1.00 0.00 H new ATOM 0 HA ASN A 60 32.014 40.618 27.855 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.031 38.606 29.249 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.355 39.279 30.179 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.598 41.081 30.516 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.051 40.309 28.993 1.00 0.00 H new ATOM 962 N ILE A 61 33.906 42.398 27.541 1.00 0.00 N ATOM 963 CA ILE A 61 34.505 43.717 27.531 1.00 0.00 C ATOM 964 C ILE A 61 33.381 44.749 27.408 1.00 0.00 C ATOM 965 O ILE A 61 32.816 44.937 26.333 1.00 0.00 O ATOM 966 CB ILE A 61 35.558 43.779 26.428 1.00 0.00 C ATOM 967 CG1 ILE A 61 36.779 42.953 26.821 1.00 0.00 C ATOM 968 CG2 ILE A 61 35.966 45.217 26.122 1.00 0.00 C ATOM 969 CD1 ILE A 61 37.757 42.680 25.682 1.00 0.00 C ATOM 0 H ILE A 61 33.738 42.042 26.600 1.00 0.00 H new ATOM 0 HA ILE A 61 35.036 43.944 28.455 1.00 0.00 H new ATOM 0 HB ILE A 61 35.119 43.360 25.522 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.309 43.471 27.621 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.441 42.000 27.228 1.00 0.00 H new ATOM 0 HG21 ILE A 61 36.717 45.222 25.332 1.00 0.00 H new ATOM 0 HG22 ILE A 61 35.092 45.781 25.796 1.00 0.00 H new ATOM 0 HG23 ILE A 61 36.380 45.676 27.019 1.00 0.00 H new ATOM 0 HD11 ILE A 61 38.593 42.087 26.054 1.00 0.00 H new ATOM 0 HD12 ILE A 61 37.248 42.132 24.889 1.00 0.00 H new ATOM 0 HD13 ILE A 61 38.130 43.625 25.288 1.00 0.00 H new ATOM 981 N GLN A 62 33.026 45.378 28.524 1.00 0.00 N ATOM 982 CA GLN A 62 31.825 46.177 28.664 1.00 0.00 C ATOM 983 C GLN A 62 32.098 47.675 28.812 1.00 0.00 C ATOM 984 O GLN A 62 33.011 48.064 29.538 1.00 0.00 O ATOM 985 CB GLN A 62 31.011 45.674 29.853 1.00 0.00 C ATOM 986 CG GLN A 62 30.642 44.194 29.827 1.00 0.00 C ATOM 987 CD GLN A 62 29.983 43.742 28.521 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.564 42.997 27.734 1.00 0.00 O ATOM 989 NE2 GLN A 62 28.759 44.183 28.247 1.00 0.00 N ATOM 0 H GLN A 62 33.585 45.342 29.376 1.00 0.00 H new ATOM 0 HA GLN A 62 31.262 46.060 27.738 1.00 0.00 H new ATOM 0 HB2 GLN A 62 31.574 45.873 30.765 1.00 0.00 H new ATOM 0 HB3 GLN A 62 30.092 46.257 29.913 1.00 0.00 H new ATOM 0 HG2 GLN A 62 31.542 43.602 29.992 1.00 0.00 H new ATOM 0 HG3 GLN A 62 29.966 43.984 30.656 1.00 0.00 H new ATOM 0 HE21 GLN A 62 28.281 44.801 28.903 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.298 43.903 27.381 1.00 0.00 H new ATOM 998 N LYS A 63 31.248 48.489 28.193 1.00 0.00 N ATOM 999 CA LYS A 63 31.168 49.936 28.188 1.00 0.00 C ATOM 1000 C LYS A 63 32.446 50.718 27.879 1.00 0.00 C ATOM 1001 O LYS A 63 32.489 51.408 26.863 1.00 0.00 O ATOM 1002 CB LYS A 63 30.486 50.459 29.449 1.00 0.00 C ATOM 1003 CG LYS A 63 28.972 50.280 29.508 1.00 0.00 C ATOM 1004 CD LYS A 63 28.230 51.141 28.489 1.00 0.00 C ATOM 1005 CE LYS A 63 26.729 51.202 28.760 1.00 0.00 C ATOM 1006 NZ LYS A 63 26.387 52.177 29.808 1.00 0.00 N ATOM 0 H LYS A 63 30.509 48.093 27.612 1.00 0.00 H new ATOM 0 HA LYS A 63 30.550 50.137 27.313 1.00 0.00 H new ATOM 0 HB2 LYS A 63 30.926 49.958 30.311 1.00 0.00 H new ATOM 0 HB3 LYS A 63 30.711 51.521 29.547 1.00 0.00 H new ATOM 0 HG2 LYS A 63 28.729 49.232 29.336 1.00 0.00 H new ATOM 0 HG3 LYS A 63 28.621 50.528 30.510 1.00 0.00 H new ATOM 0 HD2 LYS A 63 28.640 52.151 28.504 1.00 0.00 H new ATOM 0 HD3 LYS A 63 28.400 50.742 27.489 1.00 0.00 H new ATOM 0 HE2 LYS A 63 26.207 51.464 27.840 1.00 0.00 H new ATOM 0 HE3 LYS A 63 26.376 50.215 29.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 25.358 52.181 29.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 26.863 51.915 30.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 26.699 53.125 29.515 1.00 0.00 H new ATOM 1020 N GLU A 64 33.450 50.680 28.751 1.00 0.00 N ATOM 1021 CA GLU A 64 34.694 51.415 28.657 1.00 0.00 C ATOM 1022 C GLU A 64 35.754 50.679 29.479 1.00 0.00 C ATOM 1023 O GLU A 64 35.481 50.270 30.605 1.00 0.00 O ATOM 1024 CB GLU A 64 34.477 52.841 29.153 1.00 0.00 C ATOM 1025 CG GLU A 64 35.662 53.756 28.860 1.00 0.00 C ATOM 1026 CD GLU A 64 35.365 55.201 29.265 1.00 0.00 C ATOM 1027 OE1 GLU A 64 35.504 55.514 30.467 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.010 56.043 28.412 1.00 0.00 O ATOM 0 H GLU A 64 33.408 50.099 29.589 1.00 0.00 H new ATOM 0 HA GLU A 64 35.038 51.475 27.624 1.00 0.00 H new ATOM 0 HB2 GLU A 64 33.582 53.251 28.685 1.00 0.00 H new ATOM 0 HB3 GLU A 64 34.295 52.823 30.227 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.541 53.399 29.397 1.00 0.00 H new ATOM 0 HG3 GLU A 64 35.900 53.716 27.797 1.00 0.00 H new ATOM 1035 N SER A 65 36.945 50.485 28.920 1.00 0.00 N ATOM 1036 CA SER A 65 38.000 49.680 29.500 1.00 0.00 C ATOM 1037 C SER A 65 39.399 50.270 29.311 1.00 0.00 C ATOM 1038 O SER A 65 39.642 51.081 28.419 1.00 0.00 O ATOM 1039 CB SER A 65 38.037 48.279 28.896 1.00 0.00 C ATOM 1040 OG SER A 65 36.783 47.647 28.776 1.00 0.00 O ATOM 0 H SER A 65 37.204 50.899 28.024 1.00 0.00 H new ATOM 0 HA SER A 65 37.757 49.653 30.562 1.00 0.00 H new ATOM 0 HB2 SER A 65 38.493 48.338 27.908 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.685 47.653 29.509 1.00 0.00 H new ATOM 0 HG SER A 65 36.871 46.699 29.008 1.00 0.00 H new ATOM 1046 N THR A 66 40.365 49.779 30.082 1.00 0.00 N ATOM 1047 CA THR A 66 41.783 50.003 29.883 1.00 0.00 C ATOM 1048 C THR A 66 42.566 48.688 29.881 1.00 0.00 C ATOM 1049 O THR A 66 42.152 47.705 30.492 1.00 0.00 O ATOM 1050 CB THR A 66 42.326 51.029 30.872 1.00 0.00 C ATOM 1051 OG1 THR A 66 43.671 51.345 30.590 1.00 0.00 O ATOM 1052 CG2 THR A 66 42.242 50.598 32.334 1.00 0.00 C ATOM 0 H THR A 66 40.168 49.192 30.893 1.00 0.00 H new ATOM 0 HA THR A 66 41.923 50.434 28.892 1.00 0.00 H new ATOM 0 HB THR A 66 41.681 51.898 30.742 1.00 0.00 H new ATOM 0 HG1 THR A 66 43.755 51.609 29.650 1.00 0.00 H new ATOM 0 HG21 THR A 66 42.649 51.385 32.969 1.00 0.00 H new ATOM 0 HG22 THR A 66 41.201 50.418 32.601 1.00 0.00 H new ATOM 0 HG23 THR A 66 42.816 49.683 32.477 1.00 0.00 H new ATOM 1060 N LEU A 67 43.673 48.651 29.144 1.00 0.00 N ATOM 1061 CA LEU A 67 44.532 47.500 28.958 1.00 0.00 C ATOM 1062 C LEU A 67 46.000 47.879 29.161 1.00 0.00 C ATOM 1063 O LEU A 67 46.353 49.054 29.088 1.00 0.00 O ATOM 1064 CB LEU A 67 44.343 46.896 27.569 1.00 0.00 C ATOM 1065 CG LEU A 67 42.945 46.392 27.225 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.075 47.464 26.574 1.00 0.00 C ATOM 1067 CD2 LEU A 67 43.048 45.257 26.210 1.00 0.00 C ATOM 0 H LEU A 67 44.007 49.470 28.636 1.00 0.00 H new ATOM 0 HA LEU A 67 44.253 46.756 29.704 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.625 47.646 26.831 1.00 0.00 H new ATOM 0 HB3 LEU A 67 45.040 46.065 27.462 1.00 0.00 H new ATOM 0 HG LEU A 67 42.495 46.078 28.167 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.092 47.049 26.351 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.967 48.308 27.255 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.544 47.802 25.650 1.00 0.00 H new ATOM 0 HD21 LEU A 67 42.049 44.897 25.964 1.00 0.00 H new ATOM 0 HD22 LEU A 67 43.535 45.621 25.305 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.633 44.441 26.634 1.00 0.00 H new ATOM 1079 N HIS A 68 46.869 46.890 29.350 1.00 0.00 N ATOM 1080 CA HIS A 68 48.310 47.031 29.279 1.00 0.00 C ATOM 1081 C HIS A 68 48.875 46.281 28.071 1.00 0.00 C ATOM 1082 O HIS A 68 48.313 45.266 27.664 1.00 0.00 O ATOM 1083 CB HIS A 68 48.959 46.525 30.564 1.00 0.00 C ATOM 1084 CG HIS A 68 48.671 47.378 31.770 1.00 0.00 C ATOM 1085 ND1 HIS A 68 49.190 48.652 31.997 1.00 0.00 N ATOM 1086 CD2 HIS A 68 47.880 47.022 32.831 1.00 0.00 C ATOM 1087 CE1 HIS A 68 48.714 49.030 33.185 1.00 0.00 C ATOM 1088 NE2 HIS A 68 47.924 48.082 33.715 1.00 0.00 N ATOM 0 H HIS A 68 46.573 45.938 29.564 1.00 0.00 H new ATOM 0 HA HIS A 68 48.540 48.090 29.162 1.00 0.00 H new ATOM 0 HB2 HIS A 68 48.613 45.510 30.758 1.00 0.00 H new ATOM 0 HB3 HIS A 68 50.038 46.472 30.418 1.00 0.00 H new ATOM 0 HD2 HIS A 68 47.333 46.099 32.951 1.00 0.00 H new ATOM 0 HE1 HIS A 68 48.935 49.975 33.659 1.00 0.00 H new ATOM 0 HE2 HIS A 68 47.442 48.136 34.612 1.00 0.00 H new ATOM 1096 N LEU A 69 49.983 46.760 27.514 1.00 0.00 N ATOM 1097 CA LEU A 69 50.730 46.111 26.455 1.00 0.00 C ATOM 1098 C LEU A 69 52.087 45.611 26.954 1.00 0.00 C ATOM 1099 O LEU A 69 52.795 46.348 27.636 1.00 0.00 O ATOM 1100 CB LEU A 69 50.847 47.067 25.272 1.00 0.00 C ATOM 1101 CG LEU A 69 51.620 46.523 24.075 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.063 47.102 22.776 1.00 0.00 C ATOM 1103 CD2 LEU A 69 53.100 46.893 24.100 1.00 0.00 C ATOM 0 H LEU A 69 50.397 47.646 27.803 1.00 0.00 H new ATOM 0 HA LEU A 69 50.197 45.221 26.120 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.844 47.339 24.944 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.331 47.983 25.611 1.00 0.00 H new ATOM 0 HG LEU A 69 51.511 45.440 24.130 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.624 46.705 21.930 1.00 0.00 H new ATOM 0 HD12 LEU A 69 50.013 46.827 22.676 1.00 0.00 H new ATOM 0 HD13 LEU A 69 51.153 48.188 22.794 1.00 0.00 H new ATOM 0 HD21 LEU A 69 53.594 46.477 23.222 1.00 0.00 H new ATOM 0 HD22 LEU A 69 53.204 47.978 24.094 1.00 0.00 H new ATOM 0 HD23 LEU A 69 53.561 46.489 25.001 1.00 0.00 H new ATOM 1115 N VAL A 70 52.471 44.397 26.569 1.00 0.00 N ATOM 1116 CA VAL A 70 53.784 43.825 26.785 1.00 0.00 C ATOM 1117 C VAL A 70 54.373 43.246 25.496 1.00 0.00 C ATOM 1118 O VAL A 70 53.661 43.049 24.513 1.00 0.00 O ATOM 1119 CB VAL A 70 53.802 42.813 27.927 1.00 0.00 C ATOM 1120 CG1 VAL A 70 53.344 43.426 29.247 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.972 41.564 27.644 1.00 0.00 C ATOM 0 H VAL A 70 51.843 43.762 26.077 1.00 0.00 H new ATOM 0 HA VAL A 70 54.432 44.646 27.093 1.00 0.00 H new ATOM 0 HB VAL A 70 54.846 42.512 28.011 1.00 0.00 H new ATOM 0 HG11 VAL A 70 53.374 42.668 30.030 1.00 0.00 H new ATOM 0 HG12 VAL A 70 54.006 44.250 29.514 1.00 0.00 H new ATOM 0 HG13 VAL A 70 52.325 43.799 29.141 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.029 40.888 28.497 1.00 0.00 H new ATOM 0 HG22 VAL A 70 51.933 41.848 27.475 1.00 0.00 H new ATOM 0 HG23 VAL A 70 53.360 41.063 26.757 1.00 0.00 H new