Browse entries in the PDBbind-CN Database
HEADER 5Q0N_COMPLEX COMPND 5Q0N_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 229 MET GLU LEU THR PRO ASP GLN GLN THR LEU LEU HIS PHE SEQRES 2 A 229 ILE MET ASP SER TYR ASN LYS GLN ARG MET PRO GLN GLU SEQRES 3 A 229 ILE THR ASN LYS ILE LEU LYS GLU ALA PHE SER ALA GLU SEQRES 4 A 229 GLU ASN PHE LEU ILE LEU THR GLU MET ALA THR ASN HIS SEQRES 5 A 229 VAL GLN VAL LEU VAL GLU PHE THR LYS LYS LEU PRO GLY SEQRES 6 A 229 PHE GLN THR LEU ASP HIS GLU ASP GLN ILE ALA LEU LEU SEQRES 7 A 229 LYS GLY SER ALA VAL GLU ALA MET PHE LEU ARG SER ALA SEQRES 8 A 229 GLU ILE PHE ASN LYS LYS LEU PRO SER GLY HIS SER ASP SEQRES 9 A 229 LEU LEU GLU ALA ARG ILE ARG ASN SER GLY ILE SER ASP SEQRES 10 A 229 GLU TYR ILE THR PRO MET PHE SER PHE TYR LYS SER ILE SEQRES 11 A 229 GLY GLU LEU LYS MET THR GLN GLU GLU TYR ALA LEU LEU SEQRES 12 A 229 THR ALA ILE VAL ILE LEU SER PRO ASP ARG GLN TYR ILE SEQRES 13 A 229 LYS ASP ARG GLU ALA VAL GLU LYS LEU GLN GLU PRO LEU SEQRES 14 A 229 LEU ASP VAL LEU GLN LYS LEU CYS LYS ILE HIS GLN PRO SEQRES 15 A 229 GLU ASN PRO GLN HIS PHE ALA CYS LEU LEU GLY ARG LEU SEQRES 16 A 229 THR GLU LEU ARG THR PHE ASN HIS HIS HIS ALA GLU MET SEQRES 17 A 229 LEU MET SER TRP ARG VAL ASN ASP HIS LYS PHE THR PRO SEQRES 18 A 229 LEU LEU CYS GLU ILE TRP ASP VAL HET UNN A 358 60 ATOM 1 N MET A 247 40.183 17.939 -29.740 1.00 79.19 N ATOM 2 CA MET A 247 40.576 16.931 -28.758 1.00 78.73 C ATOM 3 C MET A 247 41.023 17.582 -27.435 1.00 79.79 C ATOM 4 O MET A 247 40.321 17.452 -26.431 1.00 77.76 O ATOM 5 CB MET A 247 41.668 16.018 -29.336 1.00 83.89 C ATOM 6 CG MET A 247 41.627 14.602 -28.803 1.00 88.03 C ATOM 7 SD MET A 247 43.078 13.654 -29.334 1.00 96.04 S ATOM 8 CE MET A 247 42.676 13.355 -31.082 1.00 94.32 C ATOM 9 HN3 MET A 247 40.991 18.565 -29.935 1.00 0.00 H ATOM 10 HN2 MET A 247 39.392 18.499 -29.363 1.00 0.00 H ATOM 11 HN1 MET A 247 39.888 17.468 -30.619 1.00 0.00 H ATOM 12 N GLU A 248 42.172 18.298 -27.447 1.00 75.97 N ATOM 13 CA GLU A 248 42.759 19.011 -26.296 1.00 74.00 C ATOM 14 C GLU A 248 42.115 20.396 -26.128 1.00 70.97 C ATOM 15 O GLU A 248 41.673 20.977 -27.125 1.00 70.23 O ATOM 16 CB GLU A 248 44.279 19.187 -26.502 1.00 78.09 C ATOM 17 CG GLU A 248 45.087 17.913 -26.315 1.00 92.67 C ATOM 18 CD GLU A 248 45.777 17.784 -24.971 1.00116.51 C ATOM 19 OE1 GLU A 248 47.024 17.652 -24.960 1.00116.20 O ATOM 20 OE2 GLU A 248 45.078 17.814 -23.931 1.00105.08 O ATOM 21 H GLU A 248 42.687 18.350 -28.349 1.00 0.00 H ATOM 22 N LEU A 249 42.079 20.934 -24.880 1.00 62.36 N ATOM 23 CA LEU A 249 41.521 22.272 -24.638 1.00 59.51 C ATOM 24 C LEU A 249 42.344 23.359 -25.341 1.00 61.76 C ATOM 25 O LEU A 249 43.571 23.298 -25.358 1.00 62.27 O ATOM 26 CB LEU A 249 41.432 22.615 -23.142 1.00 58.08 C ATOM 27 CG LEU A 249 40.516 21.791 -22.240 1.00 60.25 C ATOM 28 CD1 LEU A 249 40.780 22.127 -20.795 1.00 60.07 C ATOM 29 CD2 LEU A 249 39.059 22.060 -22.534 1.00 60.58 C ATOM 30 H LEU A 249 42.454 20.387 -24.079 1.00 0.00 H ATOM 31 N THR A 250 41.653 24.351 -25.912 1.00 56.58 N ATOM 32 CA THR A 250 42.260 25.493 -26.593 1.00 57.44 C ATOM 33 C THR A 250 42.677 26.519 -25.523 1.00 61.48 C ATOM 34 O THR A 250 42.122 26.460 -24.421 1.00 59.07 O ATOM 35 CB THR A 250 41.258 26.133 -27.573 1.00 56.20 C ATOM 36 OG1 THR A 250 40.157 26.664 -26.837 1.00 47.44 O ATOM 37 CG2 THR A 250 40.799 25.173 -28.669 1.00 54.33 C ATOM 38 HG1 THR A 250 39.511 27.076 -27.464 1.00 0.00 H ATOM 39 H THR A 250 40.615 24.307 -25.869 1.00 0.00 H ATOM 40 N PRO A 251 43.586 27.494 -25.823 1.00 59.97 N ATOM 41 CA PRO A 251 43.946 28.505 -24.806 1.00 59.55 C ATOM 42 C PRO A 251 42.739 29.223 -24.198 1.00 59.05 C ATOM 43 O PRO A 251 42.731 29.458 -22.995 1.00 58.16 O ATOM 44 CB PRO A 251 44.861 29.468 -25.570 1.00 63.88 C ATOM 45 CG PRO A 251 45.428 28.661 -26.675 1.00 69.59 C ATOM 46 CD PRO A 251 44.339 27.716 -27.079 1.00 63.48 C ATOM 47 N ASP A 252 41.706 29.516 -25.015 1.00 53.32 N ATOM 48 CA ASP A 252 40.460 30.149 -24.579 1.00 50.44 C ATOM 49 C ASP A 252 39.669 29.274 -23.621 1.00 50.28 C ATOM 50 O ASP A 252 39.116 29.801 -22.659 1.00 48.13 O ATOM 51 CB ASP A 252 39.579 30.539 -25.779 1.00 52.37 C ATOM 52 CG ASP A 252 39.958 31.850 -26.424 1.00 65.61 C ATOM 53 OD1 ASP A 252 41.117 32.289 -26.239 1.00 69.26 O ATOM 54 OD2 ASP A 252 39.093 32.446 -27.109 1.00 67.55 O ATOM 55 H ASP A 252 41.801 29.276 -26.022 1.00 0.00 H ATOM 56 N GLN A 253 39.623 27.950 -23.868 1.00 45.51 N ATOM 57 CA GLN A 253 38.907 27.002 -23.007 1.00 43.38 C ATOM 58 C GLN A 253 39.607 26.822 -21.663 1.00 48.54 C ATOM 59 O GLN A 253 38.938 26.733 -20.631 1.00 46.46 O ATOM 60 CB GLN A 253 38.717 25.649 -23.705 1.00 44.44 C ATOM 61 CG GLN A 253 37.716 25.691 -24.857 1.00 44.54 C ATOM 62 CD GLN A 253 37.628 24.392 -25.602 1.00 56.77 C ATOM 63 OE1 GLN A 253 38.624 23.734 -25.897 1.00 47.28 O ATOM 64 NE2 GLN A 253 36.418 24.001 -25.946 1.00 56.01 N ATOM 65 HE22 GLN A 253 35.592 24.576 -25.684 1.00 0.00 H ATOM 66 HE21 GLN A 253 36.289 23.118 -26.479 1.00 0.00 H ATOM 67 H GLN A 253 40.117 27.584 -24.707 1.00 0.00 H ATOM 68 N GLN A 254 40.949 26.815 -21.673 1.00 47.68 N ATOM 69 CA GLN A 254 41.767 26.690 -20.472 1.00 48.90 C ATOM 70 C GLN A 254 41.614 27.920 -19.577 1.00 54.12 C ATOM 71 O GLN A 254 41.624 27.785 -18.350 1.00 54.45 O ATOM 72 CB GLN A 254 43.234 26.469 -20.849 1.00 52.76 C ATOM 73 CG GLN A 254 44.027 25.769 -19.766 1.00 74.29 C ATOM 74 CD GLN A 254 45.376 25.392 -20.295 1.00103.41 C ATOM 75 OE1 GLN A 254 46.267 26.237 -20.462 1.00102.33 O ATOM 76 NE2 GLN A 254 45.567 24.109 -20.560 1.00 95.95 N ATOM 77 HE22 GLN A 254 44.797 23.426 -20.408 1.00 0.00 H ATOM 78 HE21 GLN A 254 46.487 23.784 -20.920 1.00 0.00 H ATOM 79 H GLN A 254 41.433 26.904 -22.589 1.00 0.00 H ATOM 80 N THR A 255 41.461 29.111 -20.192 1.00 50.27 N ATOM 81 CA THR A 255 41.251 30.395 -19.522 1.00 49.83 C ATOM 82 C THR A 255 39.878 30.346 -18.847 1.00 52.85 C ATOM 83 O THR A 255 39.746 30.717 -17.673 1.00 52.89 O ATOM 84 CB THR A 255 41.402 31.536 -20.555 1.00 57.39 C ATOM 85 OG1 THR A 255 42.767 31.600 -20.975 1.00 60.10 O ATOM 86 CG2 THR A 255 40.957 32.891 -20.032 1.00 53.68 C ATOM 87 HG1 THR A 255 43.025 30.738 -21.387 1.00 0.00 H ATOM 88 H THR A 255 41.495 29.117 -21.231 1.00 0.00 H ATOM 89 N LEU A 256 38.866 29.847 -19.591 1.00 47.58 N ATOM 90 CA LEU A 256 37.494 29.693 -19.124 1.00 45.25 C ATOM 91 C LEU A 256 37.413 28.737 -17.927 1.00 46.60 C ATOM 92 O LEU A 256 36.789 29.076 -16.923 1.00 44.45 O ATOM 93 CB LEU A 256 36.595 29.213 -20.278 1.00 44.89 C ATOM 94 CG LEU A 256 35.127 28.999 -19.959 1.00 48.37 C ATOM 95 CD1 LEU A 256 34.461 30.297 -19.484 1.00 48.39 C ATOM 96 CD2 LEU A 256 34.418 28.442 -21.142 1.00 50.41 C ATOM 97 H LEU A 256 39.081 29.552 -20.565 1.00 0.00 H ATOM 98 N LEU A 257 38.057 27.568 -18.035 1.00 43.73 N ATOM 99 CA LEU A 257 38.085 26.543 -16.998 1.00 43.21 C ATOM 100 C LEU A 257 38.701 27.068 -15.694 1.00 47.53 C ATOM 101 O LEU A 257 38.110 26.872 -14.626 1.00 45.52 O ATOM 102 CB LEU A 257 38.813 25.286 -17.520 1.00 44.31 C ATOM 103 CG LEU A 257 39.095 24.147 -16.522 1.00 48.73 C ATOM 104 CD1 LEU A 257 37.792 23.524 -15.974 1.00 47.64 C ATOM 105 CD2 LEU A 257 39.973 23.105 -17.150 1.00 51.06 C ATOM 106 H LEU A 257 38.572 27.378 -18.918 1.00 0.00 H ATOM 107 N HIS A 258 39.855 27.773 -15.789 1.00 45.70 N ATOM 108 CA HIS A 258 40.535 28.349 -14.623 1.00 45.70 C ATOM 109 C HIS A 258 39.683 29.412 -13.943 1.00 44.39 C ATOM 110 O HIS A 258 39.623 29.450 -12.718 1.00 42.96 O ATOM 111 CB HIS A 258 41.913 28.916 -14.997 1.00 49.53 C ATOM 112 CG HIS A 258 42.921 27.908 -15.467 1.00 54.90 C ATOM 113 ND1 HIS A 258 44.201 28.299 -15.814 1.00 59.86 N ATOM 114 CD2 HIS A 258 42.811 26.570 -15.656 1.00 56.64 C ATOM 115 CE1 HIS A 258 44.833 27.196 -16.177 1.00 60.35 C ATOM 116 NE2 HIS A 258 44.037 26.130 -16.110 1.00 58.89 N ATOM 117 H HIS A 258 40.277 27.912 -16.729 1.00 0.00 H ATOM 118 N PHE A 259 38.992 30.238 -14.738 1.00 39.33 N ATOM 119 CA PHE A 259 38.103 31.289 -14.237 1.00 38.61 C ATOM 120 C PHE A 259 36.870 30.716 -13.515 1.00 41.56 C ATOM 121 O PHE A 259 36.442 31.300 -12.525 1.00 42.60 O ATOM 122 CB PHE A 259 37.681 32.224 -15.377 1.00 40.56 C ATOM 123 CG PHE A 259 36.799 33.372 -14.963 1.00 41.79 C ATOM 124 CD1 PHE A 259 37.345 34.525 -14.410 1.00 46.97 C ATOM 125 CD2 PHE A 259 35.437 33.338 -15.201 1.00 42.33 C ATOM 126 CE1 PHE A 259 36.535 35.613 -14.072 1.00 47.79 C ATOM 127 CE2 PHE A 259 34.629 34.419 -14.847 1.00 46.03 C ATOM 128 CZ PHE A 259 35.182 35.549 -14.283 1.00 45.78 C ATOM 129 H PHE A 259 39.092 30.128 -15.767 1.00 0.00 H ATOM 130 N ILE A 260 36.300 29.601 -14.015 1.00 36.30 N ATOM 131 CA ILE A 260 35.148 28.925 -13.401 1.00 35.05 C ATOM 132 C ILE A 260 35.584 28.310 -12.067 1.00 38.28 C ATOM 133 O ILE A 260 34.840 28.386 -11.087 1.00 35.36 O ATOM 134 CB ILE A 260 34.504 27.882 -14.376 1.00 37.92 C ATOM 135 CG1 ILE A 260 33.851 28.554 -15.608 1.00 39.20 C ATOM 136 CG2 ILE A 260 33.524 26.911 -13.689 1.00 37.82 C ATOM 137 CD1 ILE A 260 32.702 29.535 -15.360 1.00 50.79 C ATOM 138 H ILE A 260 36.699 29.196 -14.886 1.00 0.00 H ATOM 139 N MET A 261 36.807 27.740 -12.039 1.00 37.80 N ATOM 140 CA MET A 261 37.417 27.123 -10.863 1.00 38.93 C ATOM 141 C MET A 261 37.671 28.096 -9.737 1.00 43.27 C ATOM 142 O MET A 261 37.377 27.765 -8.590 1.00 42.49 O ATOM 143 CB MET A 261 38.701 26.357 -11.224 1.00 43.13 C ATOM 144 CG MET A 261 38.442 24.954 -11.750 1.00 46.78 C ATOM 145 SD MET A 261 37.248 23.978 -10.791 1.00 50.62 S ATOM 146 CE MET A 261 38.136 23.718 -9.272 1.00 48.49 C ATOM 147 H MET A 261 37.357 27.740 -12.922 1.00 0.00 H ATOM 148 N ASP A 262 38.194 29.298 -10.053 1.00 41.42 N ATOM 149 CA ASP A 262 38.448 30.338 -9.054 1.00 42.18 C ATOM 150 C ASP A 262 37.143 30.722 -8.357 1.00 42.98 C ATOM 151 O ASP A 262 37.107 30.757 -7.128 1.00 41.83 O ATOM 152 CB ASP A 262 39.115 31.581 -9.682 1.00 46.14 C ATOM 153 CG ASP A 262 40.478 31.354 -10.315 1.00 63.33 C ATOM 154 OD1 ASP A 262 41.071 30.264 -10.092 1.00 65.67 O ATOM 155 OD2 ASP A 262 40.946 32.252 -11.055 1.00 69.21 O ATOM 156 H ASP A 262 38.427 29.495 -11.047 1.00 0.00 H ATOM 157 N SER A 263 36.069 30.947 -9.151 1.00 37.54 N ATOM 158 CA SER A 263 34.722 31.303 -8.692 1.00 36.45 C ATOM 159 C SER A 263 34.111 30.195 -7.843 1.00 40.13 C ATOM 160 O SER A 263 33.453 30.496 -6.848 1.00 40.31 O ATOM 161 CB SER A 263 33.798 31.579 -9.874 1.00 39.41 C ATOM 162 OG SER A 263 34.380 32.458 -10.819 1.00 53.49 O ATOM 163 HG SER A 263 35.215 32.058 -11.169 1.00 0.00 H ATOM 164 H SER A 263 36.212 30.860 -10.177 1.00 0.00 H ATOM 165 N TYR A 264 34.304 28.926 -8.251 1.00 35.61 N ATOM 166 CA TYR A 264 33.770 27.758 -7.551 1.00 35.07 C ATOM 167 C TYR A 264 34.464 27.513 -6.211 1.00 43.23 C ATOM 168 O TYR A 264 33.823 27.027 -5.275 1.00 41.56 O ATOM 169 CB TYR A 264 33.867 26.503 -8.426 1.00 35.11 C ATOM 170 CG TYR A 264 32.937 25.400 -7.976 1.00 35.40 C ATOM 171 CD1 TYR A 264 31.560 25.489 -8.196 1.00 36.58 C ATOM 172 CD2 TYR A 264 33.425 24.272 -7.315 1.00 35.06 C ATOM 173 CE1 TYR A 264 30.693 24.488 -7.759 1.00 37.37 C ATOM 174 CE2 TYR A 264 32.566 23.257 -6.887 1.00 34.84 C ATOM 175 CZ TYR A 264 31.203 23.368 -7.116 1.00 42.28 C ATOM 176 OH TYR A 264 30.338 22.375 -6.725 1.00 44.26 O ATOM 177 HH TYR A 264 29.413 22.629 -6.971 1.00 0.00 H ATOM 178 H TYR A 264 34.864 28.768 -9.113 1.00 0.00 H ATOM 179 N ASN A 265 35.768 27.860 -6.123 1.00 43.25 N ATOM 180 CA ASN A 265 36.588 27.721 -4.924 1.00 45.47 C ATOM 181 C ASN A 265 36.250 28.743 -3.821 1.00 51.67 C ATOM 182 O ASN A 265 36.662 28.558 -2.675 1.00 51.65 O ATOM 183 CB ASN A 265 38.079 27.747 -5.281 1.00 48.39 C ATOM 184 CG ASN A 265 38.595 26.431 -5.825 1.00 66.60 C ATOM 185 OD1 ASN A 265 38.094 25.343 -5.496 1.00 54.65 O ATOM 186 ND2 ASN A 265 39.640 26.501 -6.643 1.00 60.81 N ATOM 187 HD22 ASN A 265 40.038 27.427 -6.900 1.00 0.00 H ATOM 188 HD21 ASN A 265 40.060 25.630 -7.026 1.00 0.00 H ATOM 189 H ASN A 265 36.220 28.255 -6.972 1.00 0.00 H ATOM 190 N LYS A 266 35.470 29.791 -4.162 1.00 49.29 N ATOM 191 CA LYS A 266 34.993 30.831 -3.242 1.00 50.41 C ATOM 192 C LYS A 266 33.849 30.282 -2.331 1.00 58.36 C ATOM 193 O LYS A 266 33.259 31.044 -1.553 1.00 60.37 O ATOM 194 CB LYS A 266 34.503 32.050 -4.048 1.00 52.11 C ATOM 195 CG LYS A 266 35.203 33.378 -3.778 1.00 65.46 C ATOM 196 CD LYS A 266 36.579 33.523 -4.422 1.00 73.78 C ATOM 197 CE LYS A 266 37.136 34.918 -4.281 1.00 83.64 C ATOM 198 NZ LYS A 266 37.615 35.206 -2.896 1.00 88.63 N ATOM 199 HZ1 LYS A 266 36.823 35.108 -2.229 1.00 0.00 H ATOM 200 HZ2 LYS A 266 38.367 34.533 -2.644 1.00 0.00 H ATOM 201 HZ3 LYS A 266 37.987 36.176 -2.854 1.00 0.00 H ATOM 202 H LYS A 266 35.183 29.868 -5.159 1.00 0.00 H ATOM 203 N GLN A 267 33.556 28.969 -2.416 1.00 54.83 N ATOM 204 CA GLN A 267 32.517 28.295 -1.631 1.00 54.14 C ATOM 205 C GLN A 267 33.001 27.898 -0.243 1.00 61.14 C ATOM 206 O GLN A 267 34.213 27.851 -0.005 1.00 62.09 O ATOM 207 CB GLN A 267 32.051 27.029 -2.354 1.00 54.04 C ATOM 208 CG GLN A 267 30.966 27.270 -3.373 1.00 60.02 C ATOM 209 CD GLN A 267 30.506 25.985 -3.983 1.00 73.55 C ATOM 210 OE1 GLN A 267 31.304 25.165 -4.451 1.00 72.39 O ATOM 211 NE2 GLN A 267 29.208 25.786 -3.997 1.00 61.27 N ATOM 212 HE22 GLN A 267 28.568 26.500 -3.593 1.00 0.00 H ATOM 213 HE21 GLN A 267 28.820 24.915 -4.412 1.00 0.00 H ATOM 214 H GLN A 267 34.106 28.393 -3.086 1.00 0.00 H ATOM 215 N ARG A 268 32.040 27.568 0.660 1.00 58.87 N ATOM 216 CA ARG A 268 32.302 27.088 2.022 1.00 60.06 C ATOM 217 C ARG A 268 33.085 25.759 1.913 1.00 65.53 C ATOM 218 O ARG A 268 32.683 24.886 1.138 1.00 64.09 O ATOM 219 CB ARG A 268 30.975 26.901 2.795 1.00 58.38 C ATOM 220 CG ARG A 268 31.167 26.527 4.266 1.00 66.70 C ATOM 221 CD ARG A 268 29.882 26.653 5.066 1.00 72.85 C ATOM 222 NE ARG A 268 29.583 28.047 5.429 1.00 77.83 N ATOM 223 CZ ARG A 268 28.455 28.464 6.004 1.00 84.32 C ATOM 224 NH1 ARG A 268 27.486 27.600 6.290 1.00 68.09 N ATOM 225 NH2 ARG A 268 28.285 29.747 6.293 1.00 65.03 N ATOM 226 HE ARG A 268 30.308 28.763 5.221 1.00 0.00 H ATOM 227 HH12 ARG A 268 26.609 27.932 6.739 1.00 0.00 H ATOM 228 HH11 ARG A 268 27.605 26.592 6.065 1.00 0.00 H ATOM 229 HH22 ARG A 268 27.403 30.067 6.742 1.00 0.00 H ATOM 230 HH21 ARG A 268 29.034 30.434 6.071 1.00 0.00 H ATOM 231 H ARG A 268 31.047 27.662 0.364 1.00 0.00 H ATOM 232 N MET A 269 34.219 25.643 2.646 1.00 63.93 N ATOM 233 CA MET A 269 35.112 24.479 2.625 1.00 64.58 C ATOM 234 C MET A 269 34.398 23.165 3.006 1.00 63.69 C ATOM 235 O MET A 269 33.780 23.116 4.071 1.00 62.02 O ATOM 236 CB MET A 269 36.357 24.724 3.504 1.00 70.18 C ATOM 237 CG MET A 269 37.220 25.933 3.070 1.00 76.59 C ATOM 238 SD MET A 269 38.178 25.707 1.534 1.00 82.51 S ATOM 239 CE MET A 269 38.103 27.376 0.845 1.00 79.37 C ATOM 240 H MET A 269 34.475 26.436 3.268 1.00 0.00 H ATOM 241 N PRO A 270 34.459 22.109 2.139 1.00 58.20 N ATOM 242 CA PRO A 270 33.773 20.833 2.450 1.00 57.12 C ATOM 243 C PRO A 270 34.096 20.217 3.805 1.00 62.15 C ATOM 244 O PRO A 270 33.190 19.680 4.439 1.00 60.93 O ATOM 245 CB PRO A 270 34.206 19.895 1.315 1.00 58.56 C ATOM 246 CG PRO A 270 34.567 20.790 0.208 1.00 62.86 C ATOM 247 CD PRO A 270 35.132 22.038 0.825 1.00 59.38 C ATOM 248 N GLN A 271 35.374 20.295 4.247 1.00 61.42 N ATOM 249 CA GLN A 271 35.848 19.750 5.527 1.00 62.74 C ATOM 250 C GLN A 271 35.136 20.386 6.726 1.00 65.18 C ATOM 251 O GLN A 271 34.775 19.664 7.650 1.00 65.56 O ATOM 252 CB GLN A 271 37.371 19.880 5.654 1.00 66.33 C ATOM 253 CG GLN A 271 37.974 18.990 6.744 1.00 88.68 C ATOM 254 CD GLN A 271 39.483 18.916 6.692 1.00107.32 C ATOM 255 OE1 GLN A 271 40.180 19.900 6.405 1.00104.17 O ATOM 256 NE2 GLN A 271 40.021 17.742 6.997 1.00 97.40 N ATOM 257 HE22 GLN A 271 39.409 16.935 7.233 1.00 0.00 H ATOM 258 HE21 GLN A 271 41.055 17.629 7.000 1.00 0.00 H ATOM 259 H GLN A 271 36.068 20.774 3.638 1.00 0.00 H ATOM 260 N GLU A 272 34.902 21.720 6.684 1.00 59.39 N ATOM 261 CA GLU A 272 34.202 22.502 7.712 1.00 58.33 C ATOM 262 C GLU A 272 32.812 21.908 7.982 1.00 58.57 C ATOM 263 O GLU A 272 32.452 21.699 9.142 1.00 58.95 O ATOM 264 CB GLU A 272 34.096 23.973 7.251 1.00 59.39 C ATOM 265 CG GLU A 272 33.305 24.925 8.142 1.00 70.24 C ATOM 266 CD GLU A 272 33.131 26.330 7.591 1.00 93.20 C ATOM 267 OE1 GLU A 272 32.244 27.060 8.092 1.00 89.59 O ATOM 268 OE2 GLU A 272 33.884 26.706 6.664 1.00 89.76 O ATOM 269 H GLU A 272 35.249 22.236 5.850 1.00 0.00 H ATOM 270 N ILE A 273 32.069 21.601 6.895 1.00 50.92 N ATOM 271 CA ILE A 273 30.715 21.034 6.873 1.00 48.11 C ATOM 272 C ILE A 273 30.671 19.622 7.487 1.00 48.49 C ATOM 273 O ILE A 273 29.858 19.384 8.383 1.00 46.90 O ATOM 274 CB ILE A 273 30.161 21.088 5.409 1.00 49.66 C ATOM 275 CG1 ILE A 273 30.123 22.553 4.889 1.00 49.64 C ATOM 276 CG2 ILE A 273 28.800 20.381 5.275 1.00 48.46 C ATOM 277 CD1 ILE A 273 30.284 22.742 3.389 1.00 53.25 C ATOM 278 H ILE A 273 32.506 21.788 5.970 1.00 0.00 H ATOM 279 N THR A 274 31.532 18.695 6.995 1.00 44.10 N ATOM 280 CA THR A 274 31.610 17.308 7.458 1.00 43.75 C ATOM 281 C THR A 274 32.152 17.187 8.873 1.00 49.25 C ATOM 282 O THR A 274 31.672 16.328 9.610 1.00 49.47 O ATOM 283 CB THR A 274 32.378 16.419 6.487 1.00 51.46 C ATOM 284 OG1 THR A 274 33.639 17.017 6.170 1.00 59.23 O ATOM 285 CG2 THR A 274 31.599 16.132 5.235 1.00 45.73 C ATOM 286 HG1 THR A 274 33.488 17.902 5.753 1.00 0.00 H ATOM 287 H THR A 274 32.181 18.990 6.237 1.00 0.00 H ATOM 288 N ASN A 275 33.134 18.036 9.267 1.00 46.34 N ATOM 289 CA ASN A 275 33.691 18.022 10.624 1.00 48.27 C ATOM 290 C ASN A 275 32.595 18.299 11.646 1.00 51.68 C ATOM 291 O ASN A 275 32.552 17.618 12.670 1.00 53.30 O ATOM 292 CB ASN A 275 34.845 19.026 10.803 1.00 51.32 C ATOM 293 CG ASN A 275 36.186 18.619 10.220 1.00 75.52 C ATOM 294 OD1 ASN A 275 36.446 17.451 9.878 1.00 73.02 O ATOM 295 ND2 ASN A 275 37.080 19.590 10.096 1.00 64.57 N ATOM 296 HD22 ASN A 275 36.840 20.559 10.389 1.00 0.00 H ATOM 297 HD21 ASN A 275 38.022 19.383 9.706 1.00 0.00 H ATOM 298 H ASN A 275 33.506 18.723 8.581 1.00 0.00 H ATOM 299 N LYS A 276 31.687 19.254 11.343 1.00 45.21 N ATOM 300 CA LYS A 276 30.568 19.639 12.211 1.00 44.22 C ATOM 301 C LYS A 276 29.553 18.503 12.398 1.00 46.63 C ATOM 302 O LYS A 276 29.136 18.249 13.528 1.00 47.38 O ATOM 303 CB LYS A 276 29.872 20.904 11.689 1.00 44.82 C ATOM 304 CG LYS A 276 29.221 21.716 12.810 1.00 65.94 C ATOM 305 CD LYS A 276 27.853 22.267 12.408 1.00 74.48 C ATOM 306 CE LYS A 276 27.105 22.871 13.577 1.00 81.21 C ATOM 307 NZ LYS A 276 27.677 24.173 14.010 1.00 90.31 N ATOM 308 HZ1 LYS A 276 28.667 24.036 14.299 1.00 0.00 H ATOM 309 HZ2 LYS A 276 27.636 24.848 13.220 1.00 0.00 H ATOM 310 HZ3 LYS A 276 27.128 24.542 14.812 1.00 0.00 H ATOM 311 H LYS A 276 31.788 19.749 10.434 1.00 0.00 H ATOM 312 N ILE A 277 29.156 17.836 11.292 1.00 40.97 N ATOM 313 CA ILE A 277 28.201 16.723 11.303 1.00 40.06 C ATOM 314 C ILE A 277 28.796 15.507 12.053 1.00 45.58 C ATOM 315 O ILE A 277 28.101 14.909 12.877 1.00 46.60 O ATOM 316 CB ILE A 277 27.700 16.373 9.860 1.00 41.20 C ATOM 317 CG1 ILE A 277 27.031 17.598 9.179 1.00 39.13 C ATOM 318 CG2 ILE A 277 26.739 15.164 9.871 1.00 42.17 C ATOM 319 CD1 ILE A 277 26.867 17.512 7.600 1.00 34.86 C ATOM 320 H ILE A 277 29.552 18.130 10.376 1.00 0.00 H ATOM 321 N LEU A 278 30.078 15.173 11.779 1.00 42.12 N ATOM 322 CA LEU A 278 30.803 14.049 12.381 1.00 44.19 C ATOM 323 C LEU A 278 31.197 14.239 13.857 1.00 50.43 C ATOM 324 O LEU A 278 31.355 13.239 14.562 1.00 50.88 O ATOM 325 CB LEU A 278 32.064 13.699 11.563 1.00 44.59 C ATOM 326 CG LEU A 278 31.864 13.089 10.180 1.00 47.92 C ATOM 327 CD1 LEU A 278 33.172 13.074 9.413 1.00 48.06 C ATOM 328 CD2 LEU A 278 31.275 11.687 10.264 1.00 51.29 C ATOM 329 H LEU A 278 30.589 15.759 11.088 1.00 0.00 H ATOM 330 N LYS A 279 31.395 15.506 14.304 1.00 48.02 N ATOM 331 CA LYS A 279 31.829 15.863 15.664 1.00 50.07 C ATOM 332 C LYS A 279 30.876 15.352 16.737 1.00 55.81 C ATOM 333 O LYS A 279 31.288 14.599 17.624 1.00 58.08 O ATOM 334 CB LYS A 279 32.017 17.389 15.796 1.00 52.39 C ATOM 335 CG LYS A 279 32.851 17.833 17.004 1.00 71.16 C ATOM 336 CD LYS A 279 32.573 19.284 17.390 1.00 83.81 C ATOM 337 CE LYS A 279 33.750 20.205 17.144 1.00 96.80 C ATOM 338 NZ LYS A 279 33.548 21.560 17.742 1.00103.81 N ATOM 339 HZ1 LYS A 279 32.703 21.999 17.324 1.00 0.00 H ATOM 340 HZ2 LYS A 279 33.421 21.468 18.770 1.00 0.00 H ATOM 341 HZ3 LYS A 279 34.381 22.152 17.546 1.00 0.00 H ATOM 342 H LYS A 279 31.227 16.283 13.634 1.00 0.00 H ATOM 343 N GLU A 280 29.605 15.763 16.647 1.00 51.16 N ATOM 344 CA GLU A 280 28.567 15.394 17.600 1.00 51.65 C ATOM 345 C GLU A 280 27.214 15.252 16.927 1.00 54.23 C ATOM 346 O GLU A 280 26.947 15.923 15.924 1.00 53.13 O ATOM 347 CB GLU A 280 28.498 16.407 18.764 1.00 54.15 C ATOM 348 CG GLU A 280 28.372 17.874 18.365 1.00 63.59 C ATOM 349 CD GLU A 280 28.253 18.824 19.543 1.00 99.28 C ATOM 350 OE1 GLU A 280 27.130 19.315 19.801 1.00 96.60 O ATOM 351 OE2 GLU A 280 29.274 19.050 20.232 1.00106.54 O ATOM 352 H GLU A 280 29.344 16.381 15.852 1.00 0.00 H ATOM 353 N ALA A 281 26.360 14.376 17.476 1.00 50.90 N ATOM 354 CA ALA A 281 25.010 14.188 16.960 1.00 49.92 C ATOM 355 C ALA A 281 24.130 15.311 17.519 1.00 53.79 C ATOM 356 O ALA A 281 24.261 15.695 18.690 1.00 55.18 O ATOM 357 CB ALA A 281 24.470 12.829 17.374 1.00 51.92 C ATOM 358 H ALA A 281 26.670 13.814 18.294 1.00 0.00 H ATOM 359 N PHE A 282 23.281 15.872 16.662 1.00 47.67 N ATOM 360 CA PHE A 282 22.386 16.966 17.031 1.00 47.06 C ATOM 361 C PHE A 282 20.933 16.508 16.962 1.00 47.33 C ATOM 362 O PHE A 282 20.638 15.474 16.357 1.00 45.07 O ATOM 363 CB PHE A 282 22.592 18.167 16.079 1.00 47.65 C ATOM 364 CG PHE A 282 23.997 18.711 15.997 1.00 49.13 C ATOM 365 CD1 PHE A 282 24.497 19.546 16.992 1.00 53.62 C ATOM 366 CD2 PHE A 282 24.812 18.412 14.914 1.00 49.41 C ATOM 367 CE1 PHE A 282 25.794 20.062 16.907 1.00 54.67 C ATOM 368 CE2 PHE A 282 26.108 18.922 14.833 1.00 52.68 C ATOM 369 CZ PHE A 282 26.587 19.753 15.824 1.00 52.49 C ATOM 370 H PHE A 282 23.253 15.516 15.685 1.00 0.00 H ATOM 371 N SER A 283 20.023 17.291 17.563 1.00 42.71 N ATOM 372 CA SER A 283 18.598 17.004 17.500 1.00 42.30 C ATOM 373 C SER A 283 18.062 17.427 16.110 1.00 45.76 C ATOM 374 O SER A 283 18.694 18.229 15.413 1.00 44.19 O ATOM 375 CB SER A 283 17.866 17.760 18.602 1.00 45.55 C ATOM 376 OG SER A 283 18.022 19.162 18.460 1.00 51.01 O ATOM 377 HG SER A 283 18.984 19.392 18.506 1.00 0.00 H ATOM 378 H SER A 283 20.346 18.128 18.089 1.00 0.00 H ATOM 379 N ALA A 284 16.900 16.900 15.724 1.00 43.36 N ATOM 380 CA ALA A 284 16.220 17.234 14.473 1.00 41.94 C ATOM 381 C ALA A 284 15.978 18.757 14.330 1.00 44.61 C ATOM 382 O ALA A 284 16.067 19.292 13.220 1.00 41.93 O ATOM 383 CB ALA A 284 14.908 16.470 14.382 1.00 43.49 C ATOM 384 H ALA A 284 16.448 16.206 16.353 1.00 0.00 H ATOM 385 N GLU A 285 15.717 19.442 15.464 1.00 42.99 N ATOM 386 CA GLU A 285 15.499 20.898 15.544 1.00 42.98 C ATOM 387 C GLU A 285 16.830 21.633 15.291 1.00 45.37 C ATOM 388 O GLU A 285 16.860 22.632 14.566 1.00 43.28 O ATOM 389 CB GLU A 285 14.900 21.305 16.917 1.00 46.38 C ATOM 390 CG GLU A 285 13.630 20.557 17.324 1.00 63.29 C ATOM 391 CD GLU A 285 12.289 21.171 16.948 1.00 98.41 C ATOM 392 OE1 GLU A 285 12.268 22.324 16.456 1.00109.86 O ATOM 393 OE2 GLU A 285 11.251 20.507 17.180 1.00 88.53 O ATOM 394 H GLU A 285 15.666 18.900 16.350 1.00 0.00 H ATOM 395 N GLU A 286 17.928 21.122 15.891 1.00 42.21 N ATOM 396 CA GLU A 286 19.273 21.670 15.722 1.00 41.33 C ATOM 397 C GLU A 286 19.743 21.516 14.269 1.00 41.57 C ATOM 398 O GLU A 286 20.310 22.455 13.718 1.00 38.90 O ATOM 399 CB GLU A 286 20.267 21.005 16.681 1.00 43.78 C ATOM 400 CG GLU A 286 20.254 21.575 18.089 1.00 54.98 C ATOM 401 CD GLU A 286 21.035 20.781 19.122 1.00 73.64 C ATOM 402 OE1 GLU A 286 21.056 19.530 19.029 1.00 53.74 O ATOM 403 OE2 GLU A 286 21.593 21.411 20.053 1.00 68.32 O ATOM 404 H GLU A 286 17.810 20.293 16.507 1.00 0.00 H ATOM 405 N ASN A 287 19.478 20.344 13.657 1.00 37.57 N ATOM 406 CA ASN A 287 19.837 20.034 12.276 1.00 35.65 C ATOM 407 C ASN A 287 19.034 20.850 11.263 1.00 38.93 C ATOM 408 O ASN A 287 19.583 21.240 10.230 1.00 37.42 O ATOM 409 CB ASN A 287 19.714 18.535 12.002 1.00 33.86 C ATOM 410 CG ASN A 287 20.894 17.718 12.489 1.00 45.20 C ATOM 411 OD1 ASN A 287 22.061 18.124 12.395 1.00 39.94 O ATOM 412 ND2 ASN A 287 20.621 16.523 12.990 1.00 30.48 N ATOM 413 HD22 ASN A 287 19.634 16.201 13.060 1.00 0.00 H ATOM 414 HD21 ASN A 287 21.393 15.906 13.313 1.00 0.00 H ATOM 415 H ASN A 287 18.985 19.611 14.206 1.00 0.00 H ATOM 416 N PHE A 288 17.747 21.126 11.562 1.00 36.86 N ATOM 417 CA PHE A 288 16.884 21.932 10.693 1.00 35.78 C ATOM 418 C PHE A 288 17.424 23.364 10.607 1.00 39.63 C ATOM 419 O PHE A 288 17.419 23.959 9.533 1.00 38.35 O ATOM 420 CB PHE A 288 15.424 21.907 11.180 1.00 38.79 C ATOM 421 CG PHE A 288 14.472 22.656 10.281 1.00 40.07 C ATOM 422 CD1 PHE A 288 14.020 22.092 9.096 1.00 41.99 C ATOM 423 CD2 PHE A 288 14.046 23.935 10.607 1.00 42.66 C ATOM 424 CE1 PHE A 288 13.162 22.797 8.249 1.00 42.39 C ATOM 425 CE2 PHE A 288 13.195 24.642 9.754 1.00 45.00 C ATOM 426 CZ PHE A 288 12.747 24.063 8.590 1.00 41.73 C ATOM 427 H PHE A 288 17.350 20.751 12.447 1.00 0.00 H ATOM 428 N LEU A 289 17.922 23.885 11.733 1.00 37.59 N ATOM 429 CA LEU A 289 18.512 25.207 11.848 1.00 37.24 C ATOM 430 C LEU A 289 19.865 25.261 11.126 1.00 39.22 C ATOM 431 O LEU A 289 20.128 26.243 10.428 1.00 39.66 O ATOM 432 CB LEU A 289 18.644 25.605 13.323 1.00 38.99 C ATOM 433 CG LEU A 289 18.643 27.105 13.599 1.00 45.30 C ATOM 434 CD1 LEU A 289 17.267 27.711 13.329 1.00 46.24 C ATOM 435 CD2 LEU A 289 19.072 27.384 15.032 1.00 50.66 C ATOM 436 H LEU A 289 17.884 23.299 12.592 1.00 0.00 H ATOM 437 N ILE A 290 20.701 24.199 11.266 1.00 32.74 N ATOM 438 CA ILE A 290 21.983 24.072 10.564 1.00 30.90 C ATOM 439 C ILE A 290 21.678 24.111 9.040 1.00 34.08 C ATOM 440 O ILE A 290 22.308 24.880 8.317 1.00 32.89 O ATOM 441 CB ILE A 290 22.766 22.776 10.997 1.00 33.01 C ATOM 442 CG1 ILE A 290 23.292 22.903 12.446 1.00 34.17 C ATOM 443 CG2 ILE A 290 23.925 22.443 10.029 1.00 30.67 C ATOM 444 CD1 ILE A 290 23.549 21.585 13.165 1.00 37.08 C ATOM 445 H ILE A 290 20.416 23.432 11.908 1.00 0.00 H ATOM 446 N LEU A 291 20.670 23.333 8.590 1.00 31.01 N ATOM 447 CA LEU A 291 20.244 23.269 7.191 1.00 30.77 C ATOM 448 C LEU A 291 19.844 24.655 6.674 1.00 35.41 C ATOM 449 O LEU A 291 20.318 25.079 5.624 1.00 35.73 O ATOM 450 CB LEU A 291 19.076 22.258 7.012 1.00 30.77 C ATOM 451 CG LEU A 291 18.365 22.230 5.629 1.00 34.46 C ATOM 452 CD1 LEU A 291 19.280 21.746 4.512 1.00 32.89 C ATOM 453 CD2 LEU A 291 17.125 21.393 5.683 1.00 38.43 C ATOM 454 H LEU A 291 20.165 22.742 9.281 1.00 0.00 H ATOM 455 N THR A 292 18.992 25.349 7.431 1.00 32.22 N ATOM 456 CA THR A 292 18.454 26.665 7.118 1.00 32.77 C ATOM 457 C THR A 292 19.597 27.705 6.941 1.00 37.39 C ATOM 458 O THR A 292 19.553 28.479 5.989 1.00 36.88 O ATOM 459 CB THR A 292 17.359 26.999 8.157 1.00 42.30 C ATOM 460 OG1 THR A 292 16.106 27.123 7.486 1.00 48.30 O ATOM 461 CG2 THR A 292 17.661 28.203 9.030 1.00 38.75 C ATOM 462 HG1 THR A 292 15.399 27.337 8.146 1.00 0.00 H ATOM 463 H THR A 292 18.685 24.911 8.323 1.00 0.00 H ATOM 464 N GLU A 293 20.633 27.667 7.802 1.00 34.94 N ATOM 465 CA GLU A 293 21.780 28.574 7.738 1.00 34.56 C ATOM 466 C GLU A 293 22.687 28.230 6.554 1.00 36.94 C ATOM 467 O GLU A 293 23.111 29.135 5.840 1.00 37.88 O ATOM 468 CB GLU A 293 22.544 28.559 9.082 1.00 36.90 C ATOM 469 CG GLU A 293 23.720 29.530 9.181 1.00 52.16 C ATOM 470 CD GLU A 293 25.078 29.052 8.678 1.00 79.23 C ATOM 471 OE1 GLU A 293 25.475 27.908 9.002 1.00 70.04 O ATOM 472 OE2 GLU A 293 25.763 29.843 7.989 1.00 72.57 O ATOM 473 H GLU A 293 20.617 26.951 8.556 1.00 0.00 H ATOM 474 N MET A 294 22.988 26.933 6.358 1.00 31.69 N ATOM 475 CA MET A 294 23.833 26.431 5.272 1.00 30.64 C ATOM 476 C MET A 294 23.224 26.771 3.911 1.00 32.79 C ATOM 477 O MET A 294 23.937 27.225 3.020 1.00 31.62 O ATOM 478 CB MET A 294 24.007 24.897 5.385 1.00 33.22 C ATOM 479 CG MET A 294 24.890 24.452 6.528 1.00 38.93 C ATOM 480 SD MET A 294 26.631 24.562 6.138 1.00 45.67 S ATOM 481 CE MET A 294 26.747 23.406 4.880 1.00 41.26 C ATOM 482 H MET A 294 22.593 26.239 7.024 1.00 0.00 H ATOM 483 N ALA A 295 21.905 26.510 3.743 1.00 29.17 N ATOM 484 CA ALA A 295 21.174 26.757 2.500 1.00 28.20 C ATOM 485 C ALA A 295 21.057 28.247 2.160 1.00 31.71 C ATOM 486 O ALA A 295 21.116 28.591 0.980 1.00 30.60 O ATOM 487 CB ALA A 295 19.806 26.121 2.555 1.00 28.54 C ATOM 488 H ALA A 295 21.380 26.110 4.547 1.00 0.00 H ATOM 489 N THR A 296 20.908 29.121 3.180 1.00 29.35 N ATOM 490 CA THR A 296 20.830 30.579 2.994 1.00 30.09 C ATOM 491 C THR A 296 22.183 31.085 2.471 1.00 34.56 C ATOM 492 O THR A 296 22.209 31.796 1.459 1.00 35.04 O ATOM 493 CB THR A 296 20.362 31.284 4.278 1.00 36.98 C ATOM 494 OG1 THR A 296 19.081 30.757 4.629 1.00 33.17 O ATOM 495 CG2 THR A 296 20.252 32.803 4.113 1.00 35.26 C ATOM 496 HG1 THR A 296 19.157 29.782 4.782 1.00 0.00 H ATOM 497 H THR A 296 20.845 28.744 4.147 1.00 0.00 H ATOM 498 N ASN A 297 23.296 30.670 3.124 1.00 30.30 N ATOM 499 CA ASN A 297 24.650 31.020 2.693 1.00 30.18 C ATOM 500 C ASN A 297 24.924 30.513 1.283 1.00 34.62 C ATOM 501 O ASN A 297 25.466 31.267 0.483 1.00 35.32 O ATOM 502 CB ASN A 297 25.719 30.508 3.672 1.00 31.89 C ATOM 503 CG ASN A 297 27.142 30.793 3.212 1.00 49.03 C ATOM 504 OD1 ASN A 297 27.910 29.869 2.878 1.00 29.73 O ATOM 505 ND2 ASN A 297 27.490 32.089 3.107 1.00 41.83 N ATOM 506 HD22 ASN A 297 26.822 32.832 3.396 1.00 0.00 H ATOM 507 HD21 ASN A 297 28.427 32.348 2.737 1.00 0.00 H ATOM 508 H ASN A 297 23.183 30.076 3.970 1.00 0.00 H ATOM 509 N HIS A 298 24.534 29.252 0.970 1.00 30.64 N ATOM 510 CA HIS A 298 24.697 28.641 -0.349 1.00 28.81 C ATOM 511 C HIS A 298 24.047 29.488 -1.467 1.00 33.81 C ATOM 512 O HIS A 298 24.666 29.672 -2.517 1.00 34.63 O ATOM 513 CB HIS A 298 24.220 27.176 -0.357 1.00 28.77 C ATOM 514 CG HIS A 298 23.995 26.632 -1.736 1.00 32.29 C ATOM 515 ND1 HIS A 298 22.748 26.780 -2.337 1.00 35.08 N ATOM 516 CD2 HIS A 298 24.843 26.080 -2.634 1.00 33.13 C ATOM 517 CE1 HIS A 298 22.872 26.293 -3.555 1.00 33.79 C ATOM 518 NE2 HIS A 298 24.118 25.880 -3.792 1.00 33.05 N ATOM 519 H HIS A 298 24.090 28.682 1.718 1.00 0.00 H ATOM 520 N VAL A 299 22.815 29.990 -1.246 1.00 29.92 N ATOM 521 CA VAL A 299 22.096 30.827 -2.213 1.00 30.56 C ATOM 522 C VAL A 299 22.935 32.087 -2.495 1.00 35.09 C ATOM 523 O VAL A 299 23.186 32.414 -3.659 1.00 35.30 O ATOM 524 CB VAL A 299 20.645 31.167 -1.747 1.00 35.53 C ATOM 525 CG1 VAL A 299 20.025 32.269 -2.596 1.00 36.59 C ATOM 526 CG2 VAL A 299 19.758 29.937 -1.765 1.00 34.85 C ATOM 527 H VAL A 299 22.350 29.772 -0.342 1.00 0.00 H ATOM 528 N GLN A 300 23.426 32.737 -1.426 1.00 31.13 N ATOM 529 CA GLN A 300 24.269 33.915 -1.528 1.00 31.94 C ATOM 530 C GLN A 300 25.505 33.630 -2.385 1.00 33.96 C ATOM 531 O GLN A 300 25.767 34.374 -3.318 1.00 34.70 O ATOM 532 CB GLN A 300 24.672 34.409 -0.136 1.00 34.72 C ATOM 533 CG GLN A 300 23.499 34.874 0.723 1.00 44.00 C ATOM 534 CD GLN A 300 23.905 35.245 2.130 1.00 62.36 C ATOM 535 OE1 GLN A 300 25.054 35.053 2.570 1.00 63.43 O ATOM 536 NE2 GLN A 300 22.960 35.804 2.863 1.00 45.87 N ATOM 537 HE22 GLN A 300 22.011 35.950 2.464 1.00 0.00 H ATOM 538 HE21 GLN A 300 23.165 36.099 3.839 1.00 0.00 H ATOM 539 H GLN A 300 23.190 32.378 -0.479 1.00 0.00 H ATOM 540 N VAL A 301 26.215 32.527 -2.107 1.00 29.78 N ATOM 541 CA VAL A 301 27.414 32.107 -2.849 1.00 29.68 C ATOM 542 C VAL A 301 27.060 31.784 -4.314 1.00 34.43 C ATOM 543 O VAL A 301 27.784 32.192 -5.227 1.00 35.96 O ATOM 544 CB VAL A 301 28.195 30.963 -2.125 1.00 31.67 C ATOM 545 CG1 VAL A 301 29.481 30.603 -2.860 1.00 31.09 C ATOM 546 CG2 VAL A 301 28.528 31.364 -0.694 1.00 32.04 C ATOM 547 H VAL A 301 25.898 31.930 -1.316 1.00 0.00 H ATOM 548 N LEU A 302 25.922 31.107 -4.528 1.00 30.28 N ATOM 549 CA LEU A 302 25.431 30.732 -5.848 1.00 29.26 C ATOM 550 C LEU A 302 25.112 31.956 -6.714 1.00 31.38 C ATOM 551 O LEU A 302 25.427 31.929 -7.896 1.00 28.21 O ATOM 552 CB LEU A 302 24.224 29.805 -5.719 1.00 28.97 C ATOM 553 CG LEU A 302 23.774 29.090 -6.996 1.00 34.35 C ATOM 554 CD1 LEU A 302 24.777 28.003 -7.409 1.00 35.38 C ATOM 555 CD2 LEU A 302 22.421 28.491 -6.801 1.00 34.05 C ATOM 556 H LEU A 302 25.355 30.833 -3.701 1.00 0.00 H ATOM 557 N VAL A 303 24.523 33.030 -6.122 1.00 29.02 N ATOM 558 CA VAL A 303 24.227 34.278 -6.839 1.00 29.92 C ATOM 559 C VAL A 303 25.543 34.922 -7.306 1.00 35.90 C ATOM 560 O VAL A 303 25.639 35.332 -8.460 1.00 35.92 O ATOM 561 CB VAL A 303 23.323 35.265 -6.024 1.00 33.75 C ATOM 562 CG1 VAL A 303 23.126 36.587 -6.759 1.00 33.59 C ATOM 563 CG2 VAL A 303 21.959 34.634 -5.703 1.00 32.79 C ATOM 564 H VAL A 303 24.271 32.965 -5.115 1.00 0.00 H ATOM 565 N GLU A 304 26.570 34.946 -6.429 1.00 32.87 N ATOM 566 CA GLU A 304 27.891 35.494 -6.740 1.00 32.84 C ATOM 567 C GLU A 304 28.596 34.691 -7.824 1.00 35.04 C ATOM 568 O GLU A 304 29.197 35.287 -8.716 1.00 35.18 O ATOM 569 CB GLU A 304 28.776 35.606 -5.486 1.00 34.64 C ATOM 570 CG GLU A 304 28.328 36.686 -4.516 1.00 47.50 C ATOM 571 CD GLU A 304 28.015 38.041 -5.130 1.00 67.82 C ATOM 572 OE1 GLU A 304 26.817 38.412 -5.175 1.00 59.10 O ATOM 573 OE2 GLU A 304 28.961 38.709 -5.607 1.00 55.45 O ATOM 574 H GLU A 304 26.413 34.553 -5.479 1.00 0.00 H ATOM 575 N PHE A 305 28.517 33.349 -7.753 1.00 29.36 N ATOM 576 CA PHE A 305 29.097 32.434 -8.748 1.00 28.50 C ATOM 577 C PHE A 305 28.454 32.664 -10.133 1.00 35.67 C ATOM 578 O PHE A 305 29.161 32.726 -11.141 1.00 38.63 O ATOM 579 CB PHE A 305 28.917 30.966 -8.296 1.00 27.79 C ATOM 580 CG PHE A 305 29.390 29.918 -9.287 1.00 28.58 C ATOM 581 CD1 PHE A 305 30.746 29.664 -9.468 1.00 32.12 C ATOM 582 CD2 PHE A 305 28.478 29.152 -10.010 1.00 29.23 C ATOM 583 CE1 PHE A 305 31.183 28.705 -10.404 1.00 32.40 C ATOM 584 CE2 PHE A 305 28.918 28.167 -10.912 1.00 31.81 C ATOM 585 CZ PHE A 305 30.267 27.955 -11.105 1.00 30.04 C ATOM 586 H PHE A 305 28.014 32.933 -6.943 1.00 0.00 H ATOM 587 N THR A 306 27.119 32.795 -10.158 1.00 31.89 N ATOM 588 CA THR A 306 26.287 32.995 -11.343 1.00 32.36 C ATOM 589 C THR A 306 26.606 34.314 -12.043 1.00 38.09 C ATOM 590 O THR A 306 26.837 34.316 -13.251 1.00 37.69 O ATOM 591 CB THR A 306 24.818 32.842 -10.959 1.00 35.31 C ATOM 592 OG1 THR A 306 24.629 31.540 -10.423 1.00 28.81 O ATOM 593 CG2 THR A 306 23.895 33.032 -12.117 1.00 32.67 C ATOM 594 HG1 THR A 306 25.202 31.427 -9.624 1.00 0.00 H ATOM 595 H THR A 306 26.627 32.750 -9.243 1.00 0.00 H ATOM 596 N LYS A 307 26.638 35.422 -11.280 1.00 36.19 N ATOM 597 CA LYS A 307 26.992 36.765 -11.767 1.00 37.43 C ATOM 598 C LYS A 307 28.332 36.780 -12.524 1.00 42.20 C ATOM 599 O LYS A 307 28.496 37.571 -13.448 1.00 43.55 O ATOM 600 CB LYS A 307 27.065 37.752 -10.600 1.00 39.23 C ATOM 601 CG LYS A 307 25.705 38.248 -10.118 1.00 37.39 C ATOM 602 CD LYS A 307 25.784 38.901 -8.746 1.00 41.05 C ATOM 603 CE LYS A 307 26.269 40.329 -8.788 1.00 54.69 C ATOM 604 NZ LYS A 307 26.345 40.926 -7.428 1.00 62.70 N ATOM 605 HZ1 LYS A 307 25.401 40.914 -6.992 1.00 0.00 H ATOM 606 HZ2 LYS A 307 27.005 40.373 -6.844 1.00 0.00 H ATOM 607 HZ3 LYS A 307 26.682 41.907 -7.500 1.00 0.00 H ATOM 608 H LYS A 307 26.395 35.322 -10.274 1.00 0.00 H ATOM 609 N LYS A 308 29.274 35.904 -12.136 1.00 37.76 N ATOM 610 CA LYS A 308 30.587 35.791 -12.762 1.00 38.49 C ATOM 611 C LYS A 308 30.576 34.900 -14.007 1.00 43.34 C ATOM 612 O LYS A 308 31.568 34.881 -14.730 1.00 44.75 O ATOM 613 CB LYS A 308 31.648 35.330 -11.745 1.00 41.06 C ATOM 614 CG LYS A 308 32.068 36.412 -10.758 1.00 51.98 C ATOM 615 CD LYS A 308 33.017 35.856 -9.716 1.00 65.09 C ATOM 616 CE LYS A 308 32.685 36.369 -8.333 1.00 79.13 C ATOM 617 NZ LYS A 308 33.403 35.605 -7.274 1.00 87.87 N ATOM 618 HZ1 LYS A 308 33.130 34.603 -7.326 1.00 0.00 H ATOM 619 HZ2 LYS A 308 34.429 35.694 -7.419 1.00 0.00 H ATOM 620 HZ3 LYS A 308 33.149 35.987 -6.340 1.00 0.00 H ATOM 621 H LYS A 308 29.054 35.269 -11.342 1.00 0.00 H ATOM 622 N LEU A 309 29.468 34.175 -14.277 1.00 38.28 N ATOM 623 CA LEU A 309 29.398 33.318 -15.457 1.00 36.83 C ATOM 624 C LEU A 309 29.409 34.161 -16.722 1.00 43.11 C ATOM 625 O LEU A 309 28.640 35.120 -16.815 1.00 44.47 O ATOM 626 CB LEU A 309 28.203 32.345 -15.428 1.00 34.86 C ATOM 627 CG LEU A 309 28.211 31.267 -14.322 1.00 36.18 C ATOM 628 CD1 LEU A 309 26.921 30.448 -14.334 1.00 34.29 C ATOM 629 CD2 LEU A 309 29.399 30.352 -14.455 1.00 34.68 C ATOM 630 H LEU A 309 28.652 34.228 -13.634 1.00 0.00 H ATOM 631 N PRO A 310 30.330 33.869 -17.671 1.00 39.79 N ATOM 632 CA PRO A 310 30.428 34.699 -18.894 1.00 40.76 C ATOM 633 C PRO A 310 29.112 34.898 -19.643 1.00 43.66 C ATOM 634 O PRO A 310 28.396 33.934 -19.960 1.00 43.27 O ATOM 635 CB PRO A 310 31.487 33.972 -19.733 1.00 42.71 C ATOM 636 CG PRO A 310 32.326 33.261 -18.713 1.00 46.51 C ATOM 637 CD PRO A 310 31.345 32.794 -17.674 1.00 40.69 C ATOM 638 N GLY A 311 28.778 36.167 -19.837 1.00 39.45 N ATOM 639 CA GLY A 311 27.571 36.605 -20.523 1.00 39.21 C ATOM 640 C GLY A 311 26.311 36.711 -19.685 1.00 42.40 C ATOM 641 O GLY A 311 25.333 37.294 -20.152 1.00 44.55 O ATOM 642 H GLY A 311 29.422 36.899 -19.474 1.00 0.00 H ATOM 643 N PHE A 312 26.297 36.144 -18.455 1.00 35.10 N ATOM 644 CA PHE A 312 25.111 36.157 -17.589 1.00 33.94 C ATOM 645 C PHE A 312 24.484 37.544 -17.357 1.00 40.86 C ATOM 646 O PHE A 312 23.259 37.655 -17.369 1.00 41.27 O ATOM 647 CB PHE A 312 25.374 35.471 -16.232 1.00 33.72 C ATOM 648 CG PHE A 312 24.115 35.271 -15.412 1.00 34.05 C ATOM 649 CD1 PHE A 312 23.249 34.211 -15.677 1.00 34.73 C ATOM 650 CD2 PHE A 312 23.776 36.164 -14.402 1.00 35.75 C ATOM 651 CE1 PHE A 312 22.078 34.042 -14.937 1.00 34.55 C ATOM 652 CE2 PHE A 312 22.591 36.005 -13.675 1.00 37.76 C ATOM 653 CZ PHE A 312 21.751 34.944 -13.946 1.00 34.61 C ATOM 654 H PHE A 312 27.162 35.680 -18.110 1.00 0.00 H ATOM 655 N GLN A 313 25.303 38.581 -17.142 1.00 39.34 N ATOM 656 CA GLN A 313 24.816 39.921 -16.836 1.00 40.81 C ATOM 657 C GLN A 313 24.293 40.686 -18.060 1.00 46.52 C ATOM 658 O GLN A 313 23.656 41.732 -17.894 1.00 46.79 O ATOM 659 CB GLN A 313 25.865 40.714 -16.049 1.00 43.27 C ATOM 660 CG GLN A 313 25.956 40.185 -14.609 1.00 58.49 C ATOM 661 CD GLN A 313 26.843 40.959 -13.689 1.00 77.57 C ATOM 662 OE1 GLN A 313 26.397 41.537 -12.694 1.00 72.44 O ATOM 663 NE2 GLN A 313 28.141 40.832 -13.877 1.00 71.22 N ATOM 664 HE22 GLN A 313 28.499 40.342 -14.722 1.00 0.00 H ATOM 665 HE21 GLN A 313 28.808 41.222 -13.181 1.00 0.00 H ATOM 666 H GLN A 313 26.330 38.424 -17.195 1.00 0.00 H ATOM 667 N THR A 314 24.488 40.129 -19.281 1.00 44.12 N ATOM 668 CA THR A 314 23.988 40.700 -20.537 1.00 45.53 C ATOM 669 C THR A 314 22.553 40.197 -20.838 1.00 49.40 C ATOM 670 O THR A 314 21.866 40.775 -21.684 1.00 50.80 O ATOM 671 CB THR A 314 24.955 40.433 -21.701 1.00 53.66 C ATOM 672 OG1 THR A 314 24.887 39.054 -22.087 1.00 56.80 O ATOM 673 CG2 THR A 314 26.395 40.883 -21.404 1.00 49.11 C ATOM 674 HG1 THR A 314 25.137 38.484 -21.317 1.00 0.00 H ATOM 675 H THR A 314 25.026 39.240 -19.330 1.00 0.00 H ATOM 676 N LEU A 315 22.115 39.125 -20.146 1.00 43.52 N ATOM 677 CA LEU A 315 20.784 38.533 -20.283 1.00 42.81 C ATOM 678 C LEU A 315 19.715 39.434 -19.665 1.00 49.22 C ATOM 679 O LEU A 315 20.005 40.184 -18.733 1.00 49.09 O ATOM 680 CB LEU A 315 20.707 37.156 -19.572 1.00 40.30 C ATOM 681 CG LEU A 315 21.665 36.030 -20.000 1.00 42.34 C ATOM 682 CD1 LEU A 315 21.553 34.885 -19.068 1.00 39.36 C ATOM 683 CD2 LEU A 315 21.364 35.523 -21.412 1.00 44.12 C ATOM 684 H LEU A 315 22.770 38.688 -19.467 1.00 0.00 H ATOM 685 N ASP A 316 18.465 39.315 -20.164 1.00 47.70 N ATOM 686 CA ASP A 316 17.279 40.016 -19.665 1.00 48.49 C ATOM 687 C ASP A 316 17.138 39.711 -18.164 1.00 51.99 C ATOM 688 O ASP A 316 17.272 38.547 -17.763 1.00 49.03 O ATOM 689 CB ASP A 316 16.031 39.582 -20.468 1.00 50.74 C ATOM 690 CG ASP A 316 14.692 39.911 -19.830 1.00 60.37 C ATOM 691 OD1 ASP A 316 14.203 41.049 -20.017 1.00 62.06 O ATOM 692 OD2 ASP A 316 14.148 39.043 -19.115 1.00 67.18 O ATOM 693 H ASP A 316 18.334 38.672 -20.970 1.00 0.00 H ATOM 694 N HIS A 317 16.933 40.767 -17.342 1.00 51.22 N ATOM 695 CA HIS A 317 16.824 40.698 -15.877 1.00 51.04 C ATOM 696 C HIS A 317 15.840 39.659 -15.351 1.00 50.48 C ATOM 697 O HIS A 317 16.116 39.029 -14.326 1.00 47.25 O ATOM 698 CB HIS A 317 16.506 42.071 -15.267 1.00 55.34 C ATOM 699 CG HIS A 317 17.675 43.005 -15.204 1.00 61.38 C ATOM 700 ND1 HIS A 317 18.833 42.781 -15.942 1.00 63.61 N ATOM 701 CD2 HIS A 317 17.811 44.171 -14.528 1.00 66.44 C ATOM 702 CE1 HIS A 317 19.633 43.803 -15.682 1.00 64.93 C ATOM 703 NE2 HIS A 317 19.061 44.671 -14.841 1.00 66.85 N ATOM 704 H HIS A 317 16.845 41.705 -17.783 1.00 0.00 H ATOM 705 N GLU A 318 14.688 39.502 -16.022 1.00 46.93 N ATOM 706 CA GLU A 318 13.675 38.537 -15.601 1.00 45.45 C ATOM 707 C GLU A 318 14.119 37.104 -15.869 1.00 47.17 C ATOM 708 O GLU A 318 13.772 36.209 -15.096 1.00 47.03 O ATOM 709 CB GLU A 318 12.304 38.853 -16.224 1.00 48.50 C ATOM 710 CG GLU A 318 11.650 40.114 -15.670 1.00 58.03 C ATOM 711 CD GLU A 318 11.658 40.268 -14.159 1.00 79.72 C ATOM 712 OE1 GLU A 318 11.169 39.348 -13.462 1.00 74.84 O ATOM 713 OE2 GLU A 318 12.210 41.282 -13.673 1.00 72.83 O ATOM 714 H GLU A 318 14.512 40.084 -16.866 1.00 0.00 H ATOM 715 N ASP A 319 14.898 36.891 -16.960 1.00 41.61 N ATOM 716 CA ASP A 319 15.454 35.588 -17.311 1.00 39.65 C ATOM 717 C ASP A 319 16.550 35.220 -16.305 1.00 41.29 C ATOM 718 O ASP A 319 16.681 34.047 -15.945 1.00 39.25 O ATOM 719 CB ASP A 319 16.000 35.577 -18.751 1.00 41.82 C ATOM 720 CG ASP A 319 14.955 35.452 -19.849 1.00 47.47 C ATOM 721 OD1 ASP A 319 13.788 35.134 -19.531 1.00 48.07 O ATOM 722 OD2 ASP A 319 15.315 35.628 -21.028 1.00 49.20 O ATOM 723 H ASP A 319 15.110 37.699 -17.579 1.00 0.00 H ATOM 724 N GLN A 320 17.301 36.237 -15.827 1.00 37.14 N ATOM 725 CA GLN A 320 18.330 36.098 -14.796 1.00 35.15 C ATOM 726 C GLN A 320 17.708 35.532 -13.505 1.00 39.49 C ATOM 727 O GLN A 320 18.231 34.563 -12.961 1.00 39.24 O ATOM 728 CB GLN A 320 18.997 37.449 -14.523 1.00 36.81 C ATOM 729 CG GLN A 320 20.037 37.860 -15.566 1.00 42.71 C ATOM 730 CD GLN A 320 20.731 39.168 -15.223 1.00 57.71 C ATOM 731 OE1 GLN A 320 20.674 39.670 -14.099 1.00 54.62 O ATOM 732 NE2 GLN A 320 21.406 39.758 -16.189 1.00 50.46 N ATOM 733 HE22 GLN A 320 21.447 39.325 -17.134 1.00 0.00 H ATOM 734 HE21 GLN A 320 21.897 40.656 -16.006 1.00 0.00 H ATOM 735 H GLN A 320 17.136 37.186 -16.220 1.00 0.00 H ATOM 736 N ILE A 321 16.560 36.094 -13.058 1.00 37.33 N ATOM 737 CA ILE A 321 15.826 35.641 -11.863 1.00 36.80 C ATOM 738 C ILE A 321 15.288 34.211 -12.083 1.00 38.97 C ATOM 739 O ILE A 321 15.394 33.364 -11.186 1.00 36.44 O ATOM 740 CB ILE A 321 14.705 36.666 -11.461 1.00 41.87 C ATOM 741 CG1 ILE A 321 15.322 37.930 -10.815 1.00 43.74 C ATOM 742 CG2 ILE A 321 13.634 36.045 -10.524 1.00 41.64 C ATOM 743 CD1 ILE A 321 14.535 39.246 -11.043 1.00 49.32 C ATOM 744 H ILE A 321 16.171 36.897 -13.592 1.00 0.00 H ATOM 745 N ALA A 322 14.726 33.955 -13.290 1.00 36.49 N ATOM 746 CA ALA A 322 14.167 32.660 -13.670 1.00 36.30 C ATOM 747 C ALA A 322 15.217 31.545 -13.673 1.00 39.04 C ATOM 748 O ALA A 322 14.923 30.442 -13.210 1.00 37.43 O ATOM 749 CB ALA A 322 13.477 32.763 -15.017 1.00 38.68 C ATOM 750 H ALA A 322 14.691 34.726 -13.987 1.00 0.00 H ATOM 751 N LEU A 323 16.462 31.852 -14.115 1.00 36.13 N ATOM 752 CA LEU A 323 17.572 30.890 -14.102 1.00 34.13 C ATOM 753 C LEU A 323 18.013 30.528 -12.683 1.00 37.83 C ATOM 754 O LEU A 323 18.298 29.353 -12.407 1.00 35.95 O ATOM 755 CB LEU A 323 18.768 31.390 -14.930 1.00 33.45 C ATOM 756 CG LEU A 323 18.584 31.420 -16.451 1.00 36.83 C ATOM 757 CD1 LEU A 323 19.687 32.199 -17.110 1.00 36.24 C ATOM 758 CD2 LEU A 323 18.477 30.034 -17.040 1.00 36.59 C ATOM 759 H LEU A 323 16.638 32.810 -14.479 1.00 0.00 H ATOM 760 N LEU A 324 18.066 31.538 -11.793 1.00 36.19 N ATOM 761 CA LEU A 324 18.454 31.390 -10.385 1.00 35.88 C ATOM 762 C LEU A 324 17.446 30.595 -9.597 1.00 36.94 C ATOM 763 O LEU A 324 17.834 29.654 -8.895 1.00 35.07 O ATOM 764 CB LEU A 324 18.673 32.763 -9.725 1.00 37.94 C ATOM 765 CG LEU A 324 20.044 33.407 -9.938 1.00 44.48 C ATOM 766 CD1 LEU A 324 20.091 34.728 -9.258 1.00 46.93 C ATOM 767 CD2 LEU A 324 21.180 32.534 -9.364 1.00 45.12 C ATOM 768 H LEU A 324 17.814 32.490 -12.127 1.00 0.00 H ATOM 769 N LYS A 325 16.147 30.955 -9.728 1.00 34.95 N ATOM 770 CA LYS A 325 15.051 30.253 -9.064 1.00 35.55 C ATOM 771 C LYS A 325 14.988 28.790 -9.526 1.00 38.38 C ATOM 772 O LYS A 325 14.799 27.894 -8.700 1.00 37.90 O ATOM 773 CB LYS A 325 13.719 30.951 -9.366 1.00 40.63 C ATOM 774 CG LYS A 325 13.304 31.959 -8.318 1.00 63.95 C ATOM 775 CD LYS A 325 11.808 32.192 -8.401 1.00 76.81 C ATOM 776 CE LYS A 325 10.998 31.483 -7.321 1.00 82.79 C ATOM 777 NZ LYS A 325 11.082 30.003 -7.391 1.00 86.89 N ATOM 778 HZ1 LYS A 325 10.723 29.680 -8.312 1.00 0.00 H ATOM 779 HZ2 LYS A 325 12.073 29.708 -7.281 1.00 0.00 H ATOM 780 HZ3 LYS A 325 10.509 29.588 -6.629 1.00 0.00 H ATOM 781 H LYS A 325 15.918 31.771 -10.331 1.00 0.00 H ATOM 782 N GLY A 326 15.165 28.574 -10.834 1.00 35.14 N ATOM 783 CA GLY A 326 15.128 27.249 -11.445 1.00 34.14 C ATOM 784 C GLY A 326 16.265 26.314 -11.055 1.00 34.10 C ATOM 785 O GLY A 326 16.077 25.098 -11.070 1.00 33.85 O ATOM 786 H GLY A 326 15.338 29.395 -11.449 1.00 0.00 H ATOM 787 N SER A 327 17.437 26.850 -10.667 1.00 27.88 N ATOM 788 CA SER A 327 18.614 26.001 -10.365 1.00 26.24 C ATOM 789 C SER A 327 19.074 25.920 -8.898 1.00 30.39 C ATOM 790 O SER A 327 19.863 25.026 -8.570 1.00 29.68 O ATOM 791 CB SER A 327 19.800 26.431 -11.226 1.00 26.27 C ATOM 792 OG SER A 327 20.089 27.806 -11.042 1.00 30.52 O ATOM 793 HG SER A 327 19.299 28.345 -11.297 1.00 0.00 H ATOM 794 H SER A 327 17.519 27.883 -10.577 1.00 0.00 H ATOM 795 N ALA A 328 18.619 26.832 -8.032 1.00 28.97 N ATOM 796 CA ALA A 328 19.056 26.899 -6.630 1.00 29.48 C ATOM 797 C ALA A 328 19.021 25.576 -5.851 1.00 34.09 C ATOM 798 O ALA A 328 20.035 25.221 -5.249 1.00 36.66 O ATOM 799 CB ALA A 328 18.278 27.964 -5.885 1.00 31.46 C ATOM 800 H ALA A 328 17.922 27.528 -8.367 1.00 0.00 H ATOM 801 N VAL A 329 17.889 24.853 -5.869 1.00 29.46 N ATOM 802 CA VAL A 329 17.711 23.574 -5.176 1.00 29.52 C ATOM 803 C VAL A 329 18.614 22.472 -5.780 1.00 30.17 C ATOM 804 O VAL A 329 19.268 21.742 -5.035 1.00 28.86 O ATOM 805 CB VAL A 329 16.203 23.168 -5.097 1.00 35.28 C ATOM 806 CG1 VAL A 329 16.006 21.710 -4.651 1.00 35.24 C ATOM 807 CG2 VAL A 329 15.461 24.085 -4.151 1.00 35.81 C ATOM 808 H VAL A 329 17.084 25.226 -6.412 1.00 0.00 H ATOM 809 N GLU A 330 18.636 22.365 -7.122 1.00 26.09 N ATOM 810 CA GLU A 330 19.466 21.412 -7.857 1.00 24.95 C ATOM 811 C GLU A 330 20.938 21.612 -7.502 1.00 26.17 C ATOM 812 O GLU A 330 21.615 20.635 -7.167 1.00 23.57 O ATOM 813 CB GLU A 330 19.257 21.562 -9.373 1.00 26.30 C ATOM 814 CG GLU A 330 17.923 21.021 -9.860 1.00 27.74 C ATOM 815 CD GLU A 330 17.625 21.240 -11.331 1.00 35.06 C ATOM 816 OE1 GLU A 330 18.578 21.487 -12.100 1.00 36.38 O ATOM 817 OE2 GLU A 330 16.440 21.140 -11.725 1.00 27.39 O ATOM 818 H GLU A 330 18.023 23.001 -7.671 1.00 0.00 H ATOM 819 N ALA A 331 21.398 22.890 -7.496 1.00 21.96 N ATOM 820 CA ALA A 331 22.772 23.276 -7.177 1.00 22.24 C ATOM 821 C ALA A 331 23.168 22.897 -5.761 1.00 26.70 C ATOM 822 O ALA A 331 24.282 22.428 -5.558 1.00 24.85 O ATOM 823 CB ALA A 331 22.973 24.769 -7.406 1.00 23.22 C ATOM 824 H ALA A 331 20.726 23.647 -7.735 1.00 0.00 H ATOM 825 N MET A 332 22.248 23.046 -4.788 1.00 27.52 N ATOM 826 CA MET A 332 22.513 22.634 -3.410 1.00 29.47 C ATOM 827 C MET A 332 22.640 21.090 -3.311 1.00 31.18 C ATOM 828 O MET A 332 23.563 20.608 -2.651 1.00 30.80 O ATOM 829 CB MET A 332 21.444 23.168 -2.453 1.00 33.62 C ATOM 830 CG MET A 332 21.587 22.595 -1.062 1.00 40.48 C ATOM 831 SD MET A 332 20.085 22.345 -0.121 1.00 48.63 S ATOM 832 CE MET A 332 18.969 21.743 -1.371 1.00 45.10 C ATOM 833 H MET A 332 21.326 23.465 -5.023 1.00 0.00 H ATOM 834 N PHE A 333 21.742 20.336 -3.978 1.00 25.46 N ATOM 835 CA PHE A 333 21.836 18.875 -3.987 1.00 25.76 C ATOM 836 C PHE A 333 23.075 18.385 -4.711 1.00 29.69 C ATOM 837 O PHE A 333 23.659 17.391 -4.273 1.00 31.50 O ATOM 838 CB PHE A 333 20.558 18.185 -4.515 1.00 27.77 C ATOM 839 CG PHE A 333 19.467 18.168 -3.469 1.00 29.56 C ATOM 840 CD1 PHE A 333 19.632 17.457 -2.276 1.00 32.49 C ATOM 841 CD2 PHE A 333 18.302 18.897 -3.647 1.00 30.47 C ATOM 842 CE1 PHE A 333 18.656 17.474 -1.295 1.00 33.79 C ATOM 843 CE2 PHE A 333 17.318 18.907 -2.662 1.00 34.49 C ATOM 844 CZ PHE A 333 17.501 18.194 -1.494 1.00 33.60 C ATOM 845 H PHE A 333 20.969 20.801 -4.495 1.00 0.00 H ATOM 846 N LEU A 334 23.503 19.084 -5.789 1.00 23.75 N ATOM 847 CA LEU A 334 24.727 18.711 -6.504 1.00 24.77 C ATOM 848 C LEU A 334 25.935 18.952 -5.598 1.00 26.89 C ATOM 849 O LEU A 334 26.803 18.091 -5.503 1.00 25.07 O ATOM 850 CB LEU A 334 24.877 19.444 -7.859 1.00 25.20 C ATOM 851 CG LEU A 334 26.074 19.029 -8.747 1.00 30.06 C ATOM 852 CD1 LEU A 334 26.063 17.543 -9.053 1.00 30.86 C ATOM 853 CD2 LEU A 334 26.104 19.822 -10.038 1.00 31.80 C ATOM 854 H LEU A 334 22.952 19.903 -6.116 1.00 0.00 H ATOM 855 N ARG A 335 25.936 20.092 -4.885 1.00 23.73 N ATOM 856 CA ARG A 335 26.966 20.473 -3.924 1.00 24.29 C ATOM 857 C ARG A 335 27.020 19.496 -2.735 1.00 29.12 C ATOM 858 O ARG A 335 28.112 19.103 -2.317 1.00 30.97 O ATOM 859 CB ARG A 335 26.761 21.930 -3.468 1.00 24.83 C ATOM 860 CG ARG A 335 27.768 22.462 -2.452 1.00 31.73 C ATOM 861 CD ARG A 335 29.197 22.352 -2.919 1.00 29.80 C ATOM 862 NE ARG A 335 30.110 22.871 -1.908 1.00 36.12 N ATOM 863 CZ ARG A 335 31.428 22.828 -2.010 1.00 51.43 C ATOM 864 NH1 ARG A 335 31.998 22.282 -3.071 1.00 43.88 N ATOM 865 NH2 ARG A 335 32.187 23.332 -1.054 1.00 44.67 N ATOM 866 HE ARG A 335 29.700 23.301 -1.055 1.00 0.00 H ATOM 867 HH12 ARG A 335 33.035 22.251 -3.146 1.00 0.00 H ATOM 868 HH11 ARG A 335 31.409 21.884 -3.830 1.00 0.00 H ATOM 869 HH22 ARG A 335 33.223 23.296 -1.139 1.00 0.00 H ATOM 870 HH21 ARG A 335 31.749 23.765 -0.216 1.00 0.00 H ATOM 871 H ARG A 335 25.144 20.751 -5.029 1.00 0.00 H ATOM 872 N SER A 336 25.850 19.068 -2.234 1.00 24.57 N ATOM 873 CA SER A 336 25.721 18.095 -1.132 1.00 24.03 C ATOM 874 C SER A 336 26.244 16.742 -1.583 1.00 30.34 C ATOM 875 O SER A 336 26.879 16.050 -0.798 1.00 32.33 O ATOM 876 CB SER A 336 24.276 17.976 -0.663 1.00 21.72 C ATOM 877 OG SER A 336 23.851 19.197 -0.080 1.00 28.63 O ATOM 878 HG SER A 336 23.917 19.922 -0.751 1.00 0.00 H ATOM 879 H SER A 336 24.976 19.448 -2.651 1.00 0.00 H ATOM 880 N ALA A 337 26.000 16.392 -2.855 1.00 28.01 N ATOM 881 CA ALA A 337 26.464 15.152 -3.477 1.00 29.41 C ATOM 882 C ALA A 337 27.992 15.135 -3.557 1.00 33.63 C ATOM 883 O ALA A 337 28.593 14.106 -3.268 1.00 35.26 O ATOM 884 CB ALA A 337 25.854 14.999 -4.862 1.00 29.96 C ATOM 885 H ALA A 337 25.443 17.047 -3.439 1.00 0.00 H ATOM 886 N GLU A 338 28.609 16.289 -3.897 1.00 29.79 N ATOM 887 CA GLU A 338 30.057 16.482 -3.989 1.00 29.66 C ATOM 888 C GLU A 338 30.707 16.200 -2.644 1.00 35.50 C ATOM 889 O GLU A 338 31.621 15.382 -2.584 1.00 37.08 O ATOM 890 CB GLU A 338 30.392 17.899 -4.491 1.00 29.64 C ATOM 891 CG GLU A 338 31.878 18.201 -4.564 1.00 32.85 C ATOM 892 CD GLU A 338 32.258 19.565 -5.096 1.00 46.37 C ATOM 893 OE1 GLU A 338 31.389 20.466 -5.120 1.00 45.79 O ATOM 894 OE2 GLU A 338 33.429 19.732 -5.503 1.00 38.62 O ATOM 895 H GLU A 338 28.004 17.108 -4.111 1.00 0.00 H ATOM 896 N ILE A 339 30.219 16.861 -1.578 1.00 32.62 N ATOM 897 CA ILE A 339 30.712 16.720 -0.203 1.00 33.88 C ATOM 898 C ILE A 339 30.546 15.275 0.297 1.00 38.52 C ATOM 899 O ILE A 339 31.498 14.725 0.831 1.00 39.39 O ATOM 900 CB ILE A 339 30.066 17.787 0.714 1.00 36.93 C ATOM 901 CG1 ILE A 339 30.493 19.205 0.258 1.00 37.58 C ATOM 902 CG2 ILE A 339 30.450 17.570 2.172 1.00 37.33 C ATOM 903 CD1 ILE A 339 29.565 20.233 0.548 1.00 43.11 C ATOM 904 H ILE A 339 29.433 17.522 -1.741 1.00 0.00 H ATOM 905 N PHE A 340 29.381 14.645 0.052 1.00 34.60 N ATOM 906 CA PHE A 340 29.107 13.253 0.448 1.00 35.93 C ATOM 907 C PHE A 340 30.106 12.221 -0.133 1.00 43.16 C ATOM 908 O PHE A 340 30.368 11.198 0.509 1.00 44.66 O ATOM 909 CB PHE A 340 27.658 12.868 0.069 1.00 36.60 C ATOM 910 CG PHE A 340 27.188 11.518 0.566 1.00 38.72 C ATOM 911 CD1 PHE A 340 26.717 11.361 1.863 1.00 41.91 C ATOM 912 CD2 PHE A 340 27.218 10.400 -0.265 1.00 40.59 C ATOM 913 CE1 PHE A 340 26.279 10.108 2.318 1.00 43.83 C ATOM 914 CE2 PHE A 340 26.794 9.146 0.197 1.00 43.91 C ATOM 915 CZ PHE A 340 26.312 9.011 1.478 1.00 42.69 C ATOM 916 H PHE A 340 28.633 15.171 -0.444 1.00 0.00 H ATOM 917 N ASN A 341 30.636 12.484 -1.343 1.00 39.57 N ATOM 918 CA ASN A 341 31.536 11.567 -2.033 1.00 40.15 C ATOM 919 C ASN A 341 33.015 11.935 -1.912 1.00 43.83 C ATOM 920 O ASN A 341 33.838 11.304 -2.570 1.00 44.40 O ATOM 921 CB ASN A 341 31.111 11.404 -3.494 1.00 38.88 C ATOM 922 CG ASN A 341 29.809 10.682 -3.618 1.00 56.41 C ATOM 923 OD1 ASN A 341 29.728 9.469 -3.398 1.00 58.51 O ATOM 924 ND2 ASN A 341 28.752 11.413 -3.923 1.00 44.40 N ATOM 925 HD22 ASN A 341 28.858 12.432 -4.102 1.00 0.00 H ATOM 926 HD21 ASN A 341 27.813 10.970 -3.984 1.00 0.00 H ATOM 927 H ASN A 341 30.392 13.382 -1.807 1.00 0.00 H ATOM 928 N LYS A 342 33.347 12.939 -1.068 1.00 41.05 N ATOM 929 CA LYS A 342 34.726 13.337 -0.784 1.00 42.92 C ATOM 930 C LYS A 342 35.351 12.212 0.061 1.00 50.50 C ATOM 931 O LYS A 342 34.689 11.693 0.963 1.00 48.71 O ATOM 932 CB LYS A 342 34.773 14.671 -0.011 1.00 44.97 C ATOM 933 CG LYS A 342 34.764 15.921 -0.885 1.00 65.06 C ATOM 934 CD LYS A 342 36.164 16.436 -1.205 1.00 84.78 C ATOM 935 CE LYS A 342 36.760 17.265 -0.085 1.00103.18 C ATOM 936 NZ LYS A 342 38.212 17.525 -0.287 1.00113.29 N ATOM 937 HZ1 LYS A 342 38.723 16.620 -0.326 1.00 0.00 H ATOM 938 HZ2 LYS A 342 38.350 18.041 -1.179 1.00 0.00 H ATOM 939 HZ3 LYS A 342 38.574 18.095 0.504 1.00 0.00 H ATOM 940 H LYS A 342 32.579 13.457 -0.595 1.00 0.00 H ATOM 941 N LYS A 343 36.600 11.813 -0.255 1.00 51.48 N ATOM 942 CA LYS A 343 37.308 10.747 0.464 1.00 53.75 C ATOM 943 C LYS A 343 37.590 11.155 1.916 1.00 58.08 C ATOM 944 O LYS A 343 38.016 12.281 2.179 1.00 57.36 O ATOM 945 CB LYS A 343 38.567 10.307 -0.324 1.00 58.80 C ATOM 946 CG LYS A 343 39.682 9.527 0.387 1.00 78.21 C ATOM 947 CD LYS A 343 39.332 8.096 0.825 1.00 88.68 C ATOM 948 CE LYS A 343 40.552 7.347 1.300 1.00 98.30 C ATOM 949 NZ LYS A 343 40.208 6.010 1.846 1.00104.60 N ATOM 950 HZ1 LYS A 343 39.561 6.122 2.653 1.00 0.00 H ATOM 951 HZ2 LYS A 343 39.746 5.443 1.106 1.00 0.00 H ATOM 952 HZ3 LYS A 343 41.076 5.531 2.160 1.00 0.00 H ATOM 953 H LYS A 343 37.085 12.283 -1.046 1.00 0.00 H ATOM 954 N LEU A 344 37.278 10.241 2.850 1.00 55.00 N ATOM 955 CA LEU A 344 37.417 10.434 4.291 1.00 55.16 C ATOM 956 C LEU A 344 38.098 9.225 4.962 1.00 58.23 C ATOM 957 O LEU A 344 38.146 8.160 4.344 1.00 57.84 O ATOM 958 CB LEU A 344 36.011 10.653 4.901 1.00 53.86 C ATOM 959 CG LEU A 344 35.374 12.037 4.756 1.00 56.12 C ATOM 960 CD1 LEU A 344 33.962 12.025 5.271 1.00 55.17 C ATOM 961 CD2 LEU A 344 36.173 13.111 5.495 1.00 59.54 C ATOM 962 H LEU A 344 36.909 9.326 2.522 1.00 0.00 H ATOM 963 N PRO A 345 38.603 9.340 6.225 1.00 54.93 N ATOM 964 CA PRO A 345 39.207 8.162 6.882 1.00 57.22 C ATOM 965 C PRO A 345 38.188 7.045 7.123 1.00 61.69 C ATOM 966 O PRO A 345 36.982 7.305 7.109 1.00 58.81 O ATOM 967 CB PRO A 345 39.738 8.717 8.217 1.00 59.98 C ATOM 968 CG PRO A 345 39.754 10.190 8.066 1.00 62.76 C ATOM 969 CD PRO A 345 38.636 10.516 7.120 1.00 55.88 C ATOM 970 N SER A 346 38.676 5.803 7.332 1.00 60.95 N ATOM 971 CA SER A 346 37.860 4.604 7.568 1.00 61.24 C ATOM 972 C SER A 346 36.725 4.840 8.559 1.00 62.89 C ATOM 973 O SER A 346 36.955 5.397 9.636 1.00 62.22 O ATOM 974 CB SER A 346 38.730 3.439 8.045 1.00 67.43 C ATOM 975 OG SER A 346 39.634 3.036 7.031 1.00 77.48 O ATOM 976 HG SER A 346 40.185 2.283 7.362 1.00 0.00 H ATOM 977 H SER A 346 39.709 5.686 7.325 1.00 0.00 H ATOM 978 N GLY A 347 35.516 4.459 8.153 1.00 58.17 N ATOM 979 CA GLY A 347 34.314 4.572 8.971 1.00 57.80 C ATOM 980 C GLY A 347 33.564 5.890 8.916 1.00 58.85 C ATOM 981 O GLY A 347 32.351 5.898 9.145 1.00 57.32 O ATOM 982 H GLY A 347 35.423 4.058 7.198 1.00 0.00 H ATOM 983 N HIS A 348 34.281 7.009 8.633 1.00 54.27 N ATOM 984 CA HIS A 348 33.759 8.382 8.568 1.00 52.06 C ATOM 985 C HIS A 348 32.582 8.575 7.613 1.00 52.14 C ATOM 986 O HIS A 348 31.617 9.239 7.990 1.00 51.93 O ATOM 987 CB HIS A 348 34.868 9.391 8.239 1.00 53.24 C ATOM 988 CG HIS A 348 35.825 9.651 9.362 1.00 59.19 C ATOM 989 ND1 HIS A 348 36.425 8.611 10.069 1.00 63.59 N ATOM 990 CD2 HIS A 348 36.296 10.828 9.837 1.00 61.24 C ATOM 991 CE1 HIS A 348 37.212 9.188 10.961 1.00 64.34 C ATOM 992 NE2 HIS A 348 37.173 10.520 10.859 1.00 63.47 N ATOM 993 H HIS A 348 35.296 6.882 8.444 1.00 0.00 H ATOM 994 N SER A 349 32.652 8.011 6.393 1.00 45.52 N ATOM 995 CA SER A 349 31.581 8.136 5.407 1.00 43.63 C ATOM 996 C SER A 349 30.321 7.379 5.825 1.00 48.59 C ATOM 997 O SER A 349 29.210 7.855 5.566 1.00 47.03 O ATOM 998 CB SER A 349 32.059 7.697 4.033 1.00 48.07 C ATOM 999 OG SER A 349 33.099 8.554 3.593 1.00 59.49 O ATOM 1000 HG SER A 349 33.853 8.511 4.233 1.00 0.00 H ATOM 1001 H SER A 349 33.501 7.465 6.142 1.00 0.00 H ATOM 1002 N ASP A 350 30.490 6.229 6.507 1.00 48.01 N ATOM 1003 CA ASP A 350 29.366 5.446 7.029 1.00 48.44 C ATOM 1004 C ASP A 350 28.704 6.205 8.178 1.00 49.37 C ATOM 1005 O ASP A 350 27.477 6.198 8.267 1.00 47.81 O ATOM 1006 CB ASP A 350 29.802 4.045 7.485 1.00 52.95 C ATOM 1007 CG ASP A 350 30.457 3.172 6.429 1.00 68.50 C ATOM 1008 OD1 ASP A 350 30.150 3.350 5.223 1.00 68.00 O ATOM 1009 OD2 ASP A 350 31.165 2.225 6.811 1.00 81.03 O ATOM 1010 H ASP A 350 31.457 5.883 6.670 1.00 0.00 H ATOM 1011 N LEU A 351 29.513 6.905 9.016 1.00 45.39 N ATOM 1012 CA LEU A 351 29.015 7.728 10.121 1.00 45.21 C ATOM 1013 C LEU A 351 28.332 8.991 9.584 1.00 46.67 C ATOM 1014 O LEU A 351 27.288 9.376 10.102 1.00 46.35 O ATOM 1015 CB LEU A 351 30.110 8.069 11.157 1.00 46.28 C ATOM 1016 CG LEU A 351 29.664 8.882 12.391 1.00 51.55 C ATOM 1017 CD1 LEU A 351 28.673 8.119 13.261 1.00 53.18 C ATOM 1018 CD2 LEU A 351 30.846 9.305 13.231 1.00 55.48 C ATOM 1019 H LEU A 351 30.541 6.854 8.865 1.00 0.00 H ATOM 1020 N LEU A 352 28.899 9.602 8.535 1.00 40.93 N ATOM 1021 CA LEU A 352 28.332 10.781 7.894 1.00 39.72 C ATOM 1022 C LEU A 352 26.936 10.449 7.348 1.00 42.67 C ATOM 1023 O LEU A 352 25.988 11.171 7.642 1.00 41.50 O ATOM 1024 CB LEU A 352 29.268 11.297 6.776 1.00 38.96 C ATOM 1025 CG LEU A 352 28.854 12.596 6.048 1.00 40.97 C ATOM 1026 CD1 LEU A 352 29.054 13.834 6.938 1.00 42.24 C ATOM 1027 CD2 LEU A 352 29.625 12.756 4.769 1.00 37.52 C ATOM 1028 H LEU A 352 29.788 9.215 8.160 1.00 0.00 H ATOM 1029 N GLU A 353 26.811 9.335 6.609 1.00 39.73 N ATOM 1030 CA GLU A 353 25.553 8.838 6.060 1.00 39.58 C ATOM 1031 C GLU A 353 24.533 8.588 7.197 1.00 43.30 C ATOM 1032 O GLU A 353 23.408 9.093 7.126 1.00 43.36 O ATOM 1033 CB GLU A 353 25.810 7.551 5.260 1.00 42.01 C ATOM 1034 CG GLU A 353 24.631 7.073 4.424 1.00 50.91 C ATOM 1035 CD GLU A 353 24.840 5.757 3.695 1.00 59.60 C ATOM 1036 OE1 GLU A 353 25.953 5.526 3.168 1.00 44.61 O ATOM 1037 OE2 GLU A 353 23.866 4.975 3.611 1.00 52.96 O ATOM 1038 H GLU A 353 27.673 8.787 6.414 1.00 0.00 H ATOM 1039 N ALA A 354 24.950 7.869 8.257 1.00 38.77 N ATOM 1040 CA ALA A 354 24.103 7.578 9.419 1.00 39.52 C ATOM 1041 C ALA A 354 23.610 8.863 10.134 1.00 43.05 C ATOM 1042 O ALA A 354 22.445 8.926 10.543 1.00 43.89 O ATOM 1043 CB ALA A 354 24.835 6.675 10.395 1.00 42.00 C ATOM 1044 H ALA A 354 25.923 7.501 8.251 1.00 0.00 H ATOM 1045 N ARG A 355 24.480 9.882 10.262 1.00 36.87 N ATOM 1046 CA ARG A 355 24.117 11.154 10.879 1.00 36.02 C ATOM 1047 C ARG A 355 23.121 11.928 10.014 1.00 39.37 C ATOM 1048 O ARG A 355 22.175 12.495 10.561 1.00 38.91 O ATOM 1049 CB ARG A 355 25.358 11.981 11.226 1.00 33.53 C ATOM 1050 CG ARG A 355 26.138 11.416 12.419 1.00 37.73 C ATOM 1051 CD ARG A 355 25.886 12.151 13.726 1.00 40.91 C ATOM 1052 NE ARG A 355 27.155 12.490 14.365 1.00 60.04 N ATOM 1053 CZ ARG A 355 27.784 11.728 15.254 1.00 81.73 C ATOM 1054 NH1 ARG A 355 27.272 10.561 15.620 1.00 78.40 N ATOM 1055 NH2 ARG A 355 28.941 12.121 15.770 1.00 67.75 N ATOM 1056 HE ARG A 355 27.599 13.394 14.105 1.00 0.00 H ATOM 1057 HH12 ARG A 355 27.770 9.970 16.316 1.00 0.00 H ATOM 1058 HH11 ARG A 355 26.373 10.237 15.211 1.00 0.00 H ATOM 1059 HH22 ARG A 355 29.430 11.522 16.465 1.00 0.00 H ATOM 1060 HH21 ARG A 355 29.359 13.028 15.479 1.00 0.00 H ATOM 1061 H ARG A 355 25.450 9.758 9.907 1.00 0.00 H ATOM 1062 N ILE A 356 23.278 11.885 8.667 1.00 36.41 N ATOM 1063 CA ILE A 356 22.344 12.530 7.723 1.00 35.34 C ATOM 1064 C ILE A 356 20.988 11.786 7.716 1.00 41.12 C ATOM 1065 O ILE A 356 19.943 12.431 7.731 1.00 40.45 O ATOM 1066 CB ILE A 356 22.954 12.737 6.296 1.00 36.29 C ATOM 1067 CG1 ILE A 356 24.197 13.643 6.352 1.00 34.66 C ATOM 1068 CG2 ILE A 356 21.917 13.318 5.309 1.00 35.44 C ATOM 1069 CD1 ILE A 356 25.134 13.473 5.247 1.00 30.05 C ATOM 1070 H ILE A 356 24.096 11.373 8.281 1.00 0.00 H ATOM 1071 N ARG A 357 21.021 10.447 7.749 1.00 40.03 N ATOM 1072 CA ARG A 357 19.852 9.561 7.785 1.00 41.41 C ATOM 1073 C ARG A 357 18.961 9.845 9.007 1.00 46.51 C ATOM 1074 O ARG A 357 17.745 9.651 8.939 1.00 46.96 O ATOM 1075 CB ARG A 357 20.338 8.105 7.816 1.00 43.63 C ATOM 1076 CG ARG A 357 19.294 7.051 7.468 1.00 52.35 C ATOM 1077 CD ARG A 357 19.944 5.712 7.147 1.00 56.37 C ATOM 1078 NE ARG A 357 20.643 5.700 5.854 1.00 56.55 N ATOM 1079 CZ ARG A 357 20.090 5.326 4.702 1.00 70.53 C ATOM 1080 NH1 ARG A 357 18.821 4.940 4.659 1.00 55.84 N ATOM 1081 NH2 ARG A 357 20.801 5.338 3.583 1.00 60.25 N ATOM 1082 HE ARG A 357 21.637 6.004 5.838 1.00 0.00 H ATOM 1083 HH12 ARG A 357 18.396 4.649 3.755 1.00 0.00 H ATOM 1084 HH11 ARG A 357 18.251 4.928 5.529 1.00 0.00 H ATOM 1085 HH22 ARG A 357 20.364 5.045 2.686 1.00 0.00 H ATOM 1086 HH21 ARG A 357 21.796 5.641 3.602 1.00 0.00 H ATOM 1087 H ARG A 357 21.958 9.996 7.749 1.00 0.00 H ATOM 1088 N ASN A 358 19.571 10.308 10.113 1.00 43.30 N ATOM 1089 CA ASN A 358 18.890 10.609 11.372 1.00 44.10 C ATOM 1090 C ASN A 358 18.744 12.106 11.675 1.00 46.70 C ATOM 1091 O ASN A 358 18.353 12.456 12.785 1.00 48.11 O ATOM 1092 CB ASN A 358 19.599 9.887 12.526 1.00 50.74 C ATOM 1093 CG ASN A 358 18.637 9.285 13.513 1.00 88.52 C ATOM 1094 OD1 ASN A 358 17.931 8.309 13.214 1.00 84.19 O ATOM 1095 ND2 ASN A 358 18.569 9.872 14.705 1.00 83.47 N ATOM 1096 HD22 ASN A 358 19.177 10.688 14.918 1.00 0.00 H ATOM 1097 HD21 ASN A 358 17.908 9.515 15.424 1.00 0.00 H ATOM 1098 H ASN A 358 20.599 10.463 10.070 1.00 0.00 H ATOM 1099 N SER A 359 19.003 12.985 10.684 1.00 41.72 N ATOM 1100 CA SER A 359 18.942 14.452 10.824 1.00 40.19 C ATOM 1101 C SER A 359 17.540 15.045 11.087 1.00 44.45 C ATOM 1102 O SER A 359 17.435 16.169 11.586 1.00 43.83 O ATOM 1103 CB SER A 359 19.566 15.131 9.608 1.00 40.46 C ATOM 1104 OG SER A 359 18.864 14.815 8.423 1.00 44.75 O ATOM 1105 HG SER A 359 18.883 13.835 8.281 1.00 0.00 H ATOM 1106 H SER A 359 19.265 12.600 9.754 1.00 0.00 H ATOM 1107 N GLY A 360 16.496 14.312 10.725 1.00 40.76 N ATOM 1108 CA GLY A 360 15.123 14.765 10.882 1.00 41.26 C ATOM 1109 C GLY A 360 14.267 14.540 9.651 1.00 44.26 C ATOM 1110 O GLY A 360 13.045 14.472 9.772 1.00 45.11 O ATOM 1111 H GLY A 360 16.666 13.373 10.311 1.00 0.00 H ATOM 1112 N ILE A 361 14.903 14.445 8.459 1.00 40.14 N ATOM 1113 CA ILE A 361 14.211 14.173 7.184 1.00 40.51 C ATOM 1114 C ILE A 361 13.385 12.882 7.301 1.00 45.74 C ATOM 1115 O ILE A 361 13.842 11.922 7.935 1.00 44.35 O ATOM 1116 CB ILE A 361 15.153 14.010 5.959 1.00 41.97 C ATOM 1117 CG1 ILE A 361 16.608 14.297 6.293 1.00 42.48 C ATOM 1118 CG2 ILE A 361 14.665 14.813 4.782 1.00 40.38 C ATOM 1119 CD1 ILE A 361 17.590 13.325 5.645 1.00 50.67 C ATOM 1120 H ILE A 361 15.935 14.571 8.441 1.00 0.00 H ATOM 1121 N SER A 362 12.219 12.848 6.624 1.00 44.16 N ATOM 1122 CA SER A 362 11.327 11.692 6.586 1.00 46.88 C ATOM 1123 C SER A 362 11.932 10.564 5.781 1.00 54.37 C ATOM 1124 O SER A 362 12.652 10.827 4.824 1.00 52.98 O ATOM 1125 CB SER A 362 9.982 12.088 5.993 1.00 50.48 C ATOM 1126 OG SER A 362 9.309 12.932 6.908 1.00 60.01 O ATOM 1127 HG SER A 362 9.855 13.742 7.071 1.00 0.00 H ATOM 1128 H SER A 362 11.937 13.698 6.096 1.00 0.00 H ATOM 1129 N ASP A 363 11.625 9.311 6.154 1.00 55.98 N ATOM 1130 CA ASP A 363 12.115 8.094 5.491 1.00 57.98 C ATOM 1131 C ASP A 363 11.862 8.083 3.974 1.00 61.17 C ATOM 1132 O ASP A 363 12.707 7.614 3.201 1.00 60.87 O ATOM 1133 CB ASP A 363 11.513 6.845 6.158 1.00 63.43 C ATOM 1134 CG ASP A 363 11.913 6.680 7.614 1.00 83.86 C ATOM 1135 OD1 ASP A 363 11.034 6.850 8.497 1.00 87.01 O ATOM 1136 OD2 ASP A 363 13.112 6.397 7.876 1.00 91.06 O ATOM 1137 H ASP A 363 10.994 9.193 6.972 1.00 0.00 H ATOM 1138 N GLU A 364 10.708 8.645 3.575 1.00 56.86 N ATOM 1139 CA GLU A 364 10.173 8.820 2.221 1.00 56.37 C ATOM 1140 C GLU A 364 11.181 9.501 1.269 1.00 57.45 C ATOM 1141 O GLU A 364 11.204 9.198 0.074 1.00 56.49 O ATOM 1142 CB GLU A 364 8.908 9.697 2.348 1.00 58.47 C ATOM 1143 CG GLU A 364 8.025 9.807 1.117 1.00 71.75 C ATOM 1144 CD GLU A 364 6.679 10.476 1.347 1.00 94.42 C ATOM 1145 OE1 GLU A 364 6.549 11.276 2.303 1.00 82.99 O ATOM 1146 OE2 GLU A 364 5.751 10.202 0.553 1.00 93.02 O ATOM 1147 H GLU A 364 10.105 9.010 4.340 1.00 0.00 H ATOM 1148 N TYR A 365 11.998 10.418 1.810 1.00 51.90 N ATOM 1149 CA TYR A 365 12.949 11.221 1.054 1.00 49.78 C ATOM 1150 C TYR A 365 14.420 10.818 1.207 1.00 51.33 C ATOM 1151 O TYR A 365 15.254 11.309 0.434 1.00 47.64 O ATOM 1152 CB TYR A 365 12.750 12.706 1.413 1.00 50.02 C ATOM 1153 CG TYR A 365 11.361 13.197 1.073 1.00 52.10 C ATOM 1154 CD1 TYR A 365 10.974 13.395 -0.251 1.00 53.73 C ATOM 1155 CD2 TYR A 365 10.412 13.409 2.069 1.00 53.67 C ATOM 1156 CE1 TYR A 365 9.682 13.801 -0.575 1.00 54.76 C ATOM 1157 CE2 TYR A 365 9.117 13.821 1.757 1.00 55.31 C ATOM 1158 CZ TYR A 365 8.758 14.017 0.432 1.00 62.96 C ATOM 1159 OH TYR A 365 7.485 14.411 0.103 1.00 67.41 O ATOM 1160 HH TYR A 365 7.412 14.500 -0.880 1.00 0.00 H ATOM 1161 H TYR A 365 11.949 10.565 2.838 1.00 0.00 H ATOM 1162 N ILE A 366 14.732 9.924 2.182 1.00 49.43 N ATOM 1163 CA ILE A 366 16.092 9.451 2.484 1.00 49.23 C ATOM 1164 C ILE A 366 16.641 8.566 1.346 1.00 52.59 C ATOM 1165 O ILE A 366 17.766 8.772 0.889 1.00 50.05 O ATOM 1166 CB ILE A 366 16.152 8.772 3.897 1.00 53.94 C ATOM 1167 CG1 ILE A 366 16.141 9.823 5.022 1.00 53.94 C ATOM 1168 CG2 ILE A 366 17.360 7.840 4.065 1.00 54.95 C ATOM 1169 CD1 ILE A 366 15.565 9.297 6.404 1.00 61.19 C ATOM 1170 H ILE A 366 13.952 9.546 2.757 1.00 0.00 H ATOM 1171 N THR A 367 15.843 7.600 0.894 1.00 51.72 N ATOM 1172 CA THR A 367 16.240 6.695 -0.188 1.00 52.52 C ATOM 1173 C THR A 367 16.427 7.454 -1.530 1.00 52.18 C ATOM 1174 O THR A 367 17.527 7.338 -2.072 1.00 51.47 O ATOM 1175 CB THR A 367 15.314 5.469 -0.291 1.00 66.40 C ATOM 1176 OG1 THR A 367 14.595 5.293 0.939 1.00 68.33 O ATOM 1177 CG2 THR A 367 16.082 4.203 -0.646 1.00 65.38 C ATOM 1178 HG1 THR A 367 14.003 4.503 0.864 1.00 0.00 H ATOM 1179 H THR A 367 14.904 7.484 1.325 1.00 0.00 H ATOM 1180 N PRO A 368 15.465 8.277 -2.060 1.00 45.86 N ATOM 1181 CA PRO A 368 15.744 9.005 -3.320 1.00 43.70 C ATOM 1182 C PRO A 368 16.985 9.910 -3.234 1.00 45.23 C ATOM 1183 O PRO A 368 17.710 10.040 -4.220 1.00 45.30 O ATOM 1184 CB PRO A 368 14.462 9.822 -3.552 1.00 45.04 C ATOM 1185 CG PRO A 368 13.414 9.133 -2.783 1.00 50.70 C ATOM 1186 CD PRO A 368 14.096 8.572 -1.578 1.00 47.19 C ATOM 1187 N MET A 369 17.252 10.493 -2.044 1.00 39.00 N ATOM 1188 CA MET A 369 18.414 11.348 -1.809 1.00 36.83 C ATOM 1189 C MET A 369 19.762 10.579 -1.836 1.00 40.95 C ATOM 1190 O MET A 369 20.654 10.995 -2.577 1.00 39.26 O ATOM 1191 CB MET A 369 18.238 12.145 -0.518 1.00 38.59 C ATOM 1192 CG MET A 369 19.382 13.077 -0.219 1.00 40.34 C ATOM 1193 SD MET A 369 19.248 13.904 1.369 1.00 43.49 S ATOM 1194 CE MET A 369 19.471 12.565 2.465 1.00 41.93 C ATOM 1195 H MET A 369 16.596 10.324 -1.254 1.00 0.00 H ATOM 1196 N PHE A 370 19.906 9.468 -1.055 1.00 38.10 N ATOM 1197 CA PHE A 370 21.147 8.683 -1.030 1.00 38.47 C ATOM 1198 C PHE A 370 21.379 7.916 -2.331 1.00 43.26 C ATOM 1199 O PHE A 370 22.535 7.694 -2.706 1.00 43.64 O ATOM 1200 CB PHE A 370 21.266 7.771 0.203 1.00 41.69 C ATOM 1201 CG PHE A 370 21.502 8.515 1.495 1.00 43.36 C ATOM 1202 CD1 PHE A 370 22.626 9.321 1.662 1.00 46.85 C ATOM 1203 CD2 PHE A 370 20.594 8.432 2.540 1.00 46.50 C ATOM 1204 CE1 PHE A 370 22.819 10.049 2.845 1.00 47.26 C ATOM 1205 CE2 PHE A 370 20.811 9.126 3.736 1.00 49.13 C ATOM 1206 CZ PHE A 370 21.922 9.926 3.881 1.00 46.29 C ATOM 1207 H PHE A 370 19.110 9.168 -0.457 1.00 0.00 H ATOM 1208 N SER A 371 20.295 7.585 -3.053 1.00 38.99 N ATOM 1209 CA SER A 371 20.367 6.928 -4.358 1.00 38.99 C ATOM 1210 C SER A 371 21.017 7.916 -5.365 1.00 40.88 C ATOM 1211 O SER A 371 21.947 7.535 -6.084 1.00 40.05 O ATOM 1212 CB SER A 371 18.975 6.495 -4.813 1.00 42.51 C ATOM 1213 OG SER A 371 19.010 5.978 -6.129 1.00 53.26 O ATOM 1214 HG SER A 371 18.098 5.705 -6.400 1.00 0.00 H ATOM 1215 H SER A 371 19.357 7.807 -2.664 1.00 0.00 H ATOM 1216 N PHE A 372 20.576 9.195 -5.357 1.00 35.73 N ATOM 1217 CA PHE A 372 21.183 10.232 -6.198 1.00 34.40 C ATOM 1218 C PHE A 372 22.674 10.456 -5.854 1.00 35.18 C ATOM 1219 O PHE A 372 23.493 10.499 -6.762 1.00 34.75 O ATOM 1220 CB PHE A 372 20.390 11.556 -6.153 1.00 35.43 C ATOM 1221 CG PHE A 372 21.092 12.692 -6.863 1.00 36.50 C ATOM 1222 CD1 PHE A 372 21.224 12.694 -8.247 1.00 39.86 C ATOM 1223 CD2 PHE A 372 21.674 13.729 -6.143 1.00 37.87 C ATOM 1224 CE1 PHE A 372 21.893 13.732 -8.897 1.00 39.85 C ATOM 1225 CE2 PHE A 372 22.352 14.759 -6.796 1.00 39.37 C ATOM 1226 CZ PHE A 372 22.457 14.751 -8.165 1.00 37.59 C ATOM 1227 H PHE A 372 19.782 9.451 -4.735 1.00 0.00 H ATOM 1228 N TYR A 373 23.016 10.559 -4.557 1.00 30.67 N ATOM 1229 CA TYR A 373 24.392 10.786 -4.073 1.00 29.00 C ATOM 1230 C TYR A 373 25.363 9.683 -4.495 1.00 37.91 C ATOM 1231 O TYR A 373 26.476 9.978 -4.938 1.00 39.69 O ATOM 1232 CB TYR A 373 24.426 10.932 -2.541 1.00 27.15 C ATOM 1233 CG TYR A 373 23.768 12.173 -1.972 1.00 24.22 C ATOM 1234 CD1 TYR A 373 23.406 13.236 -2.792 1.00 24.38 C ATOM 1235 CD2 TYR A 373 23.564 12.310 -0.599 1.00 24.71 C ATOM 1236 CE1 TYR A 373 22.811 14.387 -2.271 1.00 21.42 C ATOM 1237 CE2 TYR A 373 22.977 13.458 -0.067 1.00 24.27 C ATOM 1238 CZ TYR A 373 22.609 14.495 -0.908 1.00 26.44 C ATOM 1239 OH TYR A 373 21.974 15.602 -0.412 1.00 28.84 O ATOM 1240 HH TYR A 373 22.554 16.040 0.261 1.00 0.00 H ATOM 1241 H TYR A 373 22.260 10.473 -3.848 1.00 0.00 H ATOM 1242 N LYS A 374 24.954 8.418 -4.332 1.00 36.51 N ATOM 1243 CA LYS A 374 25.769 7.268 -4.684 1.00 38.65 C ATOM 1244 C LYS A 374 25.973 7.148 -6.206 1.00 42.58 C ATOM 1245 O LYS A 374 27.096 6.858 -6.632 1.00 42.60 O ATOM 1246 CB LYS A 374 25.215 5.988 -4.035 1.00 44.04 C ATOM 1247 CG LYS A 374 25.715 5.858 -2.583 1.00 58.07 C ATOM 1248 CD LYS A 374 24.640 5.467 -1.567 1.00 67.74 C ATOM 1249 CE LYS A 374 25.048 5.768 -0.137 1.00 77.08 C ATOM 1250 NZ LYS A 374 26.080 4.820 0.380 1.00 82.41 N ATOM 1251 HZ1 LYS A 374 25.703 3.851 0.353 1.00 0.00 H ATOM 1252 HZ2 LYS A 374 26.932 4.879 -0.214 1.00 0.00 H ATOM 1253 HZ3 LYS A 374 26.321 5.072 1.360 1.00 0.00 H ATOM 1254 H LYS A 374 24.008 8.251 -3.934 1.00 0.00 H ATOM 1255 N SER A 375 24.927 7.472 -7.013 1.00 37.74 N ATOM 1256 CA SER A 375 24.969 7.485 -8.480 1.00 37.56 C ATOM 1257 C SER A 375 25.906 8.577 -8.998 1.00 40.62 C ATOM 1258 O SER A 375 26.475 8.427 -10.087 1.00 39.96 O ATOM 1259 CB SER A 375 23.576 7.695 -9.056 1.00 41.77 C ATOM 1260 OG SER A 375 22.754 6.572 -8.784 1.00 59.08 O ATOM 1261 HG SER A 375 22.683 6.446 -7.805 1.00 0.00 H ATOM 1262 H SER A 375 24.029 7.730 -6.556 1.00 0.00 H ATOM 1263 N ILE A 376 26.051 9.679 -8.218 1.00 35.90 N ATOM 1264 CA ILE A 376 26.969 10.788 -8.483 1.00 35.23 C ATOM 1265 C ILE A 376 28.384 10.293 -8.232 1.00 40.29 C ATOM 1266 O ILE A 376 29.250 10.519 -9.064 1.00 38.93 O ATOM 1267 CB ILE A 376 26.618 12.056 -7.647 1.00 37.38 C ATOM 1268 CG1 ILE A 376 25.402 12.811 -8.251 1.00 37.38 C ATOM 1269 CG2 ILE A 376 27.832 12.997 -7.434 1.00 37.82 C ATOM 1270 CD1 ILE A 376 25.648 13.686 -9.602 1.00 43.24 C ATOM 1271 H ILE A 376 25.462 9.740 -7.363 1.00 0.00 H ATOM 1272 N GLY A 377 28.584 9.609 -7.103 1.00 39.94 N ATOM 1273 CA GLY A 377 29.865 9.043 -6.702 1.00 41.98 C ATOM 1274 C GLY A 377 30.474 8.056 -7.678 1.00 49.80 C ATOM 1275 O GLY A 377 31.701 7.998 -7.804 1.00 51.99 O ATOM 1276 H GLY A 377 27.772 9.471 -6.468 1.00 0.00 H ATOM 1277 N GLU A 378 29.627 7.289 -8.392 1.00 47.27 N ATOM 1278 CA GLU A 378 30.052 6.279 -9.373 1.00 49.43 C ATOM 1279 C GLU A 378 30.789 6.876 -10.584 1.00 53.12 C ATOM 1280 O GLU A 378 31.567 6.167 -11.231 1.00 54.45 O ATOM 1281 CB GLU A 378 28.868 5.398 -9.811 1.00 51.78 C ATOM 1282 CG GLU A 378 28.457 4.386 -8.748 1.00 67.03 C ATOM 1283 CD GLU A 378 27.066 3.778 -8.844 1.00 95.49 C ATOM 1284 OE1 GLU A 378 26.241 4.262 -9.656 1.00 91.98 O ATOM 1285 OE2 GLU A 378 26.794 2.827 -8.076 1.00 91.49 O ATOM 1286 H GLU A 378 28.607 7.420 -8.240 1.00 0.00 H ATOM 1287 N LEU A 379 30.583 8.187 -10.845 1.00 46.88 N ATOM 1288 CA LEU A 379 31.215 8.950 -11.925 1.00 46.18 C ATOM 1289 C LEU A 379 32.630 9.373 -11.590 1.00 48.66 C ATOM 1290 O LEU A 379 33.364 9.764 -12.496 1.00 49.96 O ATOM 1291 CB LEU A 379 30.398 10.205 -12.238 1.00 45.08 C ATOM 1292 CG LEU A 379 29.122 10.035 -12.992 1.00 50.97 C ATOM 1293 CD1 LEU A 379 28.273 11.259 -12.800 1.00 50.60 C ATOM 1294 CD2 LEU A 379 29.405 9.834 -14.477 1.00 55.56 C ATOM 1295 H LEU A 379 29.920 8.697 -10.227 1.00 0.00 H ATOM 1296 N LYS A 380 32.997 9.342 -10.292 1.00 44.09 N ATOM 1297 CA LYS A 380 34.326 9.711 -9.770 1.00 44.00 C ATOM 1298 C LYS A 380 34.759 11.054 -10.368 1.00 44.51 C ATOM 1299 O LYS A 380 35.801 11.166 -11.020 1.00 45.29 O ATOM 1300 CB LYS A 380 35.370 8.585 -10.010 1.00 48.61 C ATOM 1301 CG LYS A 380 34.954 7.197 -9.498 1.00 61.11 C ATOM 1302 CD LYS A 380 35.176 7.001 -7.996 1.00 70.85 C ATOM 1303 CE LYS A 380 34.649 5.667 -7.533 1.00 84.42 C ATOM 1304 NZ LYS A 380 35.105 5.347 -6.156 1.00 98.28 N ATOM 1305 HZ1 LYS A 380 36.144 5.315 -6.135 1.00 0.00 H ATOM 1306 HZ2 LYS A 380 34.766 6.080 -5.501 1.00 0.00 H ATOM 1307 HZ3 LYS A 380 34.723 4.422 -5.872 1.00 0.00 H ATOM 1308 H LYS A 380 32.283 9.032 -9.602 1.00 0.00 H ATOM 1309 N MET A 381 33.890 12.054 -10.186 1.00 37.86 N ATOM 1310 CA MET A 381 34.030 13.412 -10.711 1.00 35.11 C ATOM 1311 C MET A 381 35.148 14.194 -10.068 1.00 37.68 C ATOM 1312 O MET A 381 35.386 14.073 -8.860 1.00 37.46 O ATOM 1313 CB MET A 381 32.708 14.179 -10.556 1.00 35.08 C ATOM 1314 CG MET A 381 31.607 13.714 -11.487 1.00 37.59 C ATOM 1315 SD MET A 381 29.999 14.528 -11.159 1.00 39.57 S ATOM 1316 CE MET A 381 30.381 16.183 -11.720 1.00 35.45 C ATOM 1317 H MET A 381 33.041 11.848 -9.622 1.00 0.00 H ATOM 1318 N THR A 382 35.833 15.005 -10.888 1.00 34.07 N ATOM 1319 CA THR A 382 36.901 15.891 -10.433 1.00 33.82 C ATOM 1320 C THR A 382 36.258 17.197 -10.040 1.00 36.16 C ATOM 1321 O THR A 382 35.096 17.451 -10.407 1.00 34.92 O ATOM 1322 CB THR A 382 37.973 16.095 -11.513 1.00 41.31 C ATOM 1323 OG1 THR A 382 37.353 16.586 -12.697 1.00 44.30 O ATOM 1324 CG2 THR A 382 38.753 14.834 -11.817 1.00 38.86 C ATOM 1325 HG1 THR A 382 38.040 16.719 -13.397 1.00 0.00 H ATOM 1326 H THR A 382 35.591 15.003 -11.899 1.00 0.00 H ATOM 1327 N GLN A 383 37.003 18.034 -9.300 1.00 34.01 N ATOM 1328 CA GLN A 383 36.537 19.354 -8.862 1.00 33.16 C ATOM 1329 C GLN A 383 36.055 20.238 -10.031 1.00 35.28 C ATOM 1330 O GLN A 383 35.043 20.930 -9.896 1.00 33.07 O ATOM 1331 CB GLN A 383 37.577 20.072 -8.002 1.00 35.62 C ATOM 1332 CG GLN A 383 39.028 19.969 -8.451 1.00 51.75 C ATOM 1333 CD GLN A 383 39.909 21.056 -7.882 1.00 52.31 C ATOM 1334 OE1 GLN A 383 39.571 21.763 -6.917 1.00 44.83 O ATOM 1335 NE2 GLN A 383 41.053 21.227 -8.507 1.00 38.88 N ATOM 1336 HE22 GLN A 383 41.303 20.616 -9.311 1.00 0.00 H ATOM 1337 HE21 GLN A 383 41.708 21.973 -8.197 1.00 0.00 H ATOM 1338 H GLN A 383 37.959 17.731 -9.023 1.00 0.00 H ATOM 1339 N GLU A 384 36.750 20.144 -11.186 1.00 32.33 N ATOM 1340 CA GLU A 384 36.457 20.871 -12.421 1.00 32.17 C ATOM 1341 C GLU A 384 35.136 20.416 -13.036 1.00 36.78 C ATOM 1342 O GLU A 384 34.361 21.245 -13.516 1.00 35.78 O ATOM 1343 CB GLU A 384 37.622 20.696 -13.419 1.00 34.79 C ATOM 1344 CG GLU A 384 38.927 21.347 -12.971 1.00 45.54 C ATOM 1345 CD GLU A 384 39.932 20.540 -12.149 1.00 57.62 C ATOM 1346 OE1 GLU A 384 39.917 19.286 -12.199 1.00 33.23 O ATOM 1347 OE2 GLU A 384 40.761 21.183 -11.468 1.00 52.82 O ATOM 1348 H GLU A 384 37.565 19.498 -11.198 1.00 0.00 H ATOM 1349 N GLU A 385 34.883 19.095 -13.000 1.00 33.29 N ATOM 1350 CA GLU A 385 33.659 18.494 -13.510 1.00 32.15 C ATOM 1351 C GLU A 385 32.450 18.961 -12.682 1.00 33.44 C ATOM 1352 O GLU A 385 31.435 19.318 -13.262 1.00 32.50 O ATOM 1353 CB GLU A 385 33.782 16.963 -13.585 1.00 34.14 C ATOM 1354 CG GLU A 385 34.709 16.514 -14.705 1.00 41.62 C ATOM 1355 CD GLU A 385 34.978 15.029 -14.846 1.00 58.98 C ATOM 1356 OE1 GLU A 385 34.478 14.238 -14.005 1.00 42.76 O ATOM 1357 OE2 GLU A 385 35.701 14.660 -15.804 1.00 58.82 O ATOM 1358 H GLU A 385 35.602 18.468 -12.585 1.00 0.00 H ATOM 1359 N TYR A 386 32.604 19.060 -11.347 1.00 29.84 N ATOM 1360 CA TYR A 386 31.577 19.584 -10.433 1.00 27.98 C ATOM 1361 C TYR A 386 31.298 21.056 -10.727 1.00 31.62 C ATOM 1362 O TYR A 386 30.129 21.446 -10.786 1.00 30.64 O ATOM 1363 CB TYR A 386 32.004 19.419 -8.955 1.00 28.00 C ATOM 1364 CG TYR A 386 31.775 18.036 -8.388 1.00 28.87 C ATOM 1365 CD1 TYR A 386 30.483 17.552 -8.169 1.00 29.47 C ATOM 1366 CD2 TYR A 386 32.846 17.236 -7.996 1.00 30.66 C ATOM 1367 CE1 TYR A 386 30.266 16.274 -7.650 1.00 29.51 C ATOM 1368 CE2 TYR A 386 32.642 15.970 -7.439 1.00 31.06 C ATOM 1369 CZ TYR A 386 31.349 15.487 -7.278 1.00 38.83 C ATOM 1370 OH TYR A 386 31.141 14.233 -6.729 1.00 41.37 O ATOM 1371 HH TYR A 386 31.522 14.207 -5.816 1.00 0.00 H ATOM 1372 H TYR A 386 33.506 18.746 -10.936 1.00 0.00 H ATOM 1373 N ALA A 387 32.372 21.866 -10.921 1.00 28.60 N ATOM 1374 CA ALA A 387 32.277 23.306 -11.216 1.00 28.25 C ATOM 1375 C ALA A 387 31.579 23.575 -12.542 1.00 30.47 C ATOM 1376 O ALA A 387 30.680 24.410 -12.587 1.00 28.64 O ATOM 1377 CB ALA A 387 33.654 23.941 -11.213 1.00 30.17 C ATOM 1378 H ALA A 387 33.320 21.443 -10.857 1.00 0.00 H ATOM 1379 N LEU A 388 31.955 22.834 -13.601 1.00 29.37 N ATOM 1380 CA LEU A 388 31.343 22.956 -14.935 1.00 29.06 C ATOM 1381 C LEU A 388 29.887 22.503 -14.944 1.00 32.13 C ATOM 1382 O LEU A 388 29.050 23.194 -15.521 1.00 29.82 O ATOM 1383 CB LEU A 388 32.156 22.203 -15.998 1.00 29.62 C ATOM 1384 CG LEU A 388 33.470 22.841 -16.412 1.00 34.67 C ATOM 1385 CD1 LEU A 388 34.340 21.838 -17.138 1.00 36.56 C ATOM 1386 CD2 LEU A 388 33.241 24.077 -17.286 1.00 35.51 C ATOM 1387 H LEU A 388 32.718 22.139 -13.470 1.00 0.00 H ATOM 1388 N LEU A 389 29.581 21.371 -14.259 1.00 29.74 N ATOM 1389 CA LEU A 389 28.224 20.841 -14.152 1.00 29.59 C ATOM 1390 C LEU A 389 27.295 21.807 -13.411 1.00 31.64 C ATOM 1391 O LEU A 389 26.141 21.954 -13.807 1.00 32.47 O ATOM 1392 CB LEU A 389 28.203 19.435 -13.532 1.00 30.26 C ATOM 1393 CG LEU A 389 27.024 18.555 -13.935 1.00 37.20 C ATOM 1394 CD1 LEU A 389 27.165 18.077 -15.384 1.00 39.26 C ATOM 1395 CD2 LEU A 389 26.915 17.338 -13.036 1.00 40.64 C ATOM 1396 H LEU A 389 30.351 20.856 -13.787 1.00 0.00 H ATOM 1397 N THR A 390 27.804 22.501 -12.384 1.00 26.43 N ATOM 1398 CA THR A 390 27.024 23.511 -11.648 1.00 25.17 C ATOM 1399 C THR A 390 26.691 24.659 -12.610 1.00 27.64 C ATOM 1400 O THR A 390 25.527 25.040 -12.707 1.00 27.94 O ATOM 1401 CB THR A 390 27.768 23.965 -10.371 1.00 29.09 C ATOM 1402 OG1 THR A 390 28.068 22.813 -9.576 1.00 25.36 O ATOM 1403 CG2 THR A 390 26.963 24.975 -9.534 1.00 25.67 C ATOM 1404 HG1 THR A 390 28.640 22.195 -10.096 1.00 0.00 H ATOM 1405 H THR A 390 28.787 22.320 -12.096 1.00 0.00 H ATOM 1406 N ALA A 391 27.697 25.164 -13.354 1.00 23.32 N ATOM 1407 CA ALA A 391 27.514 26.211 -14.366 1.00 23.79 C ATOM 1408 C ALA A 391 26.486 25.785 -15.441 1.00 28.03 C ATOM 1409 O ALA A 391 25.584 26.561 -15.768 1.00 28.56 O ATOM 1410 CB ALA A 391 28.847 26.572 -15.005 1.00 24.88 C ATOM 1411 H ALA A 391 28.656 24.790 -13.202 1.00 0.00 H ATOM 1412 N ILE A 392 26.577 24.532 -15.912 1.00 25.09 N ATOM 1413 CA ILE A 392 25.673 23.950 -16.909 1.00 26.33 C ATOM 1414 C ILE A 392 24.228 23.892 -16.367 1.00 30.95 C ATOM 1415 O ILE A 392 23.301 24.264 -17.088 1.00 30.80 O ATOM 1416 CB ILE A 392 26.219 22.591 -17.443 1.00 29.17 C ATOM 1417 CG1 ILE A 392 27.391 22.860 -18.414 1.00 30.39 C ATOM 1418 CG2 ILE A 392 25.114 21.743 -18.147 1.00 29.63 C ATOM 1419 CD1 ILE A 392 28.460 21.730 -18.523 1.00 39.26 C ATOM 1420 H ILE A 392 27.342 23.932 -15.544 1.00 0.00 H ATOM 1421 N VAL A 393 24.061 23.483 -15.099 1.00 27.08 N ATOM 1422 CA VAL A 393 22.774 23.416 -14.394 1.00 26.78 C ATOM 1423 C VAL A 393 22.125 24.810 -14.291 1.00 29.75 C ATOM 1424 O VAL A 393 20.931 24.948 -14.572 1.00 30.42 O ATOM 1425 CB VAL A 393 22.939 22.697 -13.026 1.00 30.48 C ATOM 1426 CG1 VAL A 393 21.918 23.151 -11.974 1.00 30.35 C ATOM 1427 CG2 VAL A 393 22.895 21.191 -13.211 1.00 30.67 C ATOM 1428 H VAL A 393 24.910 23.190 -14.574 1.00 0.00 H ATOM 1429 N ILE A 394 22.914 25.832 -13.941 1.00 24.91 N ATOM 1430 CA ILE A 394 22.437 27.211 -13.813 1.00 24.82 C ATOM 1431 C ILE A 394 21.988 27.766 -15.178 1.00 31.50 C ATOM 1432 O ILE A 394 20.904 28.343 -15.292 1.00 30.83 O ATOM 1433 CB ILE A 394 23.505 28.110 -13.118 1.00 26.97 C ATOM 1434 CG1 ILE A 394 23.749 27.670 -11.653 1.00 25.07 C ATOM 1435 CG2 ILE A 394 23.128 29.609 -13.202 1.00 29.16 C ATOM 1436 CD1 ILE A 394 25.061 28.196 -11.072 1.00 27.10 C ATOM 1437 H ILE A 394 23.918 25.637 -13.750 1.00 0.00 H ATOM 1438 N LEU A 395 22.811 27.561 -16.214 1.00 29.66 N ATOM 1439 CA LEU A 395 22.527 28.082 -17.550 1.00 30.08 C ATOM 1440 C LEU A 395 21.696 27.124 -18.406 1.00 35.35 C ATOM 1441 O LEU A 395 21.962 26.975 -19.594 1.00 36.03 O ATOM 1442 CB LEU A 395 23.839 28.506 -18.250 1.00 30.17 C ATOM 1443 CG LEU A 395 24.601 29.671 -17.611 1.00 34.54 C ATOM 1444 CD1 LEU A 395 25.958 29.809 -18.216 1.00 34.75 C ATOM 1445 CD2 LEU A 395 23.850 30.991 -17.772 1.00 38.23 C ATOM 1446 H LEU A 395 23.682 27.013 -16.063 1.00 0.00 H ATOM 1447 N SER A 396 20.666 26.512 -17.815 1.00 33.82 N ATOM 1448 CA SER A 396 19.770 25.603 -18.521 1.00 35.43 C ATOM 1449 C SER A 396 18.749 26.403 -19.331 1.00 42.67 C ATOM 1450 O SER A 396 17.976 27.159 -18.736 1.00 41.42 O ATOM 1451 CB SER A 396 19.070 24.662 -17.548 1.00 38.54 C ATOM 1452 OG SER A 396 19.997 23.726 -17.027 1.00 47.92 O ATOM 1453 HG SER A 396 20.719 24.208 -16.552 1.00 0.00 H ATOM 1454 H SER A 396 20.495 26.692 -16.805 1.00 0.00 H ATOM 1455 N PRO A 397 18.755 26.277 -20.686 1.00 43.40 N ATOM 1456 CA PRO A 397 17.803 27.050 -21.515 1.00 45.94 C ATOM 1457 C PRO A 397 16.356 26.606 -21.370 1.00 54.88 C ATOM 1458 O PRO A 397 15.467 27.431 -21.479 1.00 56.27 O ATOM 1459 CB PRO A 397 18.303 26.824 -22.951 1.00 48.27 C ATOM 1460 CG PRO A 397 19.662 26.191 -22.812 1.00 51.04 C ATOM 1461 CD PRO A 397 19.633 25.445 -21.529 1.00 45.11 C ATOM 1462 N ASP A 398 16.126 25.312 -21.117 1.00 55.47 N ATOM 1463 CA ASP A 398 14.803 24.692 -20.970 1.00 57.94 C ATOM 1464 C ASP A 398 14.218 24.811 -19.554 1.00 63.58 C ATOM 1465 O ASP A 398 13.535 23.897 -19.084 1.00 64.35 O ATOM 1466 CB ASP A 398 14.829 23.222 -21.442 1.00 60.90 C ATOM 1467 CG ASP A 398 16.184 22.533 -21.392 1.00 74.99 C ATOM 1468 OD1 ASP A 398 16.620 22.019 -22.438 1.00 76.13 O ATOM 1469 OD2 ASP A 398 16.822 22.537 -20.306 1.00 82.48 O ATOM 1470 H ASP A 398 16.955 24.693 -21.016 1.00 0.00 H ATOM 1471 N ARG A 399 14.480 25.941 -18.882 1.00 60.31 N ATOM 1472 CA ARG A 399 13.964 26.244 -17.543 1.00 59.77 C ATOM 1473 C ARG A 399 12.647 27.007 -17.758 1.00 67.95 C ATOM 1474 O ARG A 399 12.528 27.728 -18.758 1.00 69.42 O ATOM 1475 CB ARG A 399 14.997 27.102 -16.780 1.00 55.94 C ATOM 1476 CG ARG A 399 15.074 26.905 -15.268 1.00 54.00 C ATOM 1477 CD ARG A 399 15.362 25.475 -14.859 1.00 50.42 C ATOM 1478 NE ARG A 399 16.754 25.243 -14.471 1.00 41.81 N ATOM 1479 CZ ARG A 399 17.198 24.088 -13.983 1.00 51.32 C ATOM 1480 NH1 ARG A 399 16.366 23.064 -13.822 1.00 37.49 N ATOM 1481 NH2 ARG A 399 18.473 23.948 -13.645 1.00 32.49 N ATOM 1482 HE ARG A 399 17.433 26.023 -14.583 1.00 0.00 H ATOM 1483 HH12 ARG A 399 16.718 22.163 -13.440 1.00 0.00 H ATOM 1484 HH11 ARG A 399 15.363 23.164 -14.078 1.00 0.00 H ATOM 1485 HH22 ARG A 399 18.814 23.042 -13.264 1.00 0.00 H ATOM 1486 HH21 ARG A 399 19.132 24.744 -13.761 1.00 0.00 H ATOM 1487 H ARG A 399 15.089 26.649 -19.340 1.00 0.00 H ATOM 1488 N GLN A 400 11.642 26.828 -16.874 1.00 65.41 N ATOM 1489 CA GLN A 400 10.359 27.512 -17.080 1.00 67.45 C ATOM 1490 C GLN A 400 10.448 29.021 -16.809 1.00 70.78 C ATOM 1491 O GLN A 400 11.249 29.466 -15.975 1.00 69.85 O ATOM 1492 CB GLN A 400 9.188 26.846 -16.315 1.00 70.18 C ATOM 1493 CG GLN A 400 9.056 27.204 -14.825 1.00 92.24 C ATOM 1494 CD GLN A 400 7.732 26.791 -14.221 1.00118.86 C ATOM 1495 OE1 GLN A 400 6.685 26.755 -14.883 1.00118.87 O ATOM 1496 NE2 GLN A 400 7.741 26.510 -12.927 1.00110.34 N ATOM 1497 HE22 GLN A 400 8.633 26.547 -12.393 1.00 0.00 H ATOM 1498 HE21 GLN A 400 6.856 26.252 -12.445 1.00 0.00 H ATOM 1499 H GLN A 400 11.776 26.208 -16.050 1.00 0.00 H ATOM 1500 N TYR A 401 9.638 29.792 -17.561 1.00 67.55 N ATOM 1501 CA TYR A 401 9.492 31.256 -17.530 1.00 67.71 C ATOM 1502 C TYR A 401 10.605 32.005 -18.304 1.00 67.59 C ATOM 1503 O TYR A 401 10.565 33.238 -18.361 1.00 68.94 O ATOM 1504 CB TYR A 401 9.327 31.825 -16.093 1.00 69.34 C ATOM 1505 CG TYR A 401 8.185 31.271 -15.260 1.00 73.37 C ATOM 1506 CD1 TYR A 401 8.125 31.499 -13.886 1.00 75.34 C ATOM 1507 CD2 TYR A 401 7.136 30.565 -15.851 1.00 75.77 C ATOM 1508 CE1 TYR A 401 7.068 31.012 -13.116 1.00 77.72 C ATOM 1509 CE2 TYR A 401 6.081 30.061 -15.089 1.00 77.64 C ATOM 1510 CZ TYR A 401 6.049 30.292 -13.722 1.00 85.78 C ATOM 1511 OH TYR A 401 5.013 29.802 -12.964 1.00 87.87 O ATOM 1512 HH TYR A 401 5.149 30.058 -12.017 1.00 0.00 H ATOM 1513 H TYR A 401 9.042 29.290 -18.249 1.00 0.00 H ATOM 1514 N ILE A 402 11.567 31.275 -18.922 1.00 59.03 N ATOM 1515 CA ILE A 402 12.638 31.880 -19.728 1.00 56.69 C ATOM 1516 C ILE A 402 12.017 32.390 -21.035 1.00 59.64 C ATOM 1517 O ILE A 402 11.336 31.631 -21.724 1.00 59.21 O ATOM 1518 CB ILE A 402 13.855 30.922 -19.961 1.00 57.73 C ATOM 1519 CG1 ILE A 402 14.782 30.827 -18.723 1.00 56.70 C ATOM 1520 CG2 ILE A 402 14.713 31.362 -21.157 1.00 57.77 C ATOM 1521 CD1 ILE A 402 14.321 30.337 -17.509 1.00 62.61 C ATOM 1522 H ILE A 402 11.546 30.240 -18.821 1.00 0.00 H ATOM 1523 N LYS A 403 12.227 33.685 -21.347 1.00 55.29 N ATOM 1524 CA LYS A 403 11.715 34.338 -22.545 1.00 56.12 C ATOM 1525 C LYS A 403 12.624 34.117 -23.754 1.00 58.73 C ATOM 1526 O LYS A 403 12.134 33.821 -24.848 1.00 60.61 O ATOM 1527 CB LYS A 403 11.504 35.837 -22.292 1.00 60.29 C ATOM 1528 CG LYS A 403 10.296 36.157 -21.416 1.00 75.29 C ATOM 1529 CD LYS A 403 9.711 37.531 -21.719 1.00 91.12 C ATOM 1530 CE LYS A 403 8.792 37.557 -22.935 1.00106.63 C ATOM 1531 NZ LYS A 403 8.862 38.848 -23.672 1.00116.49 N ATOM 1532 HZ1 LYS A 403 8.579 39.623 -23.039 1.00 0.00 H ATOM 1533 HZ2 LYS A 403 9.836 39.005 -24.001 1.00 0.00 H ATOM 1534 HZ3 LYS A 403 8.219 38.815 -24.489 1.00 0.00 H ATOM 1535 H LYS A 403 12.793 34.257 -20.688 1.00 0.00 H ATOM 1536 N ASP A 404 13.939 34.273 -23.566 1.00 52.75 N ATOM 1537 CA ASP A 404 14.925 34.111 -24.633 1.00 52.42 C ATOM 1538 C ASP A 404 15.858 32.907 -24.340 1.00 52.95 C ATOM 1539 O ASP A 404 16.936 33.060 -23.756 1.00 49.97 O ATOM 1540 CB ASP A 404 15.700 35.429 -24.847 1.00 55.15 C ATOM 1541 CG ASP A 404 16.550 35.535 -26.102 1.00 70.59 C ATOM 1542 OD1 ASP A 404 16.979 34.482 -26.626 1.00 71.33 O ATOM 1543 OD2 ASP A 404 16.847 36.675 -26.520 1.00 79.78 O ATOM 1544 H ASP A 404 14.277 34.522 -22.614 1.00 0.00 H ATOM 1545 N ARG A 405 15.427 31.713 -24.776 1.00 48.81 N ATOM 1546 CA ARG A 405 16.145 30.445 -24.610 1.00 46.69 C ATOM 1547 C ARG A 405 17.454 30.410 -25.356 1.00 50.01 C ATOM 1548 O ARG A 405 18.426 29.869 -24.835 1.00 48.27 O ATOM 1549 CB ARG A 405 15.282 29.282 -25.095 1.00 48.36 C ATOM 1550 CG ARG A 405 14.164 28.962 -24.144 1.00 59.39 C ATOM 1551 CD ARG A 405 13.703 27.552 -24.338 1.00 64.36 C ATOM 1552 NE ARG A 405 12.622 27.233 -23.413 1.00 69.43 N ATOM 1553 CZ ARG A 405 12.110 26.021 -23.270 1.00 77.19 C ATOM 1554 NH1 ARG A 405 12.587 25.005 -23.978 1.00 49.60 N ATOM 1555 NH2 ARG A 405 11.124 25.809 -22.409 1.00 69.95 N ATOM 1556 HE ARG A 405 12.231 28.002 -22.832 1.00 0.00 H ATOM 1557 HH12 ARG A 405 12.181 24.054 -23.862 1.00 0.00 H ATOM 1558 HH11 ARG A 405 13.367 25.159 -24.649 1.00 0.00 H ATOM 1559 HH22 ARG A 405 10.725 24.855 -22.300 1.00 0.00 H ATOM 1560 HH21 ARG A 405 10.750 26.597 -21.843 1.00 0.00 H ATOM 1561 H ARG A 405 14.512 31.685 -25.270 1.00 0.00 H ATOM 1562 N GLU A 406 17.471 30.953 -26.593 1.00 48.24 N ATOM 1563 CA GLU A 406 18.649 30.976 -27.467 1.00 47.81 C ATOM 1564 C GLU A 406 19.809 31.788 -26.893 1.00 48.70 C ATOM 1565 O GLU A 406 20.965 31.462 -27.172 1.00 47.38 O ATOM 1566 CB GLU A 406 18.286 31.446 -28.884 1.00 51.62 C ATOM 1567 CG GLU A 406 17.435 30.447 -29.652 1.00 67.70 C ATOM 1568 CD GLU A 406 16.900 30.924 -30.989 1.00105.38 C ATOM 1569 OE1 GLU A 406 17.689 31.468 -31.795 1.00109.31 O ATOM 1570 OE2 GLU A 406 15.692 30.715 -31.246 1.00106.38 O ATOM 1571 H GLU A 406 16.593 31.382 -26.948 1.00 0.00 H ATOM 1572 N ALA A 407 19.505 32.837 -26.099 1.00 44.13 N ATOM 1573 CA ALA A 407 20.523 33.659 -25.450 1.00 42.52 C ATOM 1574 C ALA A 407 21.217 32.830 -24.349 1.00 42.90 C ATOM 1575 O ALA A 407 22.435 32.908 -24.207 1.00 43.07 O ATOM 1576 CB ALA A 407 19.892 34.914 -24.870 1.00 43.82 C ATOM 1577 H ALA A 407 18.503 33.070 -25.943 1.00 0.00 H ATOM 1578 N VAL A 408 20.442 32.001 -23.625 1.00 36.47 N ATOM 1579 CA VAL A 408 20.905 31.115 -22.558 1.00 34.52 C ATOM 1580 C VAL A 408 21.717 29.970 -23.188 1.00 41.29 C ATOM 1581 O VAL A 408 22.789 29.620 -22.681 1.00 40.87 O ATOM 1582 CB VAL A 408 19.742 30.573 -21.673 1.00 36.27 C ATOM 1583 CG1 VAL A 408 20.286 29.863 -20.427 1.00 34.55 C ATOM 1584 CG2 VAL A 408 18.783 31.684 -21.272 1.00 35.94 C ATOM 1585 H VAL A 408 19.425 31.990 -23.844 1.00 0.00 H ATOM 1586 N GLU A 409 21.206 29.418 -24.304 1.00 38.73 N ATOM 1587 CA GLU A 409 21.811 28.352 -25.105 1.00 38.57 C ATOM 1588 C GLU A 409 23.251 28.682 -25.463 1.00 42.12 C ATOM 1589 O GLU A 409 24.136 27.852 -25.250 1.00 41.71 O ATOM 1590 CB GLU A 409 21.018 28.183 -26.402 1.00 41.43 C ATOM 1591 CG GLU A 409 20.206 26.910 -26.491 1.00 51.15 C ATOM 1592 CD GLU A 409 19.134 26.951 -27.567 1.00 70.11 C ATOM 1593 OE1 GLU A 409 17.970 26.618 -27.243 1.00 51.39 O ATOM 1594 OE2 GLU A 409 19.448 27.337 -28.721 1.00 55.91 O ATOM 1595 H GLU A 409 20.289 29.785 -24.630 1.00 0.00 H ATOM 1596 N LYS A 410 23.476 29.903 -25.989 1.00 38.94 N ATOM 1597 CA LYS A 410 24.771 30.457 -26.394 1.00 39.67 C ATOM 1598 C LYS A 410 25.782 30.540 -25.252 1.00 42.42 C ATOM 1599 O LYS A 410 26.983 30.451 -25.503 1.00 41.33 O ATOM 1600 CB LYS A 410 24.590 31.844 -27.031 1.00 44.57 C ATOM 1601 CG LYS A 410 24.063 31.812 -28.463 1.00 63.17 C ATOM 1602 CD LYS A 410 23.606 33.203 -28.900 1.00 79.46 C ATOM 1603 CE LYS A 410 23.150 33.249 -30.340 1.00 95.39 C ATOM 1604 NZ LYS A 410 24.292 33.450 -31.272 1.00105.00 N ATOM 1605 HZ1 LYS A 410 24.766 34.349 -31.049 1.00 0.00 H ATOM 1606 HZ2 LYS A 410 24.966 32.665 -31.166 1.00 0.00 H ATOM 1607 HZ3 LYS A 410 23.939 33.476 -32.250 1.00 0.00 H ATOM 1608 H LYS A 410 22.645 30.514 -26.121 1.00 0.00 H ATOM 1609 N LEU A 411 25.305 30.723 -24.004 1.00 38.94 N ATOM 1610 CA LEU A 411 26.182 30.788 -22.832 1.00 37.43 C ATOM 1611 C LEU A 411 26.518 29.392 -22.286 1.00 40.79 C ATOM 1612 O LEU A 411 27.607 29.199 -21.743 1.00 39.85 O ATOM 1613 CB LEU A 411 25.573 31.670 -21.723 1.00 36.84 C ATOM 1614 CG LEU A 411 25.200 33.125 -22.079 1.00 42.45 C ATOM 1615 CD1 LEU A 411 24.761 33.872 -20.853 1.00 41.69 C ATOM 1616 CD2 LEU A 411 26.356 33.870 -22.772 1.00 46.65 C ATOM 1617 H LEU A 411 24.279 30.821 -23.869 1.00 0.00 H ATOM 1618 N GLN A 412 25.593 28.421 -22.442 1.00 36.95 N ATOM 1619 CA GLN A 412 25.771 27.053 -21.958 1.00 35.25 C ATOM 1620 C GLN A 412 26.658 26.203 -22.879 1.00 42.75 C ATOM 1621 O GLN A 412 27.395 25.343 -22.386 1.00 43.02 O ATOM 1622 CB GLN A 412 24.414 26.386 -21.742 1.00 34.77 C ATOM 1623 CG GLN A 412 24.506 25.063 -20.987 1.00 35.86 C ATOM 1624 CD GLN A 412 23.267 24.207 -21.109 1.00 34.88 C ATOM 1625 OE1 GLN A 412 22.687 24.042 -22.185 1.00 29.64 O ATOM 1626 NE2 GLN A 412 22.823 23.645 -20.015 1.00 20.22 N ATOM 1627 HE22 GLN A 412 23.322 23.793 -19.115 1.00 0.00 H ATOM 1628 HE21 GLN A 412 21.971 23.050 -20.045 1.00 0.00 H ATOM 1629 H GLN A 412 24.707 28.659 -22.932 1.00 0.00 H ATOM 1630 N GLU A 413 26.555 26.417 -24.209 1.00 39.99 N ATOM 1631 CA GLU A 413 27.307 25.664 -25.221 1.00 40.17 C ATOM 1632 C GLU A 413 28.820 25.648 -24.964 1.00 40.75 C ATOM 1633 O GLU A 413 29.349 24.544 -24.878 1.00 39.81 O ATOM 1634 CB GLU A 413 26.972 26.124 -26.654 1.00 43.65 C ATOM 1635 CG GLU A 413 25.624 25.603 -27.132 1.00 58.69 C ATOM 1636 CD GLU A 413 25.234 25.914 -28.562 1.00 80.20 C ATOM 1637 OE1 GLU A 413 25.106 27.114 -28.908 1.00 75.38 O ATOM 1638 OE2 GLU A 413 24.959 24.946 -29.306 1.00 73.66 O ATOM 1639 H GLU A 413 25.904 27.159 -24.536 1.00 0.00 H ATOM 1640 N PRO A 414 29.538 26.788 -24.748 1.00 36.57 N ATOM 1641 CA PRO A 414 30.984 26.695 -24.483 1.00 36.23 C ATOM 1642 C PRO A 414 31.355 25.921 -23.219 1.00 40.10 C ATOM 1643 O PRO A 414 32.431 25.334 -23.182 1.00 41.10 O ATOM 1644 CB PRO A 414 31.428 28.156 -24.392 1.00 37.94 C ATOM 1645 CG PRO A 414 30.207 28.910 -24.069 1.00 41.07 C ATOM 1646 CD PRO A 414 29.113 28.203 -24.792 1.00 37.36 C ATOM 1647 N LEU A 415 30.469 25.898 -22.203 1.00 34.94 N ATOM 1648 CA LEU A 415 30.710 25.162 -20.961 1.00 33.24 C ATOM 1649 C LEU A 415 30.549 23.654 -21.168 1.00 34.22 C ATOM 1650 O LEU A 415 31.365 22.878 -20.670 1.00 33.10 O ATOM 1651 CB LEU A 415 29.839 25.708 -19.816 1.00 32.43 C ATOM 1652 CG LEU A 415 30.041 27.207 -19.474 1.00 36.90 C ATOM 1653 CD1 LEU A 415 28.929 27.733 -18.634 1.00 36.27 C ATOM 1654 CD2 LEU A 415 31.334 27.441 -18.734 1.00 40.19 C ATOM 1655 H LEU A 415 29.578 26.425 -22.306 1.00 0.00 H ATOM 1656 N LEU A 416 29.548 23.253 -21.972 1.00 30.98 N ATOM 1657 CA LEU A 416 29.308 21.859 -22.362 1.00 32.12 C ATOM 1658 C LEU A 416 30.508 21.309 -23.173 1.00 40.04 C ATOM 1659 O LEU A 416 30.919 20.173 -22.942 1.00 41.02 O ATOM 1660 CB LEU A 416 28.003 21.735 -23.189 1.00 32.64 C ATOM 1661 CG LEU A 416 26.668 21.774 -22.422 1.00 35.95 C ATOM 1662 CD1 LEU A 416 25.509 22.047 -23.364 1.00 36.44 C ATOM 1663 CD2 LEU A 416 26.399 20.467 -21.690 1.00 35.37 C ATOM 1664 H LEU A 416 28.901 23.979 -22.342 1.00 0.00 H ATOM 1665 N ASP A 417 31.094 22.124 -24.085 1.00 38.34 N ATOM 1666 CA ASP A 417 32.264 21.728 -24.882 1.00 40.14 C ATOM 1667 C ASP A 417 33.499 21.502 -24.029 1.00 41.45 C ATOM 1668 O ASP A 417 34.230 20.547 -24.278 1.00 42.10 O ATOM 1669 CB ASP A 417 32.581 22.738 -26.003 1.00 44.33 C ATOM 1670 CG ASP A 417 31.589 22.758 -27.131 1.00 62.13 C ATOM 1671 OD1 ASP A 417 30.643 23.547 -27.062 1.00 64.13 O ATOM 1672 OD2 ASP A 417 31.812 22.035 -28.130 1.00 74.78 O ATOM 1673 H ASP A 417 30.697 23.075 -24.227 1.00 0.00 H ATOM 1674 N VAL A 418 33.735 22.369 -23.028 1.00 37.08 N ATOM 1675 CA VAL A 418 34.855 22.243 -22.086 1.00 36.92 C ATOM 1676 C VAL A 418 34.714 20.953 -21.251 1.00 38.49 C ATOM 1677 O VAL A 418 35.683 20.203 -21.128 1.00 38.28 O ATOM 1678 CB VAL A 418 35.042 23.512 -21.210 1.00 40.80 C ATOM 1679 CG1 VAL A 418 36.152 23.318 -20.187 1.00 41.28 C ATOM 1680 CG2 VAL A 418 35.346 24.721 -22.079 1.00 41.66 C ATOM 1681 H VAL A 418 33.087 23.175 -22.915 1.00 0.00 H ATOM 1682 N LEU A 419 33.507 20.685 -20.711 1.00 34.93 N ATOM 1683 CA LEU A 419 33.244 19.467 -19.939 1.00 34.72 C ATOM 1684 C LEU A 419 33.446 18.213 -20.808 1.00 38.96 C ATOM 1685 O LEU A 419 34.059 17.258 -20.340 1.00 39.44 O ATOM 1686 CB LEU A 419 31.836 19.488 -19.294 1.00 33.49 C ATOM 1687 CG LEU A 419 31.429 18.258 -18.445 1.00 38.57 C ATOM 1688 CD1 LEU A 419 32.285 18.128 -17.189 1.00 38.53 C ATOM 1689 CD2 LEU A 419 29.968 18.328 -18.057 1.00 40.00 C ATOM 1690 H LEU A 419 32.735 21.368 -20.848 1.00 0.00 H ATOM 1691 N GLN A 420 32.965 18.233 -22.071 1.00 35.61 N ATOM 1692 CA GLN A 420 33.117 17.102 -22.996 1.00 37.47 C ATOM 1693 C GLN A 420 34.594 16.750 -23.212 1.00 42.92 C ATOM 1694 O GLN A 420 34.964 15.585 -23.045 1.00 42.78 O ATOM 1695 CB GLN A 420 32.374 17.343 -24.322 1.00 39.29 C ATOM 1696 CG GLN A 420 32.306 16.098 -25.199 1.00 47.58 C ATOM 1697 CD GLN A 420 31.298 16.182 -26.313 1.00 62.31 C ATOM 1698 OE1 GLN A 420 30.911 17.258 -26.770 1.00 61.49 O ATOM 1699 NE2 GLN A 420 30.865 15.035 -26.792 1.00 53.55 N ATOM 1700 HE22 GLN A 420 31.208 14.140 -26.388 1.00 0.00 H ATOM 1701 HE21 GLN A 420 30.180 15.024 -27.575 1.00 0.00 H ATOM 1702 H GLN A 420 32.467 19.084 -22.401 1.00 0.00 H ATOM 1703 N LYS A 421 35.435 17.765 -23.502 1.00 41.03 N ATOM 1704 CA LYS A 421 36.886 17.607 -23.659 1.00 43.67 C ATOM 1705 C LYS A 421 37.535 17.012 -22.396 1.00 51.95 C ATOM 1706 O LYS A 421 38.351 16.098 -22.512 1.00 53.51 O ATOM 1707 CB LYS A 421 37.551 18.938 -24.033 1.00 46.16 C ATOM 1708 CG LYS A 421 37.334 19.298 -25.477 1.00 56.68 C ATOM 1709 CD LYS A 421 38.318 20.340 -25.950 1.00 67.05 C ATOM 1710 CE LYS A 421 38.148 20.633 -27.421 1.00 67.91 C ATOM 1711 NZ LYS A 421 39.029 21.743 -27.859 1.00 74.94 N ATOM 1712 HZ1 LYS A 421 38.795 22.602 -27.322 1.00 0.00 H ATOM 1713 HZ2 LYS A 421 40.022 21.485 -27.687 1.00 0.00 H ATOM 1714 HZ3 LYS A 421 38.886 21.917 -28.874 1.00 0.00 H ATOM 1715 H LYS A 421 35.031 18.716 -23.621 1.00 0.00 H ATOM 1716 N LEU A 422 37.136 17.490 -21.200 1.00 49.83 N ATOM 1717 CA LEU A 422 37.649 16.975 -19.928 1.00 51.29 C ATOM 1718 C LEU A 422 37.279 15.520 -19.708 1.00 58.50 C ATOM 1719 O LEU A 422 38.107 14.773 -19.192 1.00 60.69 O ATOM 1720 CB LEU A 422 37.164 17.801 -18.726 1.00 50.13 C ATOM 1721 CG LEU A 422 37.748 19.198 -18.527 1.00 55.47 C ATOM 1722 CD1 LEU A 422 37.304 19.739 -17.177 1.00 54.59 C ATOM 1723 CD2 LEU A 422 39.296 19.204 -18.606 1.00 58.89 C ATOM 1724 H LEU A 422 36.434 18.257 -21.180 1.00 0.00 H ATOM 1725 N CYS A 423 36.044 15.117 -20.089 1.00 54.85 N ATOM 1726 CA CYS A 423 35.572 13.739 -19.953 1.00 55.23 C ATOM 1727 C CYS A 423 36.427 12.785 -20.783 1.00 64.32 C ATOM 1728 O CYS A 423 36.767 11.706 -20.295 1.00 64.95 O ATOM 1729 CB CYS A 423 34.090 13.618 -20.297 1.00 53.72 C ATOM 1730 SG CYS A 423 32.980 14.326 -19.055 1.00 55.30 S ATOM 1731 H CYS A 423 35.399 15.822 -20.499 1.00 0.00 H ATOM 1732 N LYS A 424 36.803 13.200 -22.014 1.00 63.87 N ATOM 1733 CA LYS A 424 37.645 12.427 -22.933 1.00 67.27 C ATOM 1734 C LYS A 424 39.089 12.300 -22.412 1.00 75.36 C ATOM 1735 O LYS A 424 39.717 11.260 -22.602 1.00 77.35 O ATOM 1736 CB LYS A 424 37.650 13.065 -24.337 1.00 70.58 C ATOM 1737 CG LYS A 424 36.357 12.881 -25.122 1.00 82.19 C ATOM 1738 CD LYS A 424 36.275 13.840 -26.305 1.00 92.28 C ATOM 1739 CE LYS A 424 35.006 13.668 -27.106 1.00103.01 C ATOM 1740 NZ LYS A 424 34.795 14.799 -28.051 1.00109.96 N ATOM 1741 HZ1 LYS A 424 34.728 15.688 -27.516 1.00 0.00 H ATOM 1742 HZ2 LYS A 424 35.596 14.851 -28.712 1.00 0.00 H ATOM 1743 HZ3 LYS A 424 33.915 14.645 -28.583 1.00 0.00 H ATOM 1744 H LYS A 424 36.472 14.133 -22.331 1.00 0.00 H ATOM 1745 N ILE A 425 39.610 13.364 -21.774 1.00 72.52 N ATOM 1746 CA ILE A 425 40.967 13.410 -21.221 1.00 73.93 C ATOM 1747 C ILE A 425 41.053 12.589 -19.926 1.00 79.34 C ATOM 1748 O ILE A 425 41.934 11.741 -19.797 1.00 81.19 O ATOM 1749 CB ILE A 425 41.441 14.889 -21.051 1.00 76.26 C ATOM 1750 CG1 ILE A 425 41.701 15.551 -22.425 1.00 76.88 C ATOM 1751 CG2 ILE A 425 42.671 15.017 -20.122 1.00 78.29 C ATOM 1752 CD1 ILE A 425 41.587 17.108 -22.439 1.00 78.43 C ATOM 1753 H ILE A 425 39.012 14.208 -21.666 1.00 0.00 H ATOM 1754 N HIS A 426 40.144 12.852 -18.977 1.00 75.45 N ATOM 1755 CA HIS A 426 40.103 12.193 -17.672 1.00 75.69 C ATOM 1756 C HIS A 426 39.708 10.696 -17.744 1.00 78.65 C ATOM 1757 O HIS A 426 40.256 9.892 -16.982 1.00 79.10 O ATOM 1758 CB HIS A 426 39.204 12.981 -16.692 1.00 74.80 C ATOM 1759 CG HIS A 426 39.303 12.516 -15.275 1.00 78.83 C ATOM 1760 ND1 HIS A 426 40.530 12.401 -14.632 1.00 82.34 N ATOM 1761 CD2 HIS A 426 38.323 12.146 -14.417 1.00 80.20 C ATOM 1762 CE1 HIS A 426 40.258 11.950 -13.418 1.00 81.81 C ATOM 1763 NE2 HIS A 426 38.945 11.780 -13.239 1.00 80.75 N ATOM 1764 H HIS A 426 39.421 13.571 -19.182 1.00 0.00 H ATOM 1765 N GLN A 427 38.779 10.330 -18.653 1.00 73.16 N ATOM 1766 CA GLN A 427 38.305 8.958 -18.828 1.00 73.02 C ATOM 1767 C GLN A 427 38.356 8.541 -20.308 1.00 78.07 C ATOM 1768 O GLN A 427 37.302 8.423 -20.939 1.00 76.85 O ATOM 1769 CB GLN A 427 36.884 8.792 -18.246 1.00 72.49 C ATOM 1770 CG GLN A 427 36.827 8.693 -16.726 1.00 78.80 C ATOM 1771 CD GLN A 427 35.628 7.907 -16.240 1.00 94.53 C ATOM 1772 OE1 GLN A 427 35.107 7.011 -16.916 1.00 86.64 O ATOM 1773 NE2 GLN A 427 35.184 8.190 -15.028 1.00 89.74 N ATOM 1774 HE22 GLN A 427 35.633 8.946 -14.473 1.00 0.00 H ATOM 1775 HE21 GLN A 427 34.385 7.657 -14.629 1.00 0.00 H ATOM 1776 H GLN A 427 38.377 11.068 -19.265 1.00 0.00 H ATOM 1777 N PRO A 428 39.565 8.320 -20.897 1.00 77.17 N ATOM 1778 CA PRO A 428 39.632 7.935 -22.325 1.00 78.59 C ATOM 1779 C PRO A 428 39.124 6.526 -22.619 1.00 84.37 C ATOM 1780 O PRO A 428 38.671 6.264 -23.736 1.00 84.17 O ATOM 1781 CB PRO A 428 41.121 8.082 -22.676 1.00 81.96 C ATOM 1782 CG PRO A 428 41.758 8.760 -21.506 1.00 85.37 C ATOM 1783 CD PRO A 428 40.920 8.418 -20.320 1.00 79.59 C ATOM 1784 N GLU A 429 39.187 5.631 -21.613 1.00 82.31 N ATOM 1785 CA GLU A 429 38.731 4.239 -21.703 1.00 84.04 C ATOM 1786 C GLU A 429 37.197 4.131 -21.819 1.00 85.83 C ATOM 1787 O GLU A 429 36.696 3.179 -22.426 1.00 87.22 O ATOM 1788 CB GLU A 429 39.289 3.386 -20.532 1.00 86.62 C ATOM 1789 CG GLU A 429 38.707 3.665 -19.145 1.00 96.06 C ATOM 1790 CD GLU A 429 39.087 4.956 -18.433 1.00115.93 C ATOM 1791 OE1 GLU A 429 40.212 5.463 -18.649 1.00108.35 O ATOM 1792 OE2 GLU A 429 38.269 5.436 -17.615 1.00107.18 O ATOM 1793 H GLU A 429 39.588 5.950 -20.708 1.00 0.00 H ATOM 1794 N ASN A 430 36.470 5.118 -21.245 1.00 78.02 N ATOM 1795 CA ASN A 430 35.009 5.189 -21.240 1.00 75.52 C ATOM 1796 C ASN A 430 34.492 6.401 -22.053 1.00 75.02 C ATOM 1797 O ASN A 430 34.416 7.512 -21.524 1.00 72.52 O ATOM 1798 CB ASN A 430 34.472 5.195 -19.796 1.00 75.85 C ATOM 1799 CG ASN A 430 32.962 5.174 -19.687 1.00105.01 C ATOM 1800 OD1 ASN A 430 32.252 4.503 -20.451 1.00101.04 O ATOM 1801 ND2 ASN A 430 32.437 5.903 -18.714 1.00 96.10 N ATOM 1802 HD22 ASN A 430 33.055 6.457 -18.087 1.00 0.00 H ATOM 1803 HD21 ASN A 430 31.406 5.922 -18.577 1.00 0.00 H ATOM 1804 H ASN A 430 36.990 5.884 -20.771 1.00 0.00 H ATOM 1805 N PRO A 431 34.109 6.207 -23.333 1.00 70.29 N ATOM 1806 CA PRO A 431 33.620 7.343 -24.135 1.00 68.31 C ATOM 1807 C PRO A 431 32.168 7.740 -23.845 1.00 68.82 C ATOM 1808 O PRO A 431 31.667 8.722 -24.402 1.00 67.80 O ATOM 1809 CB PRO A 431 33.803 6.858 -25.582 1.00 72.35 C ATOM 1810 CG PRO A 431 34.426 5.474 -25.490 1.00 78.85 C ATOM 1811 CD PRO A 431 34.124 4.969 -24.131 1.00 73.75 C ATOM 1812 N GLN A 432 31.502 6.984 -22.960 1.00 63.45 N ATOM 1813 CA GLN A 432 30.118 7.196 -22.538 1.00 60.74 C ATOM 1814 C GLN A 432 30.026 8.232 -21.429 1.00 58.33 C ATOM 1815 O GLN A 432 28.963 8.829 -21.244 1.00 57.38 O ATOM 1816 CB GLN A 432 29.514 5.870 -22.029 1.00 63.43 C ATOM 1817 CG GLN A 432 29.467 4.751 -23.070 1.00 90.62 C ATOM 1818 CD GLN A 432 28.226 4.830 -23.913 1.00116.45 C ATOM 1819 OE1 GLN A 432 28.102 5.678 -24.804 1.00115.09 O ATOM 1820 NE2 GLN A 432 27.271 3.955 -23.639 1.00109.37 N ATOM 1821 HE22 GLN A 432 27.409 3.255 -22.882 1.00 0.00 H ATOM 1822 HE21 GLN A 432 26.383 3.968 -24.180 1.00 0.00 H ATOM 1823 H GLN A 432 32.012 6.181 -22.539 1.00 0.00 H ATOM 1824 N HIS A 433 31.136 8.434 -20.695 1.00 50.52 N ATOM 1825 CA HIS A 433 31.264 9.297 -19.521 1.00 46.59 C ATOM 1826 C HIS A 433 30.564 10.658 -19.621 1.00 43.84 C ATOM 1827 O HIS A 433 29.912 11.056 -18.653 1.00 40.89 O ATOM 1828 CB HIS A 433 32.729 9.485 -19.117 1.00 47.69 C ATOM 1829 CG HIS A 433 32.885 10.101 -17.766 1.00 49.72 C ATOM 1830 ND1 HIS A 433 33.368 11.383 -17.616 1.00 50.43 N ATOM 1831 CD2 HIS A 433 32.561 9.603 -16.547 1.00 50.90 C ATOM 1832 CE1 HIS A 433 33.345 11.617 -16.312 1.00 48.74 C ATOM 1833 NE2 HIS A 433 32.868 10.571 -15.630 1.00 49.45 N ATOM 1834 H HIS A 433 31.991 7.923 -20.994 1.00 0.00 H ATOM 1835 N PHE A 434 30.692 11.364 -20.755 1.00 38.46 N ATOM 1836 CA PHE A 434 30.042 12.670 -20.945 1.00 35.55 C ATOM 1837 C PHE A 434 28.512 12.553 -20.868 1.00 37.90 C ATOM 1838 O PHE A 434 27.890 13.275 -20.095 1.00 35.29 O ATOM 1839 CB PHE A 434 30.475 13.335 -22.275 1.00 36.99 C ATOM 1840 CG PHE A 434 29.875 14.702 -22.520 1.00 35.65 C ATOM 1841 CD1 PHE A 434 30.031 15.726 -21.591 1.00 35.49 C ATOM 1842 CD2 PHE A 434 29.164 14.969 -23.684 1.00 37.44 C ATOM 1843 CE1 PHE A 434 29.472 16.988 -21.812 1.00 35.14 C ATOM 1844 CE2 PHE A 434 28.605 16.240 -23.906 1.00 38.77 C ATOM 1845 CZ PHE A 434 28.769 17.241 -22.970 1.00 34.72 C ATOM 1846 H PHE A 434 31.271 10.974 -21.526 1.00 0.00 H ATOM 1847 N ALA A 435 27.930 11.619 -21.634 1.00 36.54 N ATOM 1848 CA ALA A 435 26.489 11.378 -21.654 1.00 37.43 C ATOM 1849 C ALA A 435 25.983 10.894 -20.280 1.00 42.78 C ATOM 1850 O ALA A 435 24.911 11.313 -19.859 1.00 40.37 O ATOM 1851 CB ALA A 435 26.138 10.385 -22.745 1.00 39.37 C ATOM 1852 H ALA A 435 28.536 11.036 -22.246 1.00 0.00 H ATOM 1853 N CYS A 436 26.782 10.070 -19.569 1.00 43.03 N ATOM 1854 CA CYS A 436 26.463 9.573 -18.224 1.00 44.15 C ATOM 1855 C CYS A 436 26.334 10.744 -17.267 1.00 47.26 C ATOM 1856 O CYS A 436 25.411 10.774 -16.452 1.00 47.47 O ATOM 1857 CB CYS A 436 27.521 8.591 -17.738 1.00 46.12 C ATOM 1858 SG CYS A 436 27.692 7.119 -18.761 1.00 53.20 S ATOM 1859 H CYS A 436 27.679 9.768 -20.000 1.00 0.00 H ATOM 1860 N LEU A 437 27.275 11.706 -17.374 1.00 42.54 N ATOM 1861 CA LEU A 437 27.307 12.939 -16.596 1.00 40.14 C ATOM 1862 C LEU A 437 26.066 13.780 -16.873 1.00 37.38 C ATOM 1863 O LEU A 437 25.435 14.240 -15.931 1.00 35.86 O ATOM 1864 CB LEU A 437 28.581 13.739 -16.920 1.00 41.13 C ATOM 1865 CG LEU A 437 29.569 13.881 -15.786 1.00 47.11 C ATOM 1866 CD1 LEU A 437 30.820 14.555 -16.258 1.00 49.82 C ATOM 1867 CD2 LEU A 437 28.976 14.702 -14.691 1.00 47.12 C ATOM 1868 H LEU A 437 28.037 11.556 -18.066 1.00 0.00 H ATOM 1869 N LEU A 438 25.694 13.941 -18.156 1.00 32.25 N ATOM 1870 CA LEU A 438 24.499 14.687 -18.550 1.00 31.68 C ATOM 1871 C LEU A 438 23.199 14.023 -18.088 1.00 36.58 C ATOM 1872 O LEU A 438 22.228 14.720 -17.786 1.00 34.09 O ATOM 1873 CB LEU A 438 24.467 14.913 -20.060 1.00 31.97 C ATOM 1874 CG LEU A 438 25.573 15.805 -20.630 1.00 35.14 C ATOM 1875 CD1 LEU A 438 25.378 16.001 -22.117 1.00 35.19 C ATOM 1876 CD2 LEU A 438 25.664 17.158 -19.889 1.00 32.76 C ATOM 1877 H LEU A 438 26.282 13.516 -18.901 1.00 0.00 H ATOM 1878 N GLY A 439 23.229 12.687 -18.044 1.00 36.40 N ATOM 1879 CA GLY A 439 22.134 11.829 -17.623 1.00 37.61 C ATOM 1880 C GLY A 439 21.749 12.003 -16.173 1.00 41.50 C ATOM 1881 O GLY A 439 20.584 11.798 -15.823 1.00 41.79 O ATOM 1882 H GLY A 439 24.112 12.222 -18.336 1.00 0.00 H ATOM 1883 N ARG A 440 22.723 12.389 -15.332 1.00 37.93 N ATOM 1884 CA ARG A 440 22.528 12.637 -13.902 1.00 38.27 C ATOM 1885 C ARG A 440 21.735 13.909 -13.651 1.00 44.62 C ATOM 1886 O ARG A 440 21.156 14.054 -12.571 1.00 45.16 O ATOM 1887 CB ARG A 440 23.871 12.690 -13.125 1.00 37.79 C ATOM 1888 CG ARG A 440 24.785 11.454 -13.213 1.00 49.68 C ATOM 1889 CD ARG A 440 24.160 10.083 -12.968 1.00 68.53 C ATOM 1890 NE ARG A 440 23.202 10.085 -11.864 1.00 85.55 N ATOM 1891 CZ ARG A 440 22.117 9.321 -11.811 1.00104.63 C ATOM 1892 NH1 ARG A 440 21.866 8.444 -12.773 1.00 93.68 N ATOM 1893 NH2 ARG A 440 21.290 9.409 -10.782 1.00 93.84 N ATOM 1894 HE ARG A 440 23.382 10.728 -11.067 1.00 0.00 H ATOM 1895 HH12 ARG A 440 21.014 7.849 -12.725 1.00 0.00 H ATOM 1896 HH11 ARG A 440 22.521 8.351 -13.576 1.00 0.00 H ATOM 1897 HH22 ARG A 440 20.441 8.809 -10.744 1.00 0.00 H ATOM 1898 HH21 ARG A 440 21.489 10.078 -10.011 1.00 0.00 H ATOM 1899 H ARG A 440 23.678 12.520 -15.722 1.00 0.00 H ATOM 1900 N LEU A 441 21.700 14.829 -14.640 1.00 41.50 N ATOM 1901 CA LEU A 441 20.944 16.077 -14.521 1.00 41.12 C ATOM 1902 C LEU A 441 19.428 15.854 -14.466 1.00 45.61 C ATOM 1903 O LEU A 441 18.732 16.646 -13.824 1.00 45.35 O ATOM 1904 CB LEU A 441 21.311 17.097 -15.617 1.00 41.08 C ATOM 1905 CG LEU A 441 22.781 17.520 -15.711 1.00 46.01 C ATOM 1906 CD1 LEU A 441 22.955 18.675 -16.682 1.00 46.62 C ATOM 1907 CD2 LEU A 441 23.344 17.892 -14.362 1.00 47.14 C ATOM 1908 H LEU A 441 22.229 14.644 -15.516 1.00 0.00 H ATOM 1909 N THR A 442 18.923 14.773 -15.106 1.00 42.63 N ATOM 1910 CA THR A 442 17.500 14.429 -15.105 1.00 43.04 C ATOM 1911 C THR A 442 17.072 13.933 -13.734 1.00 44.59 C ATOM 1912 O THR A 442 15.985 14.279 -13.285 1.00 43.76 O ATOM 1913 CB THR A 442 17.115 13.482 -16.260 1.00 60.06 C ATOM 1914 OG1 THR A 442 17.975 12.343 -16.274 1.00 68.01 O ATOM 1915 CG2 THR A 442 17.135 14.174 -17.618 1.00 57.74 C ATOM 1916 HG1 THR A 442 18.912 12.640 -16.397 1.00 0.00 H ATOM 1917 H THR A 442 19.580 14.155 -15.625 1.00 0.00 H ATOM 1918 N GLU A 443 17.939 13.185 -13.035 1.00 42.36 N ATOM 1919 CA GLU A 443 17.635 12.733 -11.672 1.00 42.53 C ATOM 1920 C GLU A 443 17.728 13.908 -10.697 1.00 43.77 C ATOM 1921 O GLU A 443 17.027 13.912 -9.688 1.00 43.48 O ATOM 1922 CB GLU A 443 18.507 11.537 -11.236 1.00 44.58 C ATOM 1923 CG GLU A 443 17.969 10.833 -9.990 1.00 52.95 C ATOM 1924 CD GLU A 443 18.521 9.446 -9.735 1.00 74.97 C ATOM 1925 OE1 GLU A 443 18.231 8.530 -10.538 1.00 97.76 O ATOM 1926 OE2 GLU A 443 19.287 9.284 -8.761 1.00 52.01 O ATOM 1927 H GLU A 443 18.846 12.920 -13.468 1.00 0.00 H ATOM 1928 N LEU A 444 18.547 14.927 -11.025 1.00 39.41 N ATOM 1929 CA LEU A 444 18.662 16.138 -10.210 1.00 38.42 C ATOM 1930 C LEU A 444 17.338 16.898 -10.267 1.00 44.18 C ATOM 1931 O LEU A 444 16.837 17.312 -9.227 1.00 43.43 O ATOM 1932 CB LEU A 444 19.800 17.051 -10.695 1.00 37.24 C ATOM 1933 CG LEU A 444 20.871 17.491 -9.685 1.00 40.59 C ATOM 1934 CD1 LEU A 444 21.627 18.713 -10.182 1.00 39.11 C ATOM 1935 CD2 LEU A 444 20.307 17.728 -8.284 1.00 42.09 C ATOM 1936 H LEU A 444 19.119 14.850 -11.890 1.00 0.00 H ATOM 1937 N ARG A 445 16.760 17.040 -11.479 1.00 43.02 N ATOM 1938 CA ARG A 445 15.489 17.728 -11.728 1.00 44.47 C ATOM 1939 C ARG A 445 14.299 17.194 -10.901 1.00 50.60 C ATOM 1940 O ARG A 445 13.427 17.984 -10.551 1.00 50.46 O ATOM 1941 CB ARG A 445 15.142 17.745 -13.228 1.00 45.54 C ATOM 1942 CG ARG A 445 16.069 18.637 -14.043 1.00 51.13 C ATOM 1943 CD ARG A 445 15.498 19.013 -15.388 1.00 52.93 C ATOM 1944 NE ARG A 445 16.407 19.906 -16.114 1.00 61.55 N ATOM 1945 CZ ARG A 445 16.036 21.003 -16.771 1.00 71.29 C ATOM 1946 NH1 ARG A 445 14.757 21.362 -16.813 1.00 62.65 N ATOM 1947 NH2 ARG A 445 16.939 21.744 -17.398 1.00 47.97 N ATOM 1948 HE ARG A 445 17.418 19.664 -16.116 1.00 0.00 H ATOM 1949 HH12 ARG A 445 14.474 22.220 -17.328 1.00 0.00 H ATOM 1950 HH11 ARG A 445 14.039 20.785 -16.331 1.00 0.00 H ATOM 1951 HH22 ARG A 445 16.645 22.600 -17.910 1.00 0.00 H ATOM 1952 HH21 ARG A 445 17.942 21.469 -17.378 1.00 0.00 H ATOM 1953 H ARG A 445 17.253 16.631 -12.298 1.00 0.00 H ATOM 1954 N THR A 446 14.278 15.886 -10.564 1.00 49.59 N ATOM 1955 CA THR A 446 13.210 15.264 -9.753 1.00 51.58 C ATOM 1956 C THR A 446 13.106 15.846 -8.324 1.00 59.64 C ATOM 1957 O THR A 446 12.008 15.869 -7.757 1.00 61.07 O ATOM 1958 CB THR A 446 13.364 13.744 -9.683 1.00 54.00 C ATOM 1959 OG1 THR A 446 14.513 13.436 -8.891 1.00 56.65 O ATOM 1960 CG2 THR A 446 13.396 13.064 -11.066 1.00 44.11 C ATOM 1961 HG1 THR A 446 15.317 13.837 -9.307 1.00 0.00 H ATOM 1962 H THR A 446 15.058 15.282 -10.894 1.00 0.00 H ATOM 1963 N PHE A 447 14.243 16.320 -7.757 1.00 57.00 N ATOM 1964 CA PHE A 447 14.335 16.933 -6.431 1.00 57.53 C ATOM 1965 C PHE A 447 13.585 18.263 -6.303 1.00 64.13 C ATOM 1966 O PHE A 447 13.259 18.669 -5.189 1.00 64.20 O ATOM 1967 CB PHE A 447 15.804 17.086 -6.001 1.00 58.55 C ATOM 1968 CG PHE A 447 16.383 15.790 -5.488 1.00 60.95 C ATOM 1969 CD1 PHE A 447 16.326 15.472 -4.135 1.00 64.47 C ATOM 1970 CD2 PHE A 447 16.913 14.852 -6.367 1.00 63.86 C ATOM 1971 CE1 PHE A 447 16.807 14.249 -3.669 1.00 66.35 C ATOM 1972 CE2 PHE A 447 17.383 13.627 -5.903 1.00 67.68 C ATOM 1973 CZ PHE A 447 17.333 13.336 -4.557 1.00 66.33 C ATOM 1974 H PHE A 447 15.121 16.242 -8.309 1.00 0.00 H ATOM 1975 N ASN A 448 13.304 18.928 -7.427 1.00 62.70 N ATOM 1976 CA ASN A 448 12.556 20.188 -7.455 1.00 64.25 C ATOM 1977 C ASN A 448 11.084 19.991 -7.178 1.00 71.04 C ATOM 1978 O ASN A 448 10.426 20.891 -6.633 1.00 71.14 O ATOM 1979 CB ASN A 448 12.700 20.871 -8.810 1.00 66.03 C ATOM 1980 CG ASN A 448 13.983 21.621 -8.981 1.00 79.24 C ATOM 1981 OD1 ASN A 448 14.659 22.009 -8.019 1.00 71.01 O ATOM 1982 ND2 ASN A 448 14.318 21.860 -10.222 1.00 70.32 N ATOM 1983 HD22 ASN A 448 13.719 21.514 -10.998 1.00 0.00 H ATOM 1984 HD21 ASN A 448 15.184 22.396 -10.433 1.00 0.00 H ATOM 1985 H ASN A 448 13.633 18.531 -8.330 1.00 0.00 H ATOM 1986 N HIS A 449 10.558 18.833 -7.599 1.00 69.01 N ATOM 1987 CA HIS A 449 9.153 18.506 -7.433 1.00 70.64 C ATOM 1988 C HIS A 449 8.841 18.280 -5.958 1.00 72.17 C ATOM 1989 O HIS A 449 7.800 18.740 -5.486 1.00 73.03 O ATOM 1990 CB HIS A 449 8.751 17.280 -8.290 1.00 73.16 C ATOM 1991 CG HIS A 449 9.297 17.275 -9.694 1.00 76.65 C ATOM 1992 ND1 HIS A 449 9.781 16.110 -10.274 1.00 78.68 N ATOM 1993 CD2 HIS A 449 9.418 18.287 -10.589 1.00 78.28 C ATOM 1994 CE1 HIS A 449 10.179 16.450 -11.491 1.00 77.87 C ATOM 1995 NE2 HIS A 449 9.986 17.749 -11.724 1.00 77.95 N ATOM 1996 H HIS A 449 11.180 18.141 -8.063 1.00 0.00 H ATOM 1997 N HIS A 450 9.768 17.638 -5.213 1.00 65.41 N ATOM 1998 CA HIS A 450 9.507 17.329 -3.814 1.00 64.58 C ATOM 1999 C HIS A 450 10.437 17.983 -2.783 1.00 62.72 C ATOM 2000 O HIS A 450 10.502 17.472 -1.666 1.00 62.31 O ATOM 2001 CB HIS A 450 9.468 15.809 -3.608 1.00 66.85 C ATOM 2002 CG HIS A 450 8.275 15.166 -4.245 1.00 72.58 C ATOM 2003 ND1 HIS A 450 8.414 14.175 -5.198 1.00 75.04 N ATOM 2004 CD2 HIS A 450 6.958 15.438 -4.084 1.00 76.29 C ATOM 2005 CE1 HIS A 450 7.184 13.866 -5.575 1.00 76.67 C ATOM 2006 NE2 HIS A 450 6.275 14.601 -4.933 1.00 77.80 N ATOM 2007 H HIS A 450 10.674 17.363 -5.642 1.00 0.00 H ATOM 2008 N HIS A 451 11.074 19.136 -3.087 1.00 55.46 N ATOM 2009 CA HIS A 451 11.900 19.809 -2.065 1.00 53.40 C ATOM 2010 C HIS A 451 11.037 20.411 -0.935 1.00 53.79 C ATOM 2011 O HIS A 451 11.344 20.182 0.235 1.00 53.26 O ATOM 2012 CB HIS A 451 12.893 20.839 -2.642 1.00 53.18 C ATOM 2013 CG HIS A 451 12.263 22.084 -3.163 1.00 57.59 C ATOM 2014 ND1 HIS A 451 11.844 22.189 -4.483 1.00 60.13 N ATOM 2015 CD2 HIS A 451 12.012 23.250 -2.529 1.00 59.84 C ATOM 2016 CE1 HIS A 451 11.337 23.407 -4.605 1.00 60.06 C ATOM 2017 NE2 HIS A 451 11.408 24.082 -3.454 1.00 60.34 N ATOM 2018 H HIS A 451 10.982 19.548 -4.038 1.00 0.00 H ATOM 2019 N ALA A 452 9.945 21.125 -1.286 1.00 47.57 N ATOM 2020 CA ALA A 452 9.036 21.775 -0.332 1.00 47.48 C ATOM 2021 C ALA A 452 8.460 20.804 0.695 1.00 50.52 C ATOM 2022 O ALA A 452 8.471 21.112 1.883 1.00 48.98 O ATOM 2023 CB ALA A 452 7.920 22.496 -1.069 1.00 49.04 C ATOM 2024 H ALA A 452 9.734 21.221 -2.300 1.00 0.00 H ATOM 2025 N GLU A 453 8.055 19.610 0.238 1.00 47.61 N ATOM 2026 CA GLU A 453 7.494 18.541 1.056 1.00 48.89 C ATOM 2027 C GLU A 453 8.567 17.957 1.961 1.00 54.21 C ATOM 2028 O GLU A 453 8.312 17.745 3.146 1.00 55.61 O ATOM 2029 CB GLU A 453 6.882 17.446 0.172 1.00 50.98 C ATOM 2030 CG GLU A 453 5.739 17.924 -0.712 1.00 65.47 C ATOM 2031 CD GLU A 453 6.084 18.345 -2.134 1.00 96.49 C ATOM 2032 OE1 GLU A 453 7.067 19.099 -2.331 1.00 73.23 O ATOM 2033 OE2 GLU A 453 5.319 17.967 -3.050 1.00103.97 O ATOM 2034 H GLU A 453 8.149 19.432 -0.782 1.00 0.00 H ATOM 2035 N MET A 454 9.773 17.728 1.398 1.00 49.28 N ATOM 2036 CA MET A 454 10.970 17.175 2.038 1.00 47.92 C ATOM 2037 C MET A 454 11.334 18.016 3.271 1.00 51.80 C ATOM 2038 O MET A 454 11.731 17.469 4.306 1.00 52.15 O ATOM 2039 CB MET A 454 12.111 17.176 1.008 1.00 48.50 C ATOM 2040 CG MET A 454 13.309 16.359 1.372 1.00 51.80 C ATOM 2041 SD MET A 454 14.379 16.191 -0.078 1.00 54.83 S ATOM 2042 CE MET A 454 15.808 15.405 0.670 1.00 51.28 C ATOM 2043 H MET A 454 9.863 17.973 0.391 1.00 0.00 H ATOM 2044 N LEU A 455 11.136 19.342 3.156 1.00 46.80 N ATOM 2045 CA LEU A 455 11.394 20.326 4.200 1.00 45.51 C ATOM 2046 C LEU A 455 10.267 20.424 5.219 1.00 49.41 C ATOM 2047 O LEU A 455 10.560 20.589 6.397 1.00 49.73 O ATOM 2048 CB LEU A 455 11.659 21.700 3.588 1.00 44.65 C ATOM 2049 CG LEU A 455 12.874 21.787 2.687 1.00 48.06 C ATOM 2050 CD1 LEU A 455 12.656 22.791 1.595 1.00 48.22 C ATOM 2051 CD2 LEU A 455 14.132 22.069 3.489 1.00 48.83 C ATOM 2052 H LEU A 455 10.769 19.693 2.249 1.00 0.00 H ATOM 2053 N MET A 456 8.996 20.353 4.775 1.00 45.86 N ATOM 2054 CA MET A 456 7.822 20.428 5.651 1.00 47.83 C ATOM 2055 C MET A 456 7.619 19.141 6.453 1.00 52.49 C ATOM 2056 O MET A 456 6.994 19.175 7.511 1.00 52.85 O ATOM 2057 CB MET A 456 6.534 20.751 4.850 1.00 51.58 C ATOM 2058 CG MET A 456 6.531 22.120 4.131 1.00 54.96 C ATOM 2059 SD MET A 456 7.025 23.577 5.110 1.00 58.81 S ATOM 2060 CE MET A 456 5.660 23.673 6.294 1.00 58.03 C ATOM 2061 H MET A 456 8.839 20.239 3.753 1.00 0.00 H ATOM 2062 N SER A 457 8.127 18.009 5.934 1.00 49.62 N ATOM 2063 CA SER A 457 8.006 16.684 6.549 1.00 50.56 C ATOM 2064 C SER A 457 9.090 16.418 7.612 1.00 52.37 C ATOM 2065 O SER A 457 8.995 15.424 8.338 1.00 53.42 O ATOM 2066 CB SER A 457 8.003 15.600 5.474 1.00 54.91 C ATOM 2067 OG SER A 457 9.177 15.680 4.680 1.00 64.65 O ATOM 2068 HG SER A 457 9.218 16.567 4.242 1.00 0.00 H ATOM 2069 H SER A 457 8.642 18.079 5.033 1.00 0.00 H ATOM 2070 N TRP A 458 10.097 17.321 7.713 1.00 46.09 N ATOM 2071 CA TRP A 458 11.197 17.263 8.683 1.00 45.25 C ATOM 2072 C TRP A 458 10.596 17.202 10.081 1.00 50.21 C ATOM 2073 O TRP A 458 9.677 17.974 10.368 1.00 49.09 O ATOM 2074 CB TRP A 458 12.091 18.502 8.541 1.00 42.50 C ATOM 2075 CG TRP A 458 13.484 18.341 9.077 1.00 42.82 C ATOM 2076 CD1 TRP A 458 13.870 18.383 10.385 1.00 46.54 C ATOM 2077 CD2 TRP A 458 14.689 18.225 8.306 1.00 40.92 C ATOM 2078 NE1 TRP A 458 15.240 18.265 10.480 1.00 45.08 N ATOM 2079 CE2 TRP A 458 15.767 18.161 9.220 1.00 44.82 C ATOM 2080 CE3 TRP A 458 14.959 18.129 6.930 1.00 40.86 C ATOM 2081 CZ2 TRP A 458 17.092 18.006 8.803 1.00 43.09 C ATOM 2082 CZ3 TRP A 458 16.274 17.978 6.516 1.00 41.49 C ATOM 2083 CH2 TRP A 458 17.324 17.919 7.446 1.00 42.37 C ATOM 2084 HE1 TRP A 458 15.785 18.256 11.365 1.00 0.00 H ATOM 2085 H TRP A 458 10.089 18.121 7.048 1.00 0.00 H ATOM 2086 N ARG A 459 11.057 16.248 10.924 1.00 49.07 N ATOM 2087 CA ARG A 459 10.532 16.011 12.283 1.00 51.15 C ATOM 2088 C ARG A 459 10.847 17.149 13.274 1.00 54.06 C ATOM 2089 O ARG A 459 11.638 16.979 14.199 1.00 54.01 O ATOM 2090 CB ARG A 459 10.993 14.638 12.813 1.00 55.50 C ATOM 2091 CG ARG A 459 10.084 13.475 12.378 1.00 74.72 C ATOM 2092 CD ARG A 459 10.638 12.693 11.195 1.00 87.45 C ATOM 2093 NE ARG A 459 9.585 12.037 10.412 1.00102.33 N ATOM 2094 CZ ARG A 459 9.148 10.796 10.616 1.00123.49 C ATOM 2095 NH1 ARG A 459 9.658 10.055 11.593 1.00114.73 N ATOM 2096 NH2 ARG A 459 8.193 10.288 9.848 1.00111.76 N ATOM 2097 HE ARG A 459 9.148 12.581 9.641 1.00 0.00 H ATOM 2098 HH12 ARG A 459 9.311 9.086 11.746 1.00 0.00 H ATOM 2099 HH11 ARG A 459 10.404 10.443 12.205 1.00 0.00 H ATOM 2100 HH22 ARG A 459 7.855 9.318 10.011 1.00 0.00 H ATOM 2101 HH21 ARG A 459 7.782 10.860 9.082 1.00 0.00 H ATOM 2102 H ARG A 459 11.833 15.641 10.592 1.00 0.00 H ATOM 2103 N VAL A 460 10.190 18.309 13.081 1.00 49.95 N ATOM 2104 CA VAL A 460 10.331 19.538 13.876 1.00 49.18 C ATOM 2105 C VAL A 460 8.916 20.092 14.134 1.00 53.59 C ATOM 2106 O VAL A 460 8.013 19.857 13.320 1.00 52.10 O ATOM 2107 CB VAL A 460 11.312 20.592 13.240 1.00 50.98 C ATOM 2108 CG1 VAL A 460 12.738 20.063 13.193 1.00 49.76 C ATOM 2109 CG2 VAL A 460 10.878 21.016 11.851 1.00 49.74 C ATOM 2110 H VAL A 460 9.515 18.338 12.290 1.00 0.00 H ATOM 2111 N ASN A 461 8.722 20.790 15.266 1.00 51.97 N ATOM 2112 CA ASN A 461 7.419 21.356 15.630 1.00 54.04 C ATOM 2113 C ASN A 461 7.053 22.566 14.766 1.00 58.54 C ATOM 2114 O ASN A 461 5.875 22.757 14.444 1.00 59.02 O ATOM 2115 CB ASN A 461 7.365 21.711 17.122 1.00 54.81 C ATOM 2116 CG ASN A 461 7.575 20.539 18.058 1.00 72.85 C ATOM 2117 OD1 ASN A 461 7.280 19.372 17.734 1.00 67.19 O ATOM 2118 ND2 ASN A 461 8.073 20.836 19.252 1.00 60.50 N ATOM 2119 HD22 ASN A 461 8.307 21.822 19.487 1.00 0.00 H ATOM 2120 HD21 ASN A 461 8.229 20.083 19.952 1.00 0.00 H ATOM 2121 H ASN A 461 9.527 20.934 15.909 1.00 0.00 H ATOM 2122 N ASP A 462 8.063 23.382 14.409 1.00 54.30 N ATOM 2123 CA ASP A 462 7.868 24.551 13.562 1.00 54.87 C ATOM 2124 C ASP A 462 8.968 24.665 12.532 1.00 55.74 C ATOM 2125 O ASP A 462 10.145 24.561 12.869 1.00 55.76 O ATOM 2126 CB ASP A 462 7.657 25.857 14.358 1.00 59.31 C ATOM 2127 CG ASP A 462 8.665 26.127 15.451 1.00 81.66 C ATOM 2128 OD1 ASP A 462 8.308 25.954 16.644 1.00 86.16 O ATOM 2129 OD2 ASP A 462 9.803 26.555 15.121 1.00 89.68 O ATOM 2130 H ASP A 462 9.021 23.169 14.752 1.00 0.00 H ATOM 2131 N HIS A 463 8.572 24.830 11.265 1.00 49.61 N ATOM 2132 CA HIS A 463 9.464 24.945 10.117 1.00 45.87 C ATOM 2133 C HIS A 463 9.688 26.417 9.761 1.00 49.41 C ATOM 2134 O HIS A 463 9.036 26.951 8.861 1.00 49.19 O ATOM 2135 CB HIS A 463 8.913 24.130 8.934 1.00 45.24 C ATOM 2136 CG HIS A 463 8.627 22.705 9.276 1.00 48.43 C ATOM 2137 ND1 HIS A 463 7.595 22.365 10.130 1.00 51.75 N ATOM 2138 CD2 HIS A 463 9.258 21.577 8.883 1.00 48.68 C ATOM 2139 CE1 HIS A 463 7.621 21.047 10.220 1.00 51.32 C ATOM 2140 NE2 HIS A 463 8.608 20.528 9.486 1.00 50.01 N ATOM 2141 H HIS A 463 7.549 24.880 11.085 1.00 0.00 H ATOM 2142 N LYS A 464 10.582 27.081 10.505 1.00 46.72 N ATOM 2143 CA LYS A 464 10.909 28.497 10.298 1.00 47.24 C ATOM 2144 C LYS A 464 12.053 28.643 9.299 1.00 49.17 C ATOM 2145 O LYS A 464 13.134 28.065 9.512 1.00 46.91 O ATOM 2146 CB LYS A 464 11.254 29.208 11.627 1.00 50.86 C ATOM 2147 CG LYS A 464 10.150 29.157 12.693 1.00 74.77 C ATOM 2148 CD LYS A 464 9.065 30.222 12.484 1.00 87.87 C ATOM 2149 CE LYS A 464 7.844 29.978 13.339 1.00100.47 C ATOM 2150 NZ LYS A 464 7.005 28.868 12.806 1.00109.04 N ATOM 2151 HZ1 LYS A 464 6.688 29.106 11.845 1.00 0.00 H ATOM 2152 HZ2 LYS A 464 7.566 27.993 12.781 1.00 0.00 H ATOM 2153 HZ3 LYS A 464 6.178 28.734 13.422 1.00 0.00 H ATOM 2154 H LYS A 464 11.069 26.568 11.267 1.00 0.00 H ATOM 2155 N PHE A 465 11.812 29.394 8.206 1.00 45.41 N ATOM 2156 CA PHE A 465 12.825 29.645 7.171 1.00 44.00 C ATOM 2157 C PHE A 465 13.226 31.114 7.161 1.00 48.92 C ATOM 2158 O PHE A 465 12.602 31.929 7.846 1.00 51.43 O ATOM 2159 CB PHE A 465 12.361 29.206 5.766 1.00 44.52 C ATOM 2160 CG PHE A 465 11.640 27.895 5.676 1.00 45.44 C ATOM 2161 CD1 PHE A 465 12.342 26.700 5.606 1.00 46.55 C ATOM 2162 CD2 PHE A 465 10.257 27.855 5.632 1.00 48.75 C ATOM 2163 CE1 PHE A 465 11.674 25.491 5.492 1.00 47.26 C ATOM 2164 CE2 PHE A 465 9.591 26.644 5.541 1.00 51.46 C ATOM 2165 CZ PHE A 465 10.307 25.479 5.441 1.00 48.34 C ATOM 2166 H PHE A 465 10.868 29.814 8.090 1.00 0.00 H ATOM 2167 N THR A 466 14.255 31.449 6.378 1.00 43.15 N ATOM 2168 CA THR A 466 14.753 32.818 6.249 1.00 43.13 C ATOM 2169 C THR A 466 14.027 33.508 5.076 1.00 47.40 C ATOM 2170 O THR A 466 13.663 32.809 4.122 1.00 46.43 O ATOM 2171 CB THR A 466 16.264 32.799 6.032 1.00 43.93 C ATOM 2172 OG1 THR A 466 16.532 32.187 4.772 1.00 38.42 O ATOM 2173 CG2 THR A 466 17.019 32.076 7.158 1.00 39.98 C ATOM 2174 HG1 THR A 466 17.510 32.168 4.617 1.00 0.00 H ATOM 2175 H THR A 466 14.726 30.699 5.833 1.00 0.00 H ATOM 2176 N PRO A 467 13.841 34.857 5.081 1.00 44.94 N ATOM 2177 CA PRO A 467 13.161 35.508 3.937 1.00 45.01 C ATOM 2178 C PRO A 467 13.768 35.192 2.562 1.00 46.24 C ATOM 2179 O PRO A 467 13.039 35.169 1.568 1.00 45.40 O ATOM 2180 CB PRO A 467 13.227 37.004 4.284 1.00 48.43 C ATOM 2181 CG PRO A 467 13.367 37.047 5.768 1.00 52.87 C ATOM 2182 CD PRO A 467 14.196 35.848 6.125 1.00 47.14 C ATOM 2183 N LEU A 468 15.091 34.910 2.507 1.00 40.75 N ATOM 2184 CA LEU A 468 15.778 34.538 1.270 1.00 37.81 C ATOM 2185 C LEU A 468 15.371 33.126 0.832 1.00 39.77 C ATOM 2186 O LEU A 468 15.158 32.908 -0.361 1.00 38.91 O ATOM 2187 CB LEU A 468 17.316 34.681 1.421 1.00 37.02 C ATOM 2188 CG LEU A 468 18.193 34.494 0.168 1.00 40.71 C ATOM 2189 CD1 LEU A 468 17.808 35.467 -0.962 1.00 42.17 C ATOM 2190 CD2 LEU A 468 19.669 34.617 0.503 1.00 42.61 C ATOM 2191 H LEU A 468 15.645 34.960 3.386 1.00 0.00 H ATOM 2192 N LEU A 469 15.250 32.175 1.781 1.00 36.16 N ATOM 2193 CA LEU A 469 14.833 30.801 1.463 1.00 35.55 C ATOM 2194 C LEU A 469 13.376 30.745 1.026 1.00 39.79 C ATOM 2195 O LEU A 469 13.044 29.948 0.156 1.00 38.66 O ATOM 2196 CB LEU A 469 15.098 29.802 2.620 1.00 35.31 C ATOM 2197 CG LEU A 469 16.565 29.377 2.852 1.00 38.55 C ATOM 2198 CD1 LEU A 469 16.668 28.432 4.037 1.00 38.69 C ATOM 2199 CD2 LEU A 469 17.198 28.740 1.588 1.00 37.75 C ATOM 2200 H LEU A 469 15.458 32.421 2.770 1.00 0.00 H ATOM 2201 N CYS A 470 12.517 31.600 1.602 1.00 38.14 N ATOM 2202 CA CYS A 470 11.103 31.699 1.225 1.00 39.10 C ATOM 2203 C CYS A 470 10.933 32.111 -0.242 1.00 46.83 C ATOM 2204 O CYS A 470 9.997 31.648 -0.896 1.00 49.53 O ATOM 2205 CB CYS A 470 10.358 32.648 2.154 1.00 40.01 C ATOM 2206 SG CYS A 470 9.981 31.953 3.777 1.00 44.37 S ATOM 2207 H CYS A 470 12.872 32.224 2.354 1.00 0.00 H ATOM 2208 N GLU A 471 11.833 32.966 -0.755 1.00 43.30 N ATOM 2209 CA GLU A 471 11.808 33.440 -2.139 1.00 44.10 C ATOM 2210 C GLU A 471 12.286 32.385 -3.121 1.00 50.33 C ATOM 2211 O GLU A 471 11.720 32.251 -4.205 1.00 50.73 O ATOM 2212 CB GLU A 471 12.713 34.669 -2.295 1.00 45.49 C ATOM 2213 CG GLU A 471 12.063 35.988 -1.922 1.00 54.09 C ATOM 2214 CD GLU A 471 12.869 37.215 -2.299 1.00 66.48 C ATOM 2215 OE1 GLU A 471 13.845 37.079 -3.073 1.00 42.03 O ATOM 2216 OE2 GLU A 471 12.499 38.322 -1.845 1.00 68.68 O ATOM 2217 H GLU A 471 12.591 33.311 -0.133 1.00 0.00 H ATOM 2218 N ILE A 472 13.366 31.677 -2.763 1.00 48.06 N ATOM 2219 CA ILE A 472 14.055 30.714 -3.610 1.00 47.49 C ATOM 2220 C ILE A 472 13.402 29.328 -3.596 1.00 51.96 C ATOM 2221 O ILE A 472 13.346 28.684 -4.654 1.00 52.07 O ATOM 2222 CB ILE A 472 15.567 30.719 -3.198 1.00 49.96 C ATOM 2223 CG1 ILE A 472 16.398 31.664 -4.114 1.00 50.65 C ATOM 2224 CG2 ILE A 472 16.214 29.334 -3.065 1.00 48.72 C ATOM 2225 CD1 ILE A 472 16.513 31.293 -5.646 1.00 63.24 C ATOM 2226 H ILE A 472 13.741 31.827 -1.805 1.00 0.00 H ATOM 2227 N TRP A 473 12.889 28.891 -2.428 1.00 48.79 N ATOM 2228 CA TRP A 473 12.272 27.576 -2.235 1.00 49.04 C ATOM 2229 C TRP A 473 10.742 27.511 -2.367 1.00 57.37 C ATOM 2230 O TRP A 473 10.220 26.452 -2.683 1.00 58.04 O ATOM 2231 CB TRP A 473 12.687 27.001 -0.878 1.00 47.08 C ATOM 2232 CG TRP A 473 14.094 26.501 -0.817 1.00 46.74 C ATOM 2233 CD1 TRP A 473 14.995 26.452 -1.836 1.00 48.85 C ATOM 2234 CD2 TRP A 473 14.747 25.941 0.322 1.00 46.50 C ATOM 2235 NE1 TRP A 473 16.177 25.916 -1.398 1.00 47.53 N ATOM 2236 CE2 TRP A 473 16.051 25.580 -0.079 1.00 48.99 C ATOM 2237 CE3 TRP A 473 14.371 25.750 1.668 1.00 48.86 C ATOM 2238 CZ2 TRP A 473 16.960 24.977 0.790 1.00 48.05 C ATOM 2239 CZ3 TRP A 473 15.289 25.193 2.542 1.00 50.26 C ATOM 2240 CH2 TRP A 473 16.562 24.791 2.096 1.00 49.74 C ATOM 2241 HE1 TRP A 473 17.032 25.786 -1.976 1.00 0.00 H ATOM 2242 H TRP A 473 12.934 29.530 -1.609 1.00 0.00 H ATOM 2243 N ASP A 474 10.026 28.609 -2.120 1.00 57.16 N ATOM 2244 CA ASP A 474 8.556 28.636 -2.165 1.00 60.05 C ATOM 2245 C ASP A 474 7.973 27.695 -1.085 1.00 64.38 C ATOM 2246 O ASP A 474 7.381 26.645 -1.358 1.00 63.94 O ATOM 2247 CB ASP A 474 7.978 28.396 -3.585 1.00 63.03 C ATOM 2248 CG ASP A 474 8.607 29.253 -4.673 1.00 75.88 C ATOM 2249 OD1 ASP A 474 8.685 30.499 -4.487 1.00 76.39 O ATOM 2250 OD2 ASP A 474 9.018 28.685 -5.708 1.00 83.79 O ATOM 2251 H ASP A 474 10.531 29.487 -1.885 1.00 0.00 H ATOM 2252 N VAL A 475 8.247 28.087 0.159 1.00 60.85 N ATOM 2253 CA VAL A 475 7.823 27.479 1.415 1.00 64.88 C ATOM 2254 C VAL A 475 7.261 28.618 2.267 1.00 81.96 C ATOM 2255 O VAL A 475 7.411 29.785 1.886 1.00 39.55 O ATOM 2256 CB VAL A 475 8.981 26.737 2.137 1.00 66.64 C ATOM 2257 CG1 VAL A 475 9.134 25.313 1.623 1.00 65.50 C ATOM 2258 CG2 VAL A 475 10.302 27.506 2.048 1.00 65.05 C ATOM 2259 H VAL A 475 8.840 28.937 0.245 1.00 0.00 H TER 2260 VAL A 475 HETATM 2261 O HOH 1 19.462 13.912 14.601 1.00 46.11 O HETATM 2262 O HOH 2 18.627 27.492 -14.335 1.00 35.35 O HETATM 2263 O HOH 3 27.027 27.134 2.966 1.00 22.31 O HETATM 2264 O HOH 4 10.570 36.186 1.560 1.00 44.31 O HETATM 2265 O HOH 5 12.205 26.263 12.979 1.00 55.02 O HETATM 2266 O HOH 6 15.914 11.472 9.647 1.00 40.87 O HETATM 2267 O HOH 7 28.500 37.713 -16.148 1.00 28.65 O HETATM 2268 O HOH 8 33.530 13.396 -23.659 1.00 44.85 O HETATM 2269 O HOH 9 24.869 36.902 -3.134 1.00 44.17 O HETATM 2270 O HOH 10 12.443 29.404 -13.076 1.00 45.84 O HETATM 2271 O HOH 11 35.289 10.046 -21.837 1.00 52.97 O HETATM 2272 O HOH 12 17.758 34.981 -21.976 1.00 46.37 O HETATM 2273 O HOH 13 33.002 13.796 -4.818 1.00 44.20 O HETATM 2274 O HOH 14 36.166 34.454 -11.194 1.00 55.06 O HETATM 2275 O HOH 15 41.614 18.234 -10.374 1.00 47.83 O HETATM 2276 O HOH 16 16.422 23.982 -8.596 1.00 32.16 O HETATM 2277 O HOH 17 23.765 35.113 -25.049 1.00 37.64 O HETATM 2278 O HOH 18 35.228 6.855 5.083 1.00 54.27 O HETATM 2279 O HOH 19 28.669 27.349 -0.862 1.00 60.25 O HETATM 2280 O HOH 20 10.043 23.761 17.082 1.00 72.18 O HETATM 2281 O HOH 21 31.537 11.633 -8.095 1.00 36.33 O HETATM 2282 O HOH 22 45.044 30.591 -22.109 1.00 48.23 O HETATM 2283 O HOH 23 32.777 6.221 -13.673 1.00 48.39 O HETATM 2284 O HOH 24 3.061 18.928 -4.250 1.00 65.61 O HETATM 2285 O HOH 25 36.551 15.681 -6.983 1.00 54.24 O HETATM 2286 O HOH 26 39.546 5.774 10.418 1.00 62.14 O HETATM 2287 O HOH 27 21.868 12.967 13.237 1.00 38.00 O HETATM 2288 O HOH 28 37.928 27.763 -28.030 1.00 54.13 O HETATM 2289 O HOH 29 25.851 43.915 -11.404 1.00 64.28 O HETATM 2290 O HOH 30 11.788 42.213 -19.332 1.00 70.65 O HETATM 2291 O HOH 31 28.911 5.573 -4.966 1.00 45.60 O HETATM 2292 O HOH 32 26.981 25.037 -5.482 1.00 41.19 O HETATM 2293 O HOH 33 11.417 28.710 -21.386 1.00 59.00 O HETATM 2294 O HOH 34 34.339 19.978 -27.007 1.00 46.41 O HETATM 2295 O HOH 35 11.102 13.426 -5.329 1.00 73.12 O HETATM 2296 O HOH 36 13.155 24.077 -11.489 1.00 51.44 O HETATM 2297 O HOH 37 19.739 41.368 -23.422 1.00 46.01 O HETATM 2298 O HOH 38 33.020 10.367 -26.238 1.00 57.87 O HETATM 2299 O HOH 39 6.836 26.712 7.114 1.00 58.79 O HETATM 2300 O HOH 40 21.871 24.070 15.423 1.00 47.92 O HETATM 2301 O HOH 41 21.296 17.802 21.287 1.00 54.93 O HETATM 2302 O HOH 42 23.105 15.293 13.692 1.00 53.34 O HETATM 2303 O HOH 43 35.463 17.721 -5.525 1.00 36.64 O HETATM 2304 O HOH 44 11.372 39.474 -19.683 1.00 46.93 O HETATM 2305 O HOH 45 6.015 26.507 11.505 1.00 48.84 O HETATM 2306 O HOH 46 34.468 25.980 -25.104 1.00 41.44 O HETATM 2307 O HOH 47 29.396 10.523 -23.850 1.00 51.90 O HETATM 2308 O HOH 48 32.797 10.910 -22.912 1.00 41.98 O HETATM 2309 O HOH 49 16.539 38.687 -24.481 1.00 66.77 O HETATM 2310 O HOH 50 27.311 22.687 -6.796 1.00 29.99 O HETATM 2311 O HOH 51 41.447 25.284 -8.538 1.00 51.79 O HETATM 2312 O HOH 52 39.172 31.172 -5.137 1.00 54.38 O HETATM 2313 O HOH 53 31.289 12.406 -25.646 1.00 51.59 O HETATM 2314 O HOH 54 19.836 26.734 -0.862 1.00 45.23 O HETATM 2315 O HOH 55 38.540 16.083 -15.322 1.00 58.72 O HETATM 2316 O HOH 56 30.632 6.910 -16.619 1.00 53.02 O HETATM 2317 O HOH 57 32.788 36.586 -16.816 1.00 49.32 O HETATM 2318 O HOH 58 27.938 22.320 -27.180 1.00 54.86 O HETATM 2319 O HOH 59 23.173 31.925 6.874 1.00 63.92 O HETATM 2320 O HOH 60 37.313 34.861 -26.977 1.00 50.45 O HETATM 2321 O HOH 61 18.326 6.890 -13.068 1.00 56.00 O HETATM 2322 O HOH 62 30.786 32.626 -5.108 1.00 44.67 O HETATM 2323 O HOH 63 5.297 17.128 3.333 1.00 51.47 O HETATM 2324 O HOH 64 16.868 43.337 -19.044 1.00 57.33 O HETATM 2325 O HOH 65 14.673 24.810 14.487 1.00 55.71 O HETATM 2326 O HOH 66 30.673 8.174 1.134 1.00 50.87 O HETATM 2327 O HOH 67 11.555 20.307 -12.541 1.00 46.27 O HETATM 2328 O HOH 68 18.492 37.595 -22.763 1.00 49.05 O HETATM 2329 O HOH 69 32.059 2.198 9.803 1.00 55.42 O HETATM 2330 O HOH 70 33.358 5.022 5.725 1.00 59.71 O HETATM 2331 O HOH 71 33.307 8.176 -5.105 1.00 49.99 O HETATM 2332 O HOH 72 34.363 16.090 3.242 1.00 45.99 O HETATM 2333 O HOH 73 13.190 22.829 -13.986 1.00 44.83 O HETATM 2334 O HOH 74 20.142 21.912 -20.055 1.00 41.78 O HETATM 2335 O HOH 75 30.905 38.119 -18.461 1.00 45.23 O HETATM 2336 O HOH 76 37.585 13.486 -2.798 1.00 46.78 O HETATM 2337 O HOH 77 16.265 14.549 17.804 1.00 50.02 O HETATM 2338 O HOH 78 15.756 25.242 -25.322 1.00 52.10 O HETATM 2339 O HOH 79 18.665 3.913 1.586 1.00 57.94 O HETATM 2340 O HOH 80 22.826 4.096 7.657 1.00 55.72 O HETATM 2341 O HOH 81 7.138 7.587 11.349 1.00 46.65 O HETATM 2342 O HOH 82 34.995 5.102 12.258 1.00 54.37 O HETATM 2343 O HOH 83 12.830 15.172 -13.593 1.00 62.57 O HETATM 2344 O HOH 84 17.409 35.955 4.657 1.00 28.43 O HETATM 2345 O HOH 85 35.677 32.802 -0.028 1.00 57.00 O HETATM 2346 O HOH 86 29.963 26.566 -28.378 1.00 52.85 O HETATM 2347 O HOH 87 45.325 29.913 -19.492 1.00 46.91 O HETATM 2348 O HOH 88 35.022 25.080 -1.833 1.00 55.77 O HETATM 2349 O HOH 89 20.681 38.875 -24.266 1.00 60.04 O HETATM 2350 O HOH 90 10.997 41.420 -22.816 1.00 61.31 O HETATM 2351 O HOH 91 28.378 39.415 -18.487 1.00 55.04 O HETATM 2352 O HOH 92 44.033 31.566 -14.568 1.00 75.74 O HETATM 2353 O HOH 93 33.709 10.564 -6.465 1.00 54.73 O HETATM 2354 O HOH 94 29.152 44.134 -14.577 1.00 56.47 O HETATM 2355 O HOH 95 15.436 30.473 10.667 1.00 46.07 O HETATM 2356 O HOH 96 22.209 4.110 0.477 1.00 54.45 O HETATM 2357 O HOH 97 6.314 26.343 -18.468 1.00 49.67 O HETATM 2358 O HOH 98 29.601 24.115 7.954 1.00 69.05 O HETATM 2359 O HOH 99 28.268 35.563 -0.824 1.00 57.12 O HETATM 2360 O HOH 100 36.991 19.086 -31.297 1.00 52.83 O HETATM 2361 O HOH 101 10.506 4.632 3.860 1.00 62.71 O HETATM 2362 O HOH 102 26.767 24.642 10.370 1.00 51.51 O HETATM 2363 O HOH 103 43.028 12.048 -24.284 1.00 53.40 O HETATM 2364 O HOH 104 35.933 28.591 -24.621 1.00 36.40 O HETATM 2365 O HOH 105 23.234 27.901 12.129 1.00 47.24 O HETATM 2366 O HOH 106 43.742 31.475 -29.124 1.00 59.71 O HETATM 2367 O HOH 107 39.707 7.930 12.534 1.00 75.55 O HETATM 2368 O HOH 108 4.040 32.708 -15.670 1.00 44.51 O HETATM 2369 O HOH 109 22.864 26.348 14.326 1.00 43.81 O HETATM 2370 O HOH 110 35.723 9.628 -25.683 1.00 73.49 O HETATM 2371 O HOH 111 10.823 32.734 -11.719 1.00 48.96 O HETATM 2372 O HOH 112 32.753 27.790 -27.744 1.00 50.77 O HETATM 2373 O HOH 113 36.279 35.324 -29.417 1.00 42.37 O HETATM 2374 O HOH 114 22.114 30.393 12.040 1.00 51.87 O HETATM 2375 O HOH 115 26.294 35.604 -25.911 1.00 45.66 O HETATM 2376 O HOH 116 35.698 38.107 -11.657 1.00 56.67 O HETATM 2377 O HOH 117 16.125 28.569 17.591 1.00 46.89 O HETATM 2378 O HOH 118 16.319 43.040 -11.889 1.00 61.25 O HETATM 2379 O HOH 119 27.900 45.266 -6.665 1.00 63.82 O HETATM 2380 O HOH 120 8.904 35.509 -3.171 1.00 53.58 O HETATM 2381 O HOH 121 20.230 45.821 -6.022 1.00 43.75 O HETATM 2382 O HOH 122 15.140 44.427 -4.950 1.00 39.72 O HETATM 2383 O HOH 123 23.332 40.254 -12.477 1.00 57.95 O HETATM 2384 O HOH 124 6.740 33.513 -6.383 1.00 48.93 O HETATM 2385 O HOH 125 7.177 32.236 -8.902 1.00 55.88 O HETATM 2386 O HOH 126 26.576 38.025 -1.334 1.00 50.68 O HETATM 2387 O HOH 127 17.023 45.794 -6.336 1.00 39.34 O HETATM 2388 O HOH 128 6.875 42.241 -2.680 1.00 52.78 O HETATM 2389 N1 UNN A 129 23.139 18.072 3.553 1.00 -0.22 N HETATM 2390 C4 UNN A 129 24.367 17.445 3.423 1.00 0.08 C HETATM 2391 C5 UNN A 129 24.161 16.398 2.543 1.00 0.03 C HETATM 2392 N3 UNN A 129 22.821 16.370 2.124 1.00 -0.31 N HETATM 2393 C2 UNN A 129 22.251 17.384 2.747 1.00 0.14 C HETATM 2394 C14 UNN A 129 20.822 17.742 2.609 1.00 0.03 C HETATM 2395 C24 UNN A 129 19.813 16.910 3.100 1.00 -0.04 C HETATM 2396 C32 UNN A 129 18.476 17.265 2.969 1.00 -0.04 C HETATM 2397 C30 UNN A 129 18.154 18.459 2.352 1.00 0.04 C HETATM 2398 CL33 UNN A 129 16.482 18.916 2.190 1.00 -0.07 CL HETATM 2399 C31 UNN A 129 19.131 19.304 1.863 1.00 -0.04 C HETATM 2400 C25 UNN A 129 20.461 18.942 1.994 1.00 -0.04 C HETATM 2401 H21 UNN A 129 21.233 19.600 1.613 1.00 0.07 H HETATM 2402 H20 UNN A 129 18.860 20.238 1.383 1.00 0.06 H HETATM 2403 H19 UNN A 129 17.696 16.614 3.346 1.00 0.06 H HETATM 2404 H6 UNN A 129 20.076 15.978 3.588 1.00 0.07 H HETATM 2405 C10 UNN A 129 25.229 15.569 2.207 1.00 -0.03 C HETATM 2406 C15 UNN A 129 26.451 15.845 2.786 1.00 0.15 C HETATM 2407 F27 UNN A 129 27.511 15.068 2.489 1.00 -0.19 F HETATM 2408 C11 UNN A 129 26.625 16.898 3.666 1.00 0.15 C HETATM 2409 C8 UNN A 129 25.594 17.720 4.007 1.00 -0.01 C HETATM 2410 H2 UNN A 129 25.726 18.545 4.698 1.00 0.05 H HETATM 2411 F26 UNN A 129 27.846 17.119 4.203 1.00 -0.19 F HETATM 2412 H3 UNN A 129 25.105 14.741 1.519 1.00 0.05 H HETATM 2413 C7 UNN A 129 22.802 19.283 4.416 1.00 0.16 C HETATM 2414 C6 UNN A 129 23.759 20.458 4.064 1.00 0.24 C HETATM 2415 N9 UNN A 129 24.081 20.551 2.745 1.00 -0.23 N HETATM 2416 C12 UNN A 129 24.944 21.544 2.216 1.00 0.08 C HETATM 2417 C17 UNN A 129 24.464 22.845 1.974 1.00 0.06 C HETATM 2418 CL28 UNN A 129 22.802 23.241 2.304 1.00 -0.08 CL HETATM 2419 C18 UNN A 129 25.287 23.834 1.467 1.00 -0.05 C HETATM 2420 C16 UNN A 129 26.626 23.552 1.189 1.00 -0.00 C HETATM 2421 C13 UNN A 129 27.530 24.634 0.631 1.00 0.05 C HETATM 2422 O20 UNN A 129 27.022 25.822 0.668 1.00 -0.56 O HETATM 2423 O29 UNN A 129 28.653 24.400 0.180 1.00 -0.56 O HETATM 2424 C22 UNN A 129 27.114 22.270 1.427 1.00 -0.06 C HETATM 2425 C21 UNN A 129 26.287 21.272 1.936 1.00 -0.04 C HETATM 2426 H4 UNN A 129 26.686 20.280 2.116 1.00 0.05 H HETATM 2427 H5 UNN A 129 28.153 22.046 1.213 1.00 0.06 H HETATM 2428 H22 UNN A 129 24.893 24.827 1.286 1.00 0.06 H HETATM 2429 H7 UNN A 129 23.687 19.882 2.114 1.00 0.23 H HETATM 2430 O19 UNN A 129 24.177 21.222 4.923 1.00 -0.38 O HETATM 2431 C23 UNN A 129 22.837 18.909 5.922 1.00 0.01 C HETATM 2432 C34 UNN A 129 21.973 19.842 6.768 1.00 -0.05 C HETATM 2433 C37 UNN A 129 22.104 19.520 8.269 1.00 -0.05 C HETATM 2434 C38 UNN A 129 21.709 18.064 8.576 1.00 -0.05 C HETATM 2435 C36 UNN A 129 22.480 17.066 7.692 1.00 -0.05 C HETATM 2436 C35 UNN A 129 22.386 17.457 6.171 1.00 -0.05 C HETATM 2437 H17 UNN A 129 23.029 16.780 5.590 1.00 0.03 H HETATM 2438 H18 UNN A 129 21.343 17.347 5.839 1.00 0.03 H HETATM 2439 H15 UNN A 129 22.054 16.061 7.830 1.00 0.03 H HETATM 2440 H16 UNN A 129 23.537 17.061 7.996 1.00 0.03 H HETATM 2441 H13 UNN A 129 20.631 17.941 8.395 1.00 0.03 H HETATM 2442 H14 UNN A 129 21.930 17.850 9.632 1.00 0.03 H HETATM 2443 H11 UNN A 129 21.447 20.195 8.837 1.00 0.03 H HETATM 2444 H12 UNN A 129 23.148 19.679 8.578 1.00 0.03 H HETATM 2445 H9 UNN A 129 20.921 19.727 6.468 1.00 0.03 H HETATM 2446 H10 UNN A 129 22.292 20.880 6.595 1.00 0.03 H HETATM 2447 H8 UNN A 129 23.879 19.006 6.261 1.00 0.04 H HETATM 2448 H1 UNN A 129 21.777 19.601 4.176 1.00 0.09 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2389 2390 2393 2413 CONECT 2390 2389 2391 2409 CONECT 2391 2390 2392 2405 CONECT 2392 2391 2393 CONECT 2393 2389 2392 2394 CONECT 2394 2393 2395 2400 CONECT 2395 2394 2396 2404 CONECT 2396 2395 2397 2403 CONECT 2397 2396 2398 2399 CONECT 2398 2397 CONECT 2399 2397 2400 2402 CONECT 2400 2394 2399 2401 CONECT 2401 2400 CONECT 2402 2399 CONECT 2403 2396 CONECT 2404 2395 CONECT 2405 2391 2406 2412 CONECT 2406 2405 2407 2408 CONECT 2407 2406 CONECT 2408 2406 2409 2411 CONECT 2409 2390 2408 2410 CONECT 2410 2409 CONECT 2411 2408 CONECT 2412 2405 CONECT 2413 2389 2414 2431 2448 CONECT 2414 2413 2415 2430 CONECT 2415 2414 2416 2429 CONECT 2416 2415 2417 2425 CONECT 2417 2416 2418 2419 CONECT 2418 2417 CONECT 2419 2417 2420 2428 CONECT 2420 2419 2421 2424 CONECT 2421 2420 2422 2423 CONECT 2422 2421 CONECT 2423 2421 CONECT 2424 2420 2425 2427 CONECT 2425 2416 2424 2426 CONECT 2426 2425 CONECT 2427 2424 CONECT 2428 2419 CONECT 2429 2415 CONECT 2430 2414 CONECT 2431 2413 2432 2436 2447 CONECT 2432 2431 2433 2445 2446 CONECT 2433 2432 2434 2443 2444 CONECT 2434 2433 2435 2441 2442 CONECT 2435 2434 2436 2439 2440 CONECT 2436 2431 2435 2437 2438 CONECT 2437 2436 CONECT 2438 2436 CONECT 2439 2435 CONECT 2440 2435 CONECT 2441 2434 CONECT 2442 2434 CONECT 2443 2433 CONECT 2444 2433 CONECT 2445 2432 CONECT 2446 2432 CONECT 2447 2431 CONECT 2448 2413 MASTER 0 0 0 0 0 0 0 0 2447 1 64 18 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5q0n
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bile acid receptor
Ligand Name
9L4
EC.Number
E.C.2.3.1.48
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
IC50=0.0087uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Comput. Aided Mol. Des. Vol. : pp. -
Ligand Properties
Formula
C
2
8
H
2
3
Cl
2
F
2
N
3
O
3
Molecular Weight
558.403
Exact Mass
557.108
No. of atoms
61
No. of bonds
65
Polar Surface Area
84.22
LOGP Value
8.58 (
Computed with XLOGP3
)
7.82 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 5
Canonical SMILES
O=C([C@@H](n1c(nc2c1cc(F)c(c2)F)c1ccc(cc1)Cl)C1CCCCC1)Nc1ccc(cc1Cl)C(=O)O
InChI String
InChI=1S/C28H23Cl2F2N3O3/c29-18-9-6-16(7-10-18)26-33-23-13-20(31)21(32)14-24(23)35(26)25(15-4-2-1-3-5-15)27(36)34-22-11-8-17(28(37)38)12-19(22)30/h6-15,25H,1-5H2,(H,34,36)(H,37,38)/t25-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q96RI1
Q15788
Entrez Gene ID
NCBI Entrez Gene ID:
9971
8648
ASD
Information of known allosteric effects of PDB entries
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