Browse entries in the PDBbind-CN Database
HEADER 5Q0R_COMPLEX COMPND 5Q0R_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 212 MET GLU LEU THR PRO ASP GLN GLN THR LEU LEU HIS PHE SEQRES 2 A 212 ILE MET ASP SER TYR ASN LYS GLN ARG MET PRO GLN GLU SEQRES 3 A 212 ILE THR ASN LYS ILE LEU LYS GLU ALA PHE SER ALA GLU SEQRES 4 A 212 GLU ASN PHE LEU ILE LEU THR GLU MET ALA THR ASN HIS SEQRES 5 A 212 VAL GLN VAL LEU VAL GLU PHE THR LYS LYS LEU PRO GLY SEQRES 6 A 212 PHE GLN THR LEU ASP HIS GLU ASP GLN ILE ALA LEU LEU SEQRES 7 A 212 LYS GLY SER ALA VAL GLU ALA MET PHE LEU ARG SER ALA SEQRES 8 A 212 GLU ILE PHE ASN LYS LYS LEU PRO SER GLY HIS SER ASP SEQRES 9 A 212 LEU LEU GLU ALA ARG ILE ARG ASN SER GLY ILE SER ASP SEQRES 10 A 212 GLU TYR ILE THR PRO MET PHE SER PHE TYR LYS SER ILE SEQRES 11 A 212 GLY GLU LEU LYS MET THR GLN GLU GLU TYR ALA LEU LEU SEQRES 12 A 212 THR ALA ILE VAL ILE LEU SER PRO ASP ARG GLN TYR ILE SEQRES 13 A 212 LYS ASP ARG GLU ALA VAL GLU LYS LEU GLN GLU PRO LEU SEQRES 14 A 212 LEU ASP VAL LEU GLN LYS LEU CYS LYS ILE HIS GLN PRO SEQRES 15 A 212 GLU ASN PRO GLN HIS PHE ALA CYS LEU LEU GLY ARG LEU SEQRES 16 A 212 THR GLU LEU ARG THR PHE ASN HIS HIS HIS ALA GLU MET SEQRES 17 A 212 LEU MET SER TRP SEQRES 1 A 12 HIS LYS PHE THR PRO LEU LEU CYS GLU ILE TRP ASP HET UNN A 330 62 ATOM 1 N MET A 247 11.043 11.319 24.816 1.00 67.47 N ATOM 2 CA MET A 247 11.065 10.673 23.504 1.00 65.09 C ATOM 3 C MET A 247 12.478 10.550 22.922 1.00 62.32 C ATOM 4 O MET A 247 13.345 11.383 23.204 1.00 60.82 O ATOM 5 CB MET A 247 10.096 11.354 22.511 1.00 67.20 C ATOM 6 CG MET A 247 10.464 12.786 22.149 1.00 71.00 C ATOM 7 SD MET A 247 9.144 13.644 21.251 1.00 76.17 S ATOM 8 CE MET A 247 9.418 13.027 19.599 1.00 70.50 C ATOM 9 HN3 MET A 247 11.437 12.278 24.736 1.00 0.00 H ATOM 10 HN2 MET A 247 11.614 10.763 25.484 1.00 0.00 H ATOM 11 HN1 MET A 247 10.062 11.374 25.158 1.00 0.00 H ATOM 12 N GLU A 248 12.708 9.493 22.131 1.00 54.41 N ATOM 13 CA GLU A 248 14.012 9.251 21.510 1.00 51.50 C ATOM 14 C GLU A 248 13.900 8.668 20.108 1.00 49.85 C ATOM 15 O GLU A 248 12.836 8.190 19.703 1.00 49.02 O ATOM 16 CB GLU A 248 14.912 8.367 22.404 1.00 54.43 C ATOM 17 CG GLU A 248 14.321 7.023 22.795 1.00 67.47 C ATOM 18 CD GLU A 248 15.137 6.207 23.781 1.00 93.58 C ATOM 19 OE1 GLU A 248 15.621 6.781 24.785 1.00 81.82 O ATOM 20 OE2 GLU A 248 15.253 4.977 23.572 1.00 94.62 O ATOM 21 H GLU A 248 11.934 8.822 21.952 1.00 0.00 H ATOM 22 N LEU A 249 15.008 8.702 19.376 1.00 42.66 N ATOM 23 CA LEU A 249 15.083 8.117 18.046 1.00 40.82 C ATOM 24 C LEU A 249 15.029 6.600 18.195 1.00 45.32 C ATOM 25 O LEU A 249 15.615 6.054 19.135 1.00 45.23 O ATOM 26 CB LEU A 249 16.414 8.493 17.385 1.00 39.32 C ATOM 27 CG LEU A 249 16.656 9.963 17.011 1.00 41.85 C ATOM 28 CD1 LEU A 249 18.011 10.113 16.389 1.00 40.84 C ATOM 29 CD2 LEU A 249 15.599 10.479 16.053 1.00 42.35 C ATOM 30 H LEU A 249 15.853 9.164 19.768 1.00 0.00 H ATOM 31 N THR A 250 14.332 5.916 17.273 1.00 41.93 N ATOM 32 CA THR A 250 14.288 4.448 17.262 1.00 41.79 C ATOM 33 C THR A 250 15.681 3.937 16.815 1.00 43.92 C ATOM 34 O THR A 250 16.401 4.686 16.144 1.00 40.67 O ATOM 35 CB THR A 250 13.216 3.929 16.272 1.00 47.60 C ATOM 36 OG1 THR A 250 13.614 4.250 14.937 1.00 48.00 O ATOM 37 CG2 THR A 250 11.813 4.461 16.569 1.00 43.96 C ATOM 38 HG1 THR A 250 14.484 3.820 14.741 1.00 0.00 H ATOM 39 H THR A 250 13.808 6.442 16.545 1.00 0.00 H ATOM 40 N PRO A 251 16.064 2.665 17.101 1.00 42.77 N ATOM 41 CA PRO A 251 17.373 2.169 16.617 1.00 42.68 C ATOM 42 C PRO A 251 17.578 2.345 15.107 1.00 44.49 C ATOM 43 O PRO A 251 18.669 2.707 14.691 1.00 43.39 O ATOM 44 CB PRO A 251 17.374 0.700 17.044 1.00 46.26 C ATOM 45 CG PRO A 251 16.479 0.677 18.251 1.00 51.81 C ATOM 46 CD PRO A 251 15.367 1.630 17.892 1.00 45.77 C ATOM 47 N ASP A 252 16.517 2.165 14.308 1.00 41.79 N ATOM 48 CA ASP A 252 16.518 2.355 12.850 1.00 41.45 C ATOM 49 C ASP A 252 16.854 3.819 12.482 1.00 42.45 C ATOM 50 O ASP A 252 17.670 4.061 11.588 1.00 40.62 O ATOM 51 CB ASP A 252 15.153 1.925 12.280 1.00 44.75 C ATOM 52 CG ASP A 252 14.912 2.246 10.820 1.00 63.37 C ATOM 53 OD1 ASP A 252 15.637 1.693 9.962 1.00 65.72 O ATOM 54 OD2 ASP A 252 13.955 3.001 10.531 1.00 72.91 O ATOM 55 H ASP A 252 15.625 1.868 14.753 1.00 0.00 H ATOM 56 N GLN A 253 16.259 4.785 13.203 1.00 37.86 N ATOM 57 CA GLN A 253 16.529 6.217 13.010 1.00 35.22 C ATOM 58 C GLN A 253 17.937 6.592 13.481 1.00 37.72 C ATOM 59 O GLN A 253 18.598 7.394 12.827 1.00 34.60 O ATOM 60 CB GLN A 253 15.469 7.073 13.706 1.00 36.35 C ATOM 61 CG GLN A 253 14.114 7.016 13.013 1.00 38.19 C ATOM 62 CD GLN A 253 13.037 7.735 13.778 1.00 49.40 C ATOM 63 OE1 GLN A 253 12.971 7.698 15.012 1.00 43.04 O ATOM 64 NE2 GLN A 253 12.144 8.378 13.050 1.00 42.50 N ATOM 65 HE22 GLN A 253 12.229 8.389 12.014 1.00 0.00 H ATOM 66 HE21 GLN A 253 11.355 8.873 13.513 1.00 0.00 H ATOM 67 H GLN A 253 15.574 4.505 13.934 1.00 0.00 H ATOM 68 N GLN A 254 18.415 5.971 14.583 1.00 36.42 N ATOM 69 CA GLN A 254 19.761 6.200 15.115 1.00 36.36 C ATOM 70 C GLN A 254 20.818 5.758 14.114 1.00 40.83 C ATOM 71 O GLN A 254 21.822 6.453 13.936 1.00 39.58 O ATOM 72 CB GLN A 254 19.955 5.449 16.430 1.00 39.99 C ATOM 73 CG GLN A 254 19.502 6.219 17.653 1.00 50.71 C ATOM 74 CD GLN A 254 19.798 5.433 18.905 1.00 67.99 C ATOM 75 OE1 GLN A 254 20.963 5.210 19.270 1.00 57.79 O ATOM 76 NE2 GLN A 254 18.744 4.983 19.582 1.00 63.95 N ATOM 77 HE22 GLN A 254 17.782 5.190 19.245 1.00 0.00 H ATOM 78 HE21 GLN A 254 18.882 4.424 20.448 1.00 0.00 H ATOM 79 H GLN A 254 17.796 5.297 15.078 1.00 0.00 H ATOM 80 N THR A 255 20.573 4.608 13.440 1.00 38.36 N ATOM 81 CA THR A 255 21.436 4.022 12.410 1.00 37.71 C ATOM 82 C THR A 255 21.508 4.957 11.195 1.00 39.85 C ATOM 83 O THR A 255 22.607 5.263 10.739 1.00 38.50 O ATOM 84 CB THR A 255 20.921 2.612 12.051 1.00 41.68 C ATOM 85 OG1 THR A 255 20.917 1.832 13.246 1.00 37.60 O ATOM 86 CG2 THR A 255 21.772 1.921 10.997 1.00 42.51 C ATOM 87 HG1 THR A 255 20.322 2.256 13.914 1.00 0.00 H ATOM 88 H THR A 255 19.698 4.097 13.674 1.00 0.00 H ATOM 89 N LEU A 256 20.332 5.393 10.678 1.00 34.50 N ATOM 90 CA LEU A 256 20.229 6.313 9.551 1.00 34.48 C ATOM 91 C LEU A 256 20.989 7.599 9.901 1.00 37.11 C ATOM 92 O LEU A 256 21.794 8.066 9.093 1.00 35.31 O ATOM 93 CB LEU A 256 18.739 6.613 9.250 1.00 35.45 C ATOM 94 CG LEU A 256 18.388 7.707 8.233 1.00 40.69 C ATOM 95 CD1 LEU A 256 18.980 7.417 6.858 1.00 41.49 C ATOM 96 CD2 LEU A 256 16.899 7.827 8.093 1.00 43.98 C ATOM 97 H LEU A 256 19.451 5.051 11.111 1.00 0.00 H ATOM 98 N LEU A 257 20.765 8.146 11.112 1.00 32.86 N ATOM 99 CA LEU A 257 21.470 9.360 11.515 1.00 32.56 C ATOM 100 C LEU A 257 22.984 9.162 11.541 1.00 37.24 C ATOM 101 O LEU A 257 23.701 10.013 11.002 1.00 36.73 O ATOM 102 CB LEU A 257 20.957 9.891 12.855 1.00 33.38 C ATOM 103 CG LEU A 257 21.540 11.235 13.316 1.00 38.26 C ATOM 104 CD1 LEU A 257 21.327 12.339 12.272 1.00 36.01 C ATOM 105 CD2 LEU A 257 20.966 11.627 14.645 1.00 43.26 C ATOM 106 H LEU A 257 20.087 7.701 11.763 1.00 0.00 H ATOM 107 N HIS A 258 23.462 8.041 12.141 1.00 35.21 N ATOM 108 CA HIS A 258 24.887 7.743 12.235 1.00 37.14 C ATOM 109 C HIS A 258 25.571 7.646 10.877 1.00 38.51 C ATOM 110 O HIS A 258 26.697 8.110 10.755 1.00 37.58 O ATOM 111 CB HIS A 258 25.176 6.486 13.070 1.00 41.46 C ATOM 112 CG HIS A 258 26.628 6.359 13.394 1.00 47.17 C ATOM 113 ND1 HIS A 258 27.542 5.917 12.448 1.00 49.89 N ATOM 114 CD2 HIS A 258 27.292 6.686 14.526 1.00 51.09 C ATOM 115 CE1 HIS A 258 28.724 5.991 13.033 1.00 51.10 C ATOM 116 NE2 HIS A 258 28.623 6.425 14.292 1.00 52.08 N ATOM 117 H HIS A 258 22.784 7.367 12.550 1.00 0.00 H ATOM 118 N PHE A 259 24.916 7.020 9.877 1.00 34.61 N ATOM 119 CA PHE A 259 25.455 6.875 8.533 1.00 34.60 C ATOM 120 C PHE A 259 25.623 8.242 7.877 1.00 37.22 C ATOM 121 O PHE A 259 26.665 8.501 7.280 1.00 35.45 O ATOM 122 CB PHE A 259 24.583 5.931 7.686 1.00 37.48 C ATOM 123 CG PHE A 259 25.007 4.481 7.791 1.00 41.27 C ATOM 124 CD1 PHE A 259 24.597 3.693 8.863 1.00 45.72 C ATOM 125 CD2 PHE A 259 25.831 3.906 6.825 1.00 44.34 C ATOM 126 CE1 PHE A 259 24.986 2.346 8.955 1.00 48.87 C ATOM 127 CE2 PHE A 259 26.225 2.562 6.923 1.00 49.61 C ATOM 128 CZ PHE A 259 25.796 1.791 7.984 1.00 48.54 C ATOM 129 H PHE A 259 23.977 6.620 10.077 1.00 0.00 H ATOM 130 N ILE A 260 24.646 9.141 8.071 1.00 34.07 N ATOM 131 CA ILE A 260 24.685 10.516 7.551 1.00 32.42 C ATOM 132 C ILE A 260 25.823 11.309 8.240 1.00 35.79 C ATOM 133 O ILE A 260 26.652 11.922 7.560 1.00 33.05 O ATOM 134 CB ILE A 260 23.313 11.223 7.761 1.00 35.68 C ATOM 135 CG1 ILE A 260 22.126 10.436 7.135 1.00 37.54 C ATOM 136 CG2 ILE A 260 23.336 12.694 7.295 1.00 35.12 C ATOM 137 CD1 ILE A 260 22.044 10.322 5.699 1.00 41.67 C ATOM 138 H ILE A 260 23.813 8.849 8.621 1.00 0.00 H ATOM 139 N MET A 261 25.844 11.294 9.587 1.00 33.69 N ATOM 140 CA MET A 261 26.845 12.007 10.387 1.00 35.09 C ATOM 141 C MET A 261 28.280 11.614 10.107 1.00 39.15 C ATOM 142 O MET A 261 29.152 12.484 10.072 1.00 37.76 O ATOM 143 CB MET A 261 26.547 11.873 11.888 1.00 39.29 C ATOM 144 CG MET A 261 25.375 12.703 12.325 1.00 43.75 C ATOM 145 SD MET A 261 25.489 14.367 11.634 1.00 49.52 S ATOM 146 CE MET A 261 26.778 15.051 12.651 1.00 46.60 C ATOM 147 H MET A 261 25.112 10.748 10.085 1.00 0.00 H ATOM 148 N ASP A 262 28.534 10.305 9.928 1.00 37.29 N ATOM 149 CA ASP A 262 29.871 9.765 9.651 1.00 38.63 C ATOM 150 C ASP A 262 30.389 10.254 8.303 1.00 42.94 C ATOM 151 O ASP A 262 31.552 10.627 8.186 1.00 44.96 O ATOM 152 CB ASP A 262 29.858 8.223 9.693 1.00 42.37 C ATOM 153 CG ASP A 262 31.139 7.600 9.158 1.00 60.15 C ATOM 154 OD1 ASP A 262 32.173 7.668 9.866 1.00 61.69 O ATOM 155 OD2 ASP A 262 31.128 7.116 7.997 1.00 68.03 O ATOM 156 H ASP A 262 27.738 9.638 9.989 1.00 0.00 H ATOM 157 N SER A 263 29.524 10.227 7.294 1.00 38.04 N ATOM 158 CA SER A 263 29.800 10.672 5.932 1.00 37.48 C ATOM 159 C SER A 263 29.939 12.206 5.877 1.00 39.11 C ATOM 160 O SER A 263 30.672 12.705 5.033 1.00 38.13 O ATOM 161 CB SER A 263 28.658 10.228 5.025 1.00 42.71 C ATOM 162 OG SER A 263 28.819 10.659 3.683 1.00 53.50 O ATOM 163 HG SER A 263 28.052 10.344 3.142 1.00 0.00 H ATOM 164 H SER A 263 28.572 9.858 7.492 1.00 0.00 H ATOM 165 N TYR A 264 29.214 12.944 6.743 1.00 33.67 N ATOM 166 CA TYR A 264 29.274 14.417 6.757 1.00 33.73 C ATOM 167 C TYR A 264 30.577 14.935 7.368 1.00 43.61 C ATOM 168 O TYR A 264 31.188 15.842 6.808 1.00 43.02 O ATOM 169 CB TYR A 264 28.080 15.027 7.499 1.00 32.23 C ATOM 170 CG TYR A 264 27.877 16.483 7.150 1.00 32.11 C ATOM 171 CD1 TYR A 264 27.407 16.858 5.893 1.00 32.35 C ATOM 172 CD2 TYR A 264 28.207 17.490 8.050 1.00 33.49 C ATOM 173 CE1 TYR A 264 27.258 18.197 5.545 1.00 32.39 C ATOM 174 CE2 TYR A 264 28.018 18.840 7.726 1.00 34.07 C ATOM 175 CZ TYR A 264 27.558 19.181 6.466 1.00 38.13 C ATOM 176 OH TYR A 264 27.388 20.483 6.086 1.00 40.43 O ATOM 177 HH TYR A 264 27.054 20.513 5.155 1.00 0.00 H ATOM 178 H TYR A 264 28.593 12.459 7.422 1.00 0.00 H ATOM 179 N ASN A 265 30.987 14.362 8.507 1.00 46.28 N ATOM 180 CA ASN A 265 32.204 14.710 9.251 1.00 50.05 C ATOM 181 C ASN A 265 33.529 14.337 8.534 1.00 60.62 C ATOM 182 O ASN A 265 34.600 14.731 9.012 1.00 61.07 O ATOM 183 CB ASN A 265 32.162 14.105 10.671 1.00 52.78 C ATOM 184 CG ASN A 265 31.043 14.612 11.555 1.00 84.93 C ATOM 185 OD1 ASN A 265 30.502 15.711 11.378 1.00 83.84 O ATOM 186 ND2 ASN A 265 30.674 13.814 12.544 1.00 80.53 N ATOM 187 HD22 ASN A 265 31.143 12.895 12.673 1.00 0.00 H ATOM 188 HD21 ASN A 265 29.915 14.106 13.192 1.00 0.00 H ATOM 189 H ASN A 265 30.391 13.605 8.899 1.00 0.00 H ATOM 190 N LYS A 266 33.465 13.591 7.401 1.00 61.34 N ATOM 191 CA LYS A 266 34.659 13.208 6.627 1.00 64.21 C ATOM 192 C LYS A 266 35.291 14.423 5.934 1.00 72.95 C ATOM 193 O LYS A 266 36.499 14.430 5.681 1.00 73.74 O ATOM 194 CB LYS A 266 34.348 12.105 5.588 1.00 66.79 C ATOM 195 CG LYS A 266 34.055 10.716 6.164 1.00 77.64 C ATOM 196 CD LYS A 266 35.268 10.022 6.793 1.00 87.33 C ATOM 197 CE LYS A 266 34.865 8.789 7.566 1.00 97.88 C ATOM 198 NZ LYS A 266 36.029 8.137 8.222 1.00108.62 N ATOM 199 HZ1 LYS A 266 36.720 7.855 7.498 1.00 0.00 H ATOM 200 HZ2 LYS A 266 36.472 8.806 8.884 1.00 0.00 H ATOM 201 HZ3 LYS A 266 35.706 7.295 8.741 1.00 0.00 H ATOM 202 H LYS A 266 32.532 13.276 7.065 1.00 0.00 H ATOM 203 N GLN A 267 34.464 15.446 5.639 1.00 71.42 N ATOM 204 CA GLN A 267 34.853 16.695 4.976 1.00 72.06 C ATOM 205 C GLN A 267 35.899 17.485 5.770 1.00 78.47 C ATOM 206 O GLN A 267 35.913 17.441 7.002 1.00 78.91 O ATOM 207 CB GLN A 267 33.619 17.571 4.716 1.00 72.36 C ATOM 208 CG GLN A 267 32.482 16.827 4.018 1.00 88.80 C ATOM 209 CD GLN A 267 31.132 17.500 4.130 1.00102.99 C ATOM 210 OE1 GLN A 267 30.998 18.667 4.532 1.00 98.68 O ATOM 211 NE2 GLN A 267 30.092 16.763 3.775 1.00 87.23 N ATOM 212 HE22 GLN A 267 30.235 15.788 3.442 1.00 0.00 H ATOM 213 HE21 GLN A 267 29.132 17.159 3.829 1.00 0.00 H ATOM 214 H GLN A 267 33.464 15.340 5.904 1.00 0.00 H ATOM 215 N ARG A 268 36.779 18.193 5.044 1.00 76.20 N ATOM 216 CA ARG A 268 37.858 19.026 5.576 1.00 77.45 C ATOM 217 C ARG A 268 38.311 19.978 4.468 1.00 81.54 C ATOM 218 O ARG A 268 38.431 19.553 3.313 1.00 81.47 O ATOM 219 CB ARG A 268 39.044 18.152 6.033 1.00 79.99 C ATOM 220 CG ARG A 268 40.093 18.893 6.853 1.00 93.30 C ATOM 221 CD ARG A 268 41.355 18.070 7.017 1.00103.93 C ATOM 222 NE ARG A 268 42.496 18.899 7.414 1.00114.12 N ATOM 223 CZ ARG A 268 43.357 19.453 6.566 1.00128.94 C ATOM 224 NH1 ARG A 268 43.220 19.276 5.257 1.00115.85 N ATOM 225 NH2 ARG A 268 44.364 20.188 7.020 1.00117.01 N ATOM 226 HE ARG A 268 42.643 19.066 8.430 1.00 0.00 H ATOM 227 HH12 ARG A 268 43.897 19.712 4.600 1.00 0.00 H ATOM 228 HH11 ARG A 268 42.435 18.701 4.889 1.00 0.00 H ATOM 229 HH22 ARG A 268 45.035 20.619 6.353 1.00 0.00 H ATOM 230 HH21 ARG A 268 44.482 20.333 8.043 1.00 0.00 H ATOM 231 H ARG A 268 36.685 18.145 4.009 1.00 0.00 H ATOM 232 N MET A 269 38.564 21.258 4.815 1.00 77.38 N ATOM 233 CA MET A 269 39.025 22.259 3.852 1.00 76.73 C ATOM 234 C MET A 269 40.516 22.036 3.559 1.00 78.00 C ATOM 235 O MET A 269 41.331 22.085 4.488 1.00 78.86 O ATOM 236 CB MET A 269 38.765 23.689 4.353 1.00 79.72 C ATOM 237 CG MET A 269 38.573 24.696 3.228 1.00 83.78 C ATOM 238 SD MET A 269 38.446 26.418 3.788 1.00 89.57 S ATOM 239 CE MET A 269 36.845 26.393 4.565 1.00 85.45 C ATOM 240 H MET A 269 38.426 21.544 5.805 1.00 0.00 H ATOM 241 N PRO A 270 40.886 21.747 2.286 1.00 71.15 N ATOM 242 CA PRO A 270 42.307 21.504 1.969 1.00 70.97 C ATOM 243 C PRO A 270 43.220 22.651 2.397 1.00 71.65 C ATOM 244 O PRO A 270 42.860 23.816 2.214 1.00 70.28 O ATOM 245 CB PRO A 270 42.301 21.306 0.448 1.00 72.79 C ATOM 246 CG PRO A 270 40.918 20.858 0.131 1.00 76.30 C ATOM 247 CD PRO A 270 40.043 21.626 1.080 1.00 71.24 C ATOM 248 N GLN A 271 44.379 22.308 3.005 1.00 66.84 N ATOM 249 CA GLN A 271 45.392 23.247 3.509 1.00 66.95 C ATOM 250 C GLN A 271 45.871 24.208 2.419 1.00 68.63 C ATOM 251 O GLN A 271 46.116 25.382 2.696 1.00 69.10 O ATOM 252 CB GLN A 271 46.579 22.474 4.128 1.00 70.11 C ATOM 253 CG GLN A 271 47.640 23.329 4.844 1.00 86.75 C ATOM 254 CD GLN A 271 47.106 24.140 6.004 1.00104.84 C ATOM 255 OE1 GLN A 271 46.542 23.610 6.967 1.00100.42 O ATOM 256 NE2 GLN A 271 47.301 25.448 5.946 1.00 97.49 N ATOM 257 HE22 GLN A 271 47.779 25.866 5.123 1.00 0.00 H ATOM 258 HE21 GLN A 271 46.976 26.057 6.724 1.00 0.00 H ATOM 259 H GLN A 271 44.570 21.293 3.126 1.00 0.00 H ATOM 260 N GLU A 272 45.969 23.704 1.184 1.00 63.26 N ATOM 261 CA GLU A 272 46.395 24.422 -0.020 1.00 63.12 C ATOM 262 C GLU A 272 45.506 25.645 -0.282 1.00 62.92 C ATOM 263 O GLU A 272 46.022 26.739 -0.517 1.00 62.58 O ATOM 264 CB GLU A 272 46.383 23.471 -1.230 1.00 64.62 C ATOM 265 CG GLU A 272 47.181 22.189 -1.019 1.00 80.82 C ATOM 266 CD GLU A 272 46.476 21.061 -0.283 1.00105.69 C ATOM 267 OE1 GLU A 272 45.356 20.683 -0.696 1.00101.23 O ATOM 268 OE2 GLU A 272 47.054 20.542 0.699 1.00103.54 O ATOM 269 H GLU A 272 45.718 22.702 1.067 1.00 0.00 H ATOM 270 N ILE A 273 44.175 25.451 -0.203 1.00 56.89 N ATOM 271 CA ILE A 273 43.150 26.483 -0.386 1.00 55.72 C ATOM 272 C ILE A 273 43.232 27.505 0.753 1.00 58.48 C ATOM 273 O ILE A 273 43.204 28.709 0.485 1.00 59.66 O ATOM 274 CB ILE A 273 41.739 25.839 -0.533 1.00 57.55 C ATOM 275 CG1 ILE A 273 41.568 25.191 -1.923 1.00 57.73 C ATOM 276 CG2 ILE A 273 40.613 26.845 -0.251 1.00 58.71 C ATOM 277 CD1 ILE A 273 40.446 24.102 -2.023 1.00 63.10 C ATOM 278 H ILE A 273 43.847 24.487 0.006 1.00 0.00 H ATOM 279 N THR A 274 43.364 27.031 2.011 1.00 52.98 N ATOM 280 CA THR A 274 43.471 27.909 3.180 1.00 53.16 C ATOM 281 C THR A 274 44.733 28.774 3.110 1.00 57.03 C ATOM 282 O THR A 274 44.677 29.954 3.463 1.00 57.75 O ATOM 283 CB THR A 274 43.334 27.136 4.502 1.00 63.92 C ATOM 284 OG1 THR A 274 44.454 26.275 4.676 1.00 70.31 O ATOM 285 CG2 THR A 274 42.038 26.343 4.594 1.00 57.80 C ATOM 286 HG1 THR A 274 44.495 25.633 3.924 1.00 0.00 H ATOM 287 H THR A 274 43.391 26.002 2.156 1.00 0.00 H ATOM 288 N ASN A 275 45.851 28.211 2.601 1.00 52.83 N ATOM 289 CA ASN A 275 47.092 28.964 2.422 1.00 54.79 C ATOM 290 C ASN A 275 46.919 30.053 1.362 1.00 58.54 C ATOM 291 O ASN A 275 47.477 31.133 1.526 1.00 60.41 O ATOM 292 CB ASN A 275 48.282 28.048 2.101 1.00 57.52 C ATOM 293 CG ASN A 275 48.783 27.223 3.275 1.00 83.48 C ATOM 294 OD1 ASN A 275 48.660 27.597 4.452 1.00 76.21 O ATOM 295 ND2 ASN A 275 49.390 26.084 2.977 1.00 76.44 N ATOM 296 HD22 ASN A 275 49.483 25.788 1.984 1.00 0.00 H ATOM 297 HD21 ASN A 275 49.774 25.485 3.736 1.00 0.00 H ATOM 298 H ASN A 275 45.828 27.208 2.327 1.00 0.00 H ATOM 299 N LYS A 276 46.125 29.786 0.307 1.00 53.30 N ATOM 300 CA LYS A 276 45.827 30.759 -0.748 1.00 53.69 C ATOM 301 C LYS A 276 45.031 31.937 -0.175 1.00 57.36 C ATOM 302 O LYS A 276 45.374 33.087 -0.459 1.00 58.79 O ATOM 303 CB LYS A 276 45.089 30.110 -1.927 1.00 55.10 C ATOM 304 CG LYS A 276 46.021 29.376 -2.895 1.00 70.28 C ATOM 305 CD LYS A 276 45.297 28.902 -4.159 1.00 80.57 C ATOM 306 CE LYS A 276 45.428 29.877 -5.307 1.00 95.40 C ATOM 307 NZ LYS A 276 44.585 29.494 -6.468 1.00105.63 N ATOM 308 HZ1 LYS A 276 44.872 28.554 -6.808 1.00 0.00 H ATOM 309 HZ2 LYS A 276 43.587 29.469 -6.177 1.00 0.00 H ATOM 310 HZ3 LYS A 276 44.708 30.192 -7.229 1.00 0.00 H ATOM 311 H LYS A 276 45.701 28.839 0.237 1.00 0.00 H ATOM 312 N ILE A 277 44.031 31.650 0.698 1.00 51.76 N ATOM 313 CA ILE A 277 43.220 32.661 1.401 1.00 51.21 C ATOM 314 C ILE A 277 44.152 33.574 2.178 1.00 57.03 C ATOM 315 O ILE A 277 43.984 34.790 2.131 1.00 58.81 O ATOM 316 CB ILE A 277 42.120 32.012 2.309 1.00 52.28 C ATOM 317 CG1 ILE A 277 41.039 31.332 1.452 1.00 49.65 C ATOM 318 CG2 ILE A 277 41.482 33.052 3.267 1.00 54.48 C ATOM 319 CD1 ILE A 277 40.200 30.251 2.181 1.00 55.21 C ATOM 320 H ILE A 277 43.823 30.648 0.883 1.00 0.00 H ATOM 321 N LEU A 278 45.171 32.999 2.839 1.00 52.59 N ATOM 322 CA LEU A 278 46.136 33.788 3.583 1.00 54.62 C ATOM 323 C LEU A 278 47.119 34.549 2.688 1.00 60.39 C ATOM 324 O LEU A 278 47.253 35.749 2.878 1.00 61.49 O ATOM 325 CB LEU A 278 46.882 32.935 4.638 1.00 55.00 C ATOM 326 CG LEU A 278 48.120 33.567 5.325 1.00 62.16 C ATOM 327 CD1 LEU A 278 47.726 34.501 6.468 1.00 63.67 C ATOM 328 CD2 LEU A 278 49.077 32.503 5.820 1.00 64.38 C ATOM 329 H LEU A 278 45.271 31.964 2.817 1.00 0.00 H ATOM 330 N LYS A 279 47.776 33.867 1.717 1.00 57.38 N ATOM 331 CA LYS A 279 48.877 34.395 0.898 1.00 59.79 C ATOM 332 C LYS A 279 48.564 35.135 -0.418 1.00 63.65 C ATOM 333 O LYS A 279 49.244 36.119 -0.683 1.00 65.31 O ATOM 334 CB LYS A 279 49.875 33.275 0.555 1.00 63.12 C ATOM 335 CG LYS A 279 50.598 32.652 1.755 1.00 77.94 C ATOM 336 CD LYS A 279 51.951 32.009 1.377 1.00 88.65 C ATOM 337 CE LYS A 279 51.880 30.805 0.453 1.00 99.16 C ATOM 338 NZ LYS A 279 51.186 29.644 1.071 1.00108.68 N ATOM 339 HZ1 LYS A 279 51.694 29.355 1.931 1.00 0.00 H ATOM 340 HZ2 LYS A 279 50.212 29.914 1.317 1.00 0.00 H ATOM 341 HZ3 LYS A 279 51.168 28.853 0.396 1.00 0.00 H ATOM 342 H LYS A 279 47.476 32.888 1.537 1.00 0.00 H ATOM 343 N GLU A 280 47.660 34.637 -1.279 1.00 59.03 N ATOM 344 CA GLU A 280 47.414 35.228 -2.611 1.00 59.54 C ATOM 345 C GLU A 280 47.151 36.741 -2.618 1.00 64.52 C ATOM 346 O GLU A 280 46.543 37.252 -1.691 1.00 64.47 O ATOM 347 CB GLU A 280 46.292 34.497 -3.356 1.00 58.92 C ATOM 348 CG GLU A 280 46.605 33.053 -3.726 1.00 71.13 C ATOM 349 CD GLU A 280 47.787 32.751 -4.636 1.00 99.82 C ATOM 350 OE1 GLU A 280 48.164 33.619 -5.456 1.00101.84 O ATOM 351 OE2 GLU A 280 48.311 31.616 -4.553 1.00 92.63 O ATOM 352 H GLU A 280 47.111 33.801 -0.996 1.00 0.00 H ATOM 353 N ALA A 281 47.616 37.458 -3.659 1.00 61.41 N ATOM 354 CA ALA A 281 47.417 38.910 -3.764 1.00 62.46 C ATOM 355 C ALA A 281 45.931 39.303 -3.783 1.00 62.63 C ATOM 356 O ALA A 281 45.094 38.535 -4.255 1.00 60.46 O ATOM 357 CB ALA A 281 48.131 39.461 -4.993 1.00 65.34 C ATOM 358 H ALA A 281 48.134 36.967 -4.415 1.00 0.00 H ATOM 359 N PHE A 282 45.612 40.483 -3.230 1.00 59.82 N ATOM 360 CA PHE A 282 44.254 41.004 -3.154 1.00 59.18 C ATOM 361 C PHE A 282 43.858 41.705 -4.449 1.00 65.64 C ATOM 362 O PHE A 282 43.959 42.929 -4.569 1.00 68.33 O ATOM 363 CB PHE A 282 44.086 41.930 -1.938 1.00 62.24 C ATOM 364 CG PHE A 282 42.659 42.095 -1.480 1.00 63.10 C ATOM 365 CD1 PHE A 282 41.988 41.054 -0.845 1.00 62.75 C ATOM 366 CD2 PHE A 282 41.987 43.297 -1.669 1.00 66.74 C ATOM 367 CE1 PHE A 282 40.668 41.209 -0.421 1.00 63.04 C ATOM 368 CE2 PHE A 282 40.667 43.454 -1.236 1.00 68.85 C ATOM 369 CZ PHE A 282 40.019 42.411 -0.609 1.00 64.35 C ATOM 370 H PHE A 282 46.380 41.060 -2.832 1.00 0.00 H ATOM 371 N SER A 283 43.451 40.908 -5.434 1.00 60.93 N ATOM 372 CA SER A 283 42.986 41.382 -6.739 1.00 62.13 C ATOM 373 C SER A 283 41.703 40.622 -7.055 1.00 62.74 C ATOM 374 O SER A 283 41.511 39.533 -6.518 1.00 57.98 O ATOM 375 CB SER A 283 44.035 41.118 -7.817 1.00 66.28 C ATOM 376 OG SER A 283 44.164 39.731 -8.098 1.00 70.58 O ATOM 377 HG SER A 283 44.851 39.600 -8.799 1.00 0.00 H ATOM 378 H SER A 283 43.464 39.882 -5.266 1.00 0.00 H ATOM 379 N ALA A 284 40.841 41.181 -7.924 1.00 60.98 N ATOM 380 CA ALA A 284 39.579 40.561 -8.334 1.00 59.86 C ATOM 381 C ALA A 284 39.803 39.188 -8.986 1.00 63.17 C ATOM 382 O ALA A 284 39.039 38.261 -8.718 1.00 60.94 O ATOM 383 CB ALA A 284 38.823 41.487 -9.281 1.00 62.97 C ATOM 384 H ALA A 284 41.085 42.108 -8.328 1.00 0.00 H ATOM 385 N GLU A 285 40.873 39.060 -9.807 1.00 61.26 N ATOM 386 CA GLU A 285 41.267 37.832 -10.506 1.00 60.12 C ATOM 387 C GLU A 285 41.714 36.744 -9.530 1.00 60.97 C ATOM 388 O GLU A 285 41.238 35.621 -9.645 1.00 58.80 O ATOM 389 CB GLU A 285 42.377 38.101 -11.539 1.00 63.77 C ATOM 390 CG GLU A 285 41.923 38.864 -12.774 1.00 80.40 C ATOM 391 CD GLU A 285 43.025 39.295 -13.728 1.00109.40 C ATOM 392 OE1 GLU A 285 44.127 39.660 -13.253 1.00105.73 O ATOM 393 OE2 GLU A 285 42.770 39.310 -14.954 1.00106.36 O ATOM 394 H GLU A 285 41.464 39.903 -9.954 1.00 0.00 H ATOM 395 N GLU A 286 42.632 37.064 -8.585 1.00 57.86 N ATOM 396 CA GLU A 286 43.110 36.095 -7.590 1.00 55.91 C ATOM 397 C GLU A 286 41.997 35.686 -6.615 1.00 56.60 C ATOM 398 O GLU A 286 41.947 34.520 -6.215 1.00 53.98 O ATOM 399 CB GLU A 286 44.349 36.596 -6.833 1.00 58.71 C ATOM 400 CG GLU A 286 45.640 36.598 -7.644 1.00 73.80 C ATOM 401 CD GLU A 286 46.259 35.259 -8.018 1.00101.80 C ATOM 402 OE1 GLU A 286 45.899 34.226 -7.407 1.00 97.14 O ATOM 403 OE2 GLU A 286 47.135 35.253 -8.913 1.00101.07 O ATOM 404 H GLU A 286 43.012 38.032 -8.564 1.00 0.00 H ATOM 405 N ASN A 287 41.095 36.631 -6.263 1.00 52.80 N ATOM 406 CA ASN A 287 39.965 36.362 -5.369 1.00 51.05 C ATOM 407 C ASN A 287 38.948 35.426 -6.009 1.00 53.92 C ATOM 408 O ASN A 287 38.510 34.479 -5.352 1.00 50.47 O ATOM 409 CB ASN A 287 39.322 37.662 -4.871 1.00 49.28 C ATOM 410 CG ASN A 287 40.216 38.457 -3.945 1.00 65.30 C ATOM 411 OD1 ASN A 287 41.268 37.987 -3.493 1.00 56.68 O ATOM 412 ND2 ASN A 287 39.849 39.702 -3.678 1.00 57.58 N ATOM 413 HD22 ASN A 287 38.961 40.077 -4.068 1.00 0.00 H ATOM 414 HD21 ASN A 287 40.449 40.304 -3.078 1.00 0.00 H ATOM 415 H ASN A 287 41.209 37.592 -6.644 1.00 0.00 H ATOM 416 N PHE A 288 38.622 35.661 -7.302 1.00 53.41 N ATOM 417 CA PHE A 288 37.694 34.851 -8.102 1.00 53.68 C ATOM 418 C PHE A 288 38.200 33.411 -8.240 1.00 56.96 C ATOM 419 O PHE A 288 37.407 32.473 -8.126 1.00 55.13 O ATOM 420 CB PHE A 288 37.476 35.478 -9.497 1.00 58.25 C ATOM 421 CG PHE A 288 36.322 34.893 -10.281 1.00 60.29 C ATOM 422 CD1 PHE A 288 36.519 33.828 -11.153 1.00 63.52 C ATOM 423 CD2 PHE A 288 35.037 35.404 -10.143 1.00 63.38 C ATOM 424 CE1 PHE A 288 35.450 33.279 -11.866 1.00 64.54 C ATOM 425 CE2 PHE A 288 33.969 34.861 -10.867 1.00 66.42 C ATOM 426 CZ PHE A 288 34.182 33.797 -11.717 1.00 63.90 C ATOM 427 H PHE A 288 39.064 36.480 -7.766 1.00 0.00 H ATOM 428 N LEU A 289 39.516 33.245 -8.477 1.00 53.62 N ATOM 429 CA LEU A 289 40.153 31.940 -8.609 1.00 52.66 C ATOM 430 C LEU A 289 40.097 31.135 -7.309 1.00 53.15 C ATOM 431 O LEU A 289 39.894 29.923 -7.358 1.00 51.54 O ATOM 432 CB LEU A 289 41.591 32.079 -9.133 1.00 54.54 C ATOM 433 CG LEU A 289 41.707 32.373 -10.635 1.00 61.82 C ATOM 434 CD1 LEU A 289 42.999 33.101 -10.960 1.00 63.87 C ATOM 435 CD2 LEU A 289 41.575 31.099 -11.465 1.00 65.02 C ATOM 436 H LEU A 289 40.110 34.094 -8.571 1.00 0.00 H ATOM 437 N ILE A 290 40.217 31.812 -6.150 1.00 49.05 N ATOM 438 CA ILE A 290 40.127 31.171 -4.830 1.00 46.70 C ATOM 439 C ILE A 290 38.723 30.586 -4.632 1.00 47.36 C ATOM 440 O ILE A 290 38.606 29.442 -4.203 1.00 45.94 O ATOM 441 CB ILE A 290 40.595 32.113 -3.678 1.00 49.95 C ATOM 442 CG1 ILE A 290 42.116 32.338 -3.765 1.00 51.13 C ATOM 443 CG2 ILE A 290 40.218 31.548 -2.296 1.00 48.69 C ATOM 444 CD1 ILE A 290 42.647 33.573 -3.045 1.00 58.03 C ATOM 445 H ILE A 290 40.381 32.838 -6.191 1.00 0.00 H ATOM 446 N LEU A 291 37.674 31.341 -5.008 1.00 43.50 N ATOM 447 CA LEU A 291 36.283 30.896 -4.906 1.00 42.40 C ATOM 448 C LEU A 291 36.006 29.698 -5.816 1.00 45.01 C ATOM 449 O LEU A 291 35.318 28.756 -5.411 1.00 42.98 O ATOM 450 CB LEU A 291 35.308 32.051 -5.176 1.00 43.89 C ATOM 451 CG LEU A 291 35.200 33.100 -4.056 1.00 49.34 C ATOM 452 CD1 LEU A 291 34.333 34.274 -4.479 1.00 51.17 C ATOM 453 CD2 LEU A 291 34.652 32.492 -2.786 1.00 49.45 C ATOM 454 H LEU A 291 37.861 32.290 -5.391 1.00 0.00 H ATOM 455 N THR A 292 36.608 29.716 -7.016 1.00 41.63 N ATOM 456 CA THR A 292 36.549 28.663 -8.036 1.00 41.28 C ATOM 457 C THR A 292 37.141 27.362 -7.466 1.00 41.63 C ATOM 458 O THR A 292 36.491 26.324 -7.525 1.00 41.17 O ATOM 459 CB THR A 292 37.256 29.165 -9.324 1.00 49.44 C ATOM 460 OG1 THR A 292 36.616 30.356 -9.756 1.00 52.37 O ATOM 461 CG2 THR A 292 37.196 28.178 -10.448 1.00 46.70 C ATOM 462 HG1 THR A 292 36.683 31.042 -9.045 1.00 0.00 H ATOM 463 H THR A 292 37.172 30.559 -7.245 1.00 0.00 H ATOM 464 N GLU A 293 38.342 27.439 -6.874 1.00 37.47 N ATOM 465 CA GLU A 293 39.003 26.302 -6.245 1.00 37.12 C ATOM 466 C GLU A 293 38.134 25.742 -5.092 1.00 38.99 C ATOM 467 O GLU A 293 38.010 24.524 -4.962 1.00 36.08 O ATOM 468 CB GLU A 293 40.397 26.694 -5.756 1.00 39.74 C ATOM 469 CG GLU A 293 41.421 25.591 -5.972 1.00 56.52 C ATOM 470 CD GLU A 293 42.863 25.957 -5.680 1.00 84.26 C ATOM 471 OE1 GLU A 293 43.544 25.170 -4.983 1.00 84.19 O ATOM 472 OE2 GLU A 293 43.324 27.010 -6.176 1.00 79.58 O ATOM 473 H GLU A 293 38.828 28.359 -6.863 1.00 0.00 H ATOM 474 N MET A 294 37.481 26.639 -4.307 1.00 35.14 N ATOM 475 CA MET A 294 36.598 26.245 -3.198 1.00 33.40 C ATOM 476 C MET A 294 35.338 25.523 -3.695 1.00 35.98 C ATOM 477 O MET A 294 34.962 24.489 -3.135 1.00 33.53 O ATOM 478 CB MET A 294 36.243 27.441 -2.301 1.00 35.44 C ATOM 479 CG MET A 294 37.415 27.950 -1.492 1.00 39.78 C ATOM 480 SD MET A 294 37.058 29.390 -0.428 1.00 44.64 S ATOM 481 CE MET A 294 36.301 28.553 0.979 1.00 39.89 C ATOM 482 H MET A 294 37.612 27.653 -4.499 1.00 0.00 H ATOM 483 N ALA A 295 34.701 26.050 -4.740 1.00 33.74 N ATOM 484 CA ALA A 295 33.500 25.449 -5.314 1.00 33.12 C ATOM 485 C ALA A 295 33.795 24.093 -5.973 1.00 37.41 C ATOM 486 O ALA A 295 32.972 23.187 -5.884 1.00 35.79 O ATOM 487 CB ALA A 295 32.845 26.408 -6.298 1.00 34.95 C ATOM 488 H ALA A 295 35.074 26.924 -5.164 1.00 0.00 H ATOM 489 N THR A 296 34.985 23.943 -6.595 1.00 36.31 N ATOM 490 CA THR A 296 35.428 22.696 -7.239 1.00 36.26 C ATOM 491 C THR A 296 35.677 21.629 -6.169 1.00 40.23 C ATOM 492 O THR A 296 35.246 20.484 -6.335 1.00 40.52 O ATOM 493 CB THR A 296 36.636 22.965 -8.135 1.00 41.77 C ATOM 494 OG1 THR A 296 36.295 24.025 -9.032 1.00 38.04 O ATOM 495 CG2 THR A 296 37.076 21.736 -8.923 1.00 41.52 C ATOM 496 HG1 THR A 296 36.068 24.836 -8.512 1.00 0.00 H ATOM 497 H THR A 296 35.628 24.760 -6.620 1.00 0.00 H ATOM 498 N ASN A 297 36.322 22.012 -5.055 1.00 35.45 N ATOM 499 CA ASN A 297 36.569 21.093 -3.944 1.00 34.78 C ATOM 500 C ASN A 297 35.241 20.607 -3.372 1.00 36.86 C ATOM 501 O ASN A 297 35.091 19.407 -3.127 1.00 36.27 O ATOM 502 CB ASN A 297 37.397 21.751 -2.835 1.00 35.25 C ATOM 503 CG ASN A 297 37.555 20.839 -1.636 1.00 51.53 C ATOM 504 OD1 ASN A 297 38.112 19.745 -1.732 1.00 48.82 O ATOM 505 ND2 ASN A 297 36.970 21.218 -0.510 1.00 44.61 N ATOM 506 HD22 ASN A 297 36.506 22.147 -0.452 1.00 0.00 H ATOM 507 HD21 ASN A 297 36.975 20.587 0.317 1.00 0.00 H ATOM 508 H ASN A 297 36.657 22.994 -4.980 1.00 0.00 H ATOM 509 N HIS A 298 34.288 21.540 -3.168 1.00 31.57 N ATOM 510 CA HIS A 298 32.979 21.203 -2.642 1.00 31.40 C ATOM 511 C HIS A 298 32.201 20.192 -3.507 1.00 35.28 C ATOM 512 O HIS A 298 31.588 19.281 -2.944 1.00 33.51 O ATOM 513 CB HIS A 298 32.134 22.444 -2.361 1.00 31.70 C ATOM 514 CG HIS A 298 30.772 22.102 -1.845 1.00 33.65 C ATOM 515 ND1 HIS A 298 29.663 22.154 -2.662 1.00 35.15 N ATOM 516 CD2 HIS A 298 30.415 21.566 -0.654 1.00 33.94 C ATOM 517 CE1 HIS A 298 28.661 21.704 -1.928 1.00 33.61 C ATOM 518 NE2 HIS A 298 29.065 21.353 -0.711 1.00 33.04 N ATOM 519 H HIS A 298 34.499 22.533 -3.395 1.00 0.00 H ATOM 520 N VAL A 299 32.217 20.339 -4.842 1.00 32.84 N ATOM 521 CA VAL A 299 31.487 19.388 -5.696 1.00 33.69 C ATOM 522 C VAL A 299 32.028 17.946 -5.490 1.00 36.04 C ATOM 523 O VAL A 299 31.240 17.006 -5.400 1.00 34.87 O ATOM 524 CB VAL A 299 31.392 19.795 -7.191 1.00 39.06 C ATOM 525 CG1 VAL A 299 30.549 18.790 -7.975 1.00 40.13 C ATOM 526 CG2 VAL A 299 30.801 21.192 -7.346 1.00 38.81 C ATOM 527 H VAL A 299 32.745 21.125 -5.272 1.00 0.00 H ATOM 528 N GLN A 300 33.358 17.792 -5.367 1.00 32.56 N ATOM 529 CA GLN A 300 33.989 16.497 -5.123 1.00 32.75 C ATOM 530 C GLN A 300 33.542 15.918 -3.764 1.00 34.99 C ATOM 531 O GLN A 300 33.210 14.733 -3.665 1.00 34.49 O ATOM 532 CB GLN A 300 35.520 16.649 -5.167 1.00 35.24 C ATOM 533 CG GLN A 300 36.077 16.823 -6.578 1.00 45.02 C ATOM 534 CD GLN A 300 37.561 17.049 -6.547 1.00 59.94 C ATOM 535 OE1 GLN A 300 38.038 18.140 -6.227 1.00 53.66 O ATOM 536 NE2 GLN A 300 38.320 16.013 -6.859 1.00 53.83 N ATOM 537 HE22 GLN A 300 37.881 15.108 -7.124 1.00 0.00 H ATOM 538 HE21 GLN A 300 39.356 16.103 -6.839 1.00 0.00 H ATOM 539 H GLN A 300 33.965 18.633 -5.449 1.00 0.00 H ATOM 540 N VAL A 301 33.551 16.769 -2.727 1.00 31.10 N ATOM 541 CA VAL A 301 33.141 16.452 -1.356 1.00 31.87 C ATOM 542 C VAL A 301 31.620 16.062 -1.347 1.00 33.66 C ATOM 543 O VAL A 301 31.229 15.084 -0.709 1.00 31.94 O ATOM 544 CB VAL A 301 33.476 17.674 -0.461 1.00 36.97 C ATOM 545 CG1 VAL A 301 32.629 17.716 0.798 1.00 36.88 C ATOM 546 CG2 VAL A 301 34.957 17.700 -0.122 1.00 37.80 C ATOM 547 H VAL A 301 33.878 17.739 -2.912 1.00 0.00 H ATOM 548 N LEU A 302 30.807 16.815 -2.100 1.00 29.56 N ATOM 549 CA LEU A 302 29.369 16.616 -2.268 1.00 28.48 C ATOM 550 C LEU A 302 29.085 15.245 -2.924 1.00 30.01 C ATOM 551 O LEU A 302 28.214 14.542 -2.453 1.00 28.56 O ATOM 552 CB LEU A 302 28.782 17.742 -3.127 1.00 29.02 C ATOM 553 CG LEU A 302 27.296 17.611 -3.478 1.00 35.06 C ATOM 554 CD1 LEU A 302 26.443 17.680 -2.226 1.00 35.04 C ATOM 555 CD2 LEU A 302 26.871 18.709 -4.417 1.00 37.88 C ATOM 556 H LEU A 302 31.238 17.612 -2.610 1.00 0.00 H ATOM 557 N VAL A 303 29.816 14.875 -3.982 1.00 28.42 N ATOM 558 CA VAL A 303 29.623 13.578 -4.652 1.00 29.54 C ATOM 559 C VAL A 303 29.907 12.420 -3.666 1.00 33.28 C ATOM 560 O VAL A 303 29.093 11.510 -3.543 1.00 32.81 O ATOM 561 CB VAL A 303 30.381 13.443 -6.008 1.00 35.02 C ATOM 562 CG1 VAL A 303 30.234 12.033 -6.593 1.00 36.35 C ATOM 563 CG2 VAL A 303 29.890 14.475 -7.020 1.00 35.26 C ATOM 564 H VAL A 303 30.544 15.524 -4.343 1.00 0.00 H ATOM 565 N GLU A 304 31.017 12.495 -2.924 1.00 31.27 N ATOM 566 CA GLU A 304 31.424 11.476 -1.946 1.00 31.48 C ATOM 567 C GLU A 304 30.403 11.314 -0.822 1.00 33.34 C ATOM 568 O GLU A 304 30.018 10.190 -0.495 1.00 34.15 O ATOM 569 CB GLU A 304 32.835 11.784 -1.397 1.00 33.29 C ATOM 570 CG GLU A 304 33.947 11.389 -2.355 1.00 48.47 C ATOM 571 CD GLU A 304 33.810 10.002 -2.963 1.00 77.24 C ATOM 572 OE1 GLU A 304 33.845 9.011 -2.198 1.00 70.94 O ATOM 573 OE2 GLU A 304 33.607 9.911 -4.196 1.00 74.42 O ATOM 574 H GLU A 304 31.630 13.326 -3.047 1.00 0.00 H ATOM 575 N PHE A 305 29.883 12.434 -0.316 1.00 27.16 N ATOM 576 CA PHE A 305 28.850 12.441 0.717 1.00 26.14 C ATOM 577 C PHE A 305 27.568 11.802 0.197 1.00 30.96 C ATOM 578 O PHE A 305 27.006 10.942 0.874 1.00 32.05 O ATOM 579 CB PHE A 305 28.575 13.880 1.200 1.00 26.80 C ATOM 580 CG PHE A 305 27.408 14.018 2.148 1.00 28.20 C ATOM 581 CD1 PHE A 305 27.456 13.469 3.426 1.00 30.74 C ATOM 582 CD2 PHE A 305 26.269 14.734 1.777 1.00 29.23 C ATOM 583 CE1 PHE A 305 26.373 13.607 4.309 1.00 31.15 C ATOM 584 CE2 PHE A 305 25.190 14.873 2.657 1.00 31.32 C ATOM 585 CZ PHE A 305 25.256 14.326 3.924 1.00 29.80 C ATOM 586 H PHE A 305 30.230 13.346 -0.675 1.00 0.00 H ATOM 587 N THR A 306 27.128 12.203 -1.009 1.00 27.50 N ATOM 588 CA THR A 306 25.901 11.724 -1.666 1.00 29.05 C ATOM 589 C THR A 306 25.891 10.210 -1.872 1.00 35.09 C ATOM 590 O THR A 306 24.882 9.577 -1.572 1.00 34.40 O ATOM 591 CB THR A 306 25.673 12.504 -2.985 1.00 32.82 C ATOM 592 OG1 THR A 306 25.570 13.893 -2.678 1.00 31.44 O ATOM 593 CG2 THR A 306 24.425 12.100 -3.691 1.00 34.22 C ATOM 594 HG1 THR A 306 26.407 14.197 -2.246 1.00 0.00 H ATOM 595 H THR A 306 27.700 12.907 -1.518 1.00 0.00 H ATOM 596 N LYS A 307 27.014 9.638 -2.389 1.00 33.83 N ATOM 597 CA LYS A 307 27.194 8.212 -2.662 1.00 35.40 C ATOM 598 C LYS A 307 26.942 7.354 -1.434 1.00 39.80 C ATOM 599 O LYS A 307 26.448 6.228 -1.562 1.00 39.45 O ATOM 600 CB LYS A 307 28.615 7.940 -3.179 1.00 38.38 C ATOM 601 CG LYS A 307 28.850 8.341 -4.625 1.00 48.80 C ATOM 602 CD LYS A 307 30.341 8.406 -4.958 1.00 61.41 C ATOM 603 CE LYS A 307 31.047 7.067 -4.909 1.00 69.09 C ATOM 604 NZ LYS A 307 32.515 7.228 -5.009 1.00 77.43 N ATOM 605 HZ1 LYS A 307 32.751 7.694 -5.908 1.00 0.00 H ATOM 606 HZ2 LYS A 307 32.853 7.810 -4.216 1.00 0.00 H ATOM 607 HZ3 LYS A 307 32.968 6.293 -4.972 1.00 0.00 H ATOM 608 H LYS A 307 27.811 10.269 -2.608 1.00 0.00 H ATOM 609 N LYS A 308 27.324 7.873 -0.258 1.00 35.60 N ATOM 610 CA LYS A 308 27.181 7.236 1.055 1.00 36.51 C ATOM 611 C LYS A 308 25.786 7.413 1.663 1.00 40.00 C ATOM 612 O LYS A 308 25.507 6.794 2.693 1.00 40.94 O ATOM 613 CB LYS A 308 28.242 7.767 2.031 1.00 38.68 C ATOM 614 CG LYS A 308 29.663 7.320 1.695 1.00 50.63 C ATOM 615 CD LYS A 308 30.644 7.972 2.656 1.00 64.51 C ATOM 616 CE LYS A 308 32.057 8.012 2.129 1.00 80.47 C ATOM 617 NZ LYS A 308 32.217 9.024 1.053 1.00 90.24 N ATOM 618 HZ1 LYS A 308 31.580 8.793 0.264 1.00 0.00 H ATOM 619 HZ2 LYS A 308 31.981 9.965 1.426 1.00 0.00 H ATOM 620 HZ3 LYS A 308 33.202 9.020 0.718 1.00 0.00 H ATOM 621 H LYS A 308 27.763 8.816 -0.279 1.00 0.00 H ATOM 622 N LEU A 309 24.923 8.265 1.072 1.00 35.65 N ATOM 623 CA LEU A 309 23.568 8.462 1.601 1.00 34.85 C ATOM 624 C LEU A 309 22.761 7.155 1.512 1.00 39.20 C ATOM 625 O LEU A 309 22.690 6.566 0.437 1.00 39.74 O ATOM 626 CB LEU A 309 22.788 9.622 0.926 1.00 33.76 C ATOM 627 CG LEU A 309 23.281 11.061 1.113 1.00 35.49 C ATOM 628 CD1 LEU A 309 22.379 12.039 0.363 1.00 35.78 C ATOM 629 CD2 LEU A 309 23.286 11.477 2.576 1.00 34.25 C ATOM 630 H LEU A 309 25.223 8.791 0.227 1.00 0.00 H ATOM 631 N PRO A 310 22.181 6.687 2.646 1.00 36.03 N ATOM 632 CA PRO A 310 21.400 5.437 2.637 1.00 37.26 C ATOM 633 C PRO A 310 20.364 5.361 1.512 1.00 39.82 C ATOM 634 O PRO A 310 19.491 6.226 1.407 1.00 37.34 O ATOM 635 CB PRO A 310 20.736 5.441 4.019 1.00 38.91 C ATOM 636 CG PRO A 310 21.694 6.166 4.871 1.00 42.88 C ATOM 637 CD PRO A 310 22.220 7.273 4.002 1.00 37.48 C ATOM 638 N GLY A 311 20.534 4.369 0.638 1.00 37.36 N ATOM 639 CA GLY A 311 19.633 4.110 -0.483 1.00 37.93 C ATOM 640 C GLY A 311 19.923 4.866 -1.764 1.00 41.40 C ATOM 641 O GLY A 311 19.354 4.539 -2.802 1.00 41.69 O ATOM 642 H GLY A 311 21.355 3.743 0.761 1.00 0.00 H ATOM 643 N PHE A 312 20.795 5.888 -1.722 1.00 36.34 N ATOM 644 CA PHE A 312 21.134 6.672 -2.918 1.00 36.00 C ATOM 645 C PHE A 312 21.627 5.782 -4.067 1.00 43.67 C ATOM 646 O PHE A 312 21.217 5.986 -5.213 1.00 45.15 O ATOM 647 CB PHE A 312 22.165 7.776 -2.609 1.00 34.21 C ATOM 648 CG PHE A 312 22.438 8.663 -3.803 1.00 34.24 C ATOM 649 CD1 PHE A 312 21.590 9.719 -4.115 1.00 35.14 C ATOM 650 CD2 PHE A 312 23.531 8.427 -4.630 1.00 35.66 C ATOM 651 CE1 PHE A 312 21.812 10.505 -5.251 1.00 35.81 C ATOM 652 CE2 PHE A 312 23.774 9.238 -5.740 1.00 37.53 C ATOM 653 CZ PHE A 312 22.925 10.287 -6.032 1.00 34.10 C ATOM 654 H PHE A 312 21.243 6.131 -0.816 1.00 0.00 H ATOM 655 N GLN A 313 22.499 4.799 -3.748 1.00 41.66 N ATOM 656 CA GLN A 313 23.076 3.850 -4.707 1.00 43.83 C ATOM 657 C GLN A 313 22.021 2.920 -5.301 1.00 50.18 C ATOM 658 O GLN A 313 22.228 2.402 -6.385 1.00 51.53 O ATOM 659 CB GLN A 313 24.211 3.018 -4.068 1.00 45.16 C ATOM 660 CG GLN A 313 25.378 3.852 -3.528 1.00 59.43 C ATOM 661 CD GLN A 313 26.474 4.124 -4.529 1.00 80.10 C ATOM 662 OE1 GLN A 313 26.238 4.468 -5.693 1.00 80.29 O ATOM 663 NE2 GLN A 313 27.709 4.020 -4.074 1.00 69.62 N ATOM 664 HE22 GLN A 313 27.878 3.728 -3.090 1.00 0.00 H ATOM 665 HE21 GLN A 313 28.513 4.230 -4.699 1.00 0.00 H ATOM 666 H GLN A 313 22.781 4.709 -2.751 1.00 0.00 H ATOM 667 N THR A 314 20.898 2.713 -4.596 1.00 47.12 N ATOM 668 CA THR A 314 19.817 1.831 -5.053 1.00 48.68 C ATOM 669 C THR A 314 18.904 2.519 -6.077 1.00 53.16 C ATOM 670 O THR A 314 18.038 1.862 -6.652 1.00 55.08 O ATOM 671 CB THR A 314 19.045 1.231 -3.875 1.00 54.34 C ATOM 672 OG1 THR A 314 18.181 2.216 -3.317 1.00 54.82 O ATOM 673 CG2 THR A 314 19.953 0.630 -2.803 1.00 49.76 C ATOM 674 HG1 THR A 314 18.719 2.984 -3.001 1.00 0.00 H ATOM 675 H THR A 314 20.788 3.200 -3.684 1.00 0.00 H ATOM 676 N LEU A 315 19.088 3.836 -6.295 1.00 47.92 N ATOM 677 CA LEU A 315 18.311 4.579 -7.289 1.00 48.43 C ATOM 678 C LEU A 315 18.870 4.335 -8.699 1.00 55.80 C ATOM 679 O LEU A 315 20.041 3.973 -8.863 1.00 53.64 O ATOM 680 CB LEU A 315 18.350 6.090 -7.006 1.00 45.99 C ATOM 681 CG LEU A 315 17.769 6.594 -5.679 1.00 47.72 C ATOM 682 CD1 LEU A 315 18.114 8.053 -5.469 1.00 45.27 C ATOM 683 CD2 LEU A 315 16.260 6.388 -5.609 1.00 50.54 C ATOM 684 H LEU A 315 19.806 4.342 -5.738 1.00 0.00 H ATOM 685 N ASP A 316 18.021 4.574 -9.714 1.00 56.39 N ATOM 686 CA ASP A 316 18.349 4.511 -11.135 1.00 59.35 C ATOM 687 C ASP A 316 19.538 5.471 -11.363 1.00 61.60 C ATOM 688 O ASP A 316 19.549 6.558 -10.780 1.00 57.63 O ATOM 689 CB ASP A 316 17.113 4.957 -11.932 1.00 63.48 C ATOM 690 CG ASP A 316 17.337 5.156 -13.410 1.00 79.81 C ATOM 691 OD1 ASP A 316 17.141 4.187 -14.174 1.00 84.41 O ATOM 692 OD2 ASP A 316 17.666 6.291 -13.808 1.00 85.29 O ATOM 693 H ASP A 316 17.043 4.826 -9.464 1.00 0.00 H ATOM 694 N HIS A 317 20.545 5.052 -12.167 1.00 60.25 N ATOM 695 CA HIS A 317 21.757 5.843 -12.429 1.00 59.10 C ATOM 696 C HIS A 317 21.476 7.254 -12.963 1.00 60.94 C ATOM 697 O HIS A 317 22.116 8.195 -12.497 1.00 58.53 O ATOM 698 CB HIS A 317 22.754 5.101 -13.329 1.00 62.79 C ATOM 699 CG HIS A 317 24.102 5.753 -13.371 1.00 65.28 C ATOM 700 ND1 HIS A 317 24.508 6.502 -14.462 1.00 68.37 N ATOM 701 CD2 HIS A 317 25.073 5.793 -12.428 1.00 65.39 C ATOM 702 CE1 HIS A 317 25.717 6.950 -14.161 1.00 66.38 C ATOM 703 NE2 HIS A 317 26.099 6.551 -12.946 1.00 64.90 N ATOM 704 H HIS A 317 20.456 4.122 -12.623 1.00 0.00 H ATOM 705 N GLU A 318 20.514 7.409 -13.893 1.00 58.93 N ATOM 706 CA GLU A 318 20.130 8.718 -14.436 1.00 59.08 C ATOM 707 C GLU A 318 19.533 9.597 -13.323 1.00 59.81 C ATOM 708 O GLU A 318 19.812 10.797 -13.293 1.00 59.22 O ATOM 709 CB GLU A 318 19.162 8.564 -15.628 1.00 64.47 C ATOM 710 CG GLU A 318 18.851 9.845 -16.402 1.00 78.97 C ATOM 711 CD GLU A 318 17.860 10.820 -15.782 1.00 98.01 C ATOM 712 OE1 GLU A 318 16.953 10.375 -15.038 1.00 71.26 O ATOM 713 OE2 GLU A 318 17.998 12.038 -16.038 1.00 99.80 O ATOM 714 H GLU A 318 20.021 6.563 -14.242 1.00 0.00 H ATOM 715 N ASP A 319 18.738 9.002 -12.402 1.00 54.56 N ATOM 716 CA ASP A 319 18.155 9.741 -11.272 1.00 50.96 C ATOM 717 C ASP A 319 19.243 10.221 -10.315 1.00 49.47 C ATOM 718 O ASP A 319 19.154 11.340 -9.811 1.00 45.97 O ATOM 719 CB ASP A 319 17.074 8.920 -10.546 1.00 52.29 C ATOM 720 CG ASP A 319 15.842 8.620 -11.393 1.00 64.83 C ATOM 721 OD1 ASP A 319 15.832 8.998 -12.589 1.00 66.99 O ATOM 722 OD2 ASP A 319 14.893 7.995 -10.864 1.00 69.27 O ATOM 723 H ASP A 319 18.533 7.987 -12.497 1.00 0.00 H ATOM 724 N GLN A 320 20.293 9.395 -10.107 1.00 45.10 N ATOM 725 CA GLN A 320 21.429 9.758 -9.245 1.00 42.50 C ATOM 726 C GLN A 320 22.109 11.044 -9.743 1.00 44.26 C ATOM 727 O GLN A 320 22.381 11.939 -8.946 1.00 41.09 O ATOM 728 CB GLN A 320 22.444 8.608 -9.157 1.00 44.32 C ATOM 729 CG GLN A 320 21.975 7.429 -8.317 1.00 43.80 C ATOM 730 CD GLN A 320 22.997 6.322 -8.298 1.00 58.60 C ATOM 731 OE1 GLN A 320 24.198 6.544 -8.126 1.00 58.39 O ATOM 732 NE2 GLN A 320 22.547 5.097 -8.463 1.00 48.59 N ATOM 733 HE22 GLN A 320 21.530 4.931 -8.607 1.00 0.00 H ATOM 734 HE21 GLN A 320 23.208 4.294 -8.450 1.00 0.00 H ATOM 735 H GLN A 320 20.298 8.466 -10.575 1.00 0.00 H ATOM 736 N ILE A 321 22.334 11.146 -11.069 1.00 43.07 N ATOM 737 CA ILE A 321 22.941 12.309 -11.733 1.00 43.25 C ATOM 738 C ILE A 321 22.020 13.542 -11.669 1.00 45.10 C ATOM 739 O ILE A 321 22.505 14.632 -11.397 1.00 43.97 O ATOM 740 CB ILE A 321 23.350 11.951 -13.198 1.00 49.50 C ATOM 741 CG1 ILE A 321 24.479 10.891 -13.236 1.00 49.68 C ATOM 742 CG2 ILE A 321 23.697 13.202 -14.038 1.00 52.58 C ATOM 743 CD1 ILE A 321 25.916 11.383 -12.760 1.00 50.09 C ATOM 744 H ILE A 321 22.057 10.341 -11.667 1.00 0.00 H ATOM 745 N ALA A 322 20.718 13.375 -11.961 1.00 42.33 N ATOM 746 CA ALA A 322 19.738 14.466 -11.917 1.00 42.87 C ATOM 747 C ALA A 322 19.623 15.077 -10.491 1.00 44.30 C ATOM 748 O ALA A 322 19.395 16.283 -10.354 1.00 44.62 O ATOM 749 CB ALA A 322 18.380 13.967 -12.389 1.00 46.01 C ATOM 750 H ALA A 322 20.390 12.426 -12.231 1.00 0.00 H ATOM 751 N LEU A 323 19.798 14.252 -9.438 1.00 38.43 N ATOM 752 CA LEU A 323 19.759 14.744 -8.055 1.00 35.76 C ATOM 753 C LEU A 323 21.007 15.552 -7.751 1.00 38.26 C ATOM 754 O LEU A 323 20.896 16.632 -7.179 1.00 36.42 O ATOM 755 CB LEU A 323 19.591 13.612 -7.037 1.00 34.39 C ATOM 756 CG LEU A 323 18.210 12.940 -6.978 1.00 39.95 C ATOM 757 CD1 LEU A 323 18.275 11.685 -6.163 1.00 40.20 C ATOM 758 CD2 LEU A 323 17.172 13.841 -6.356 1.00 39.55 C ATOM 759 H LEU A 323 19.965 13.240 -9.610 1.00 0.00 H ATOM 760 N LEU A 324 22.186 15.045 -8.155 1.00 36.87 N ATOM 761 CA LEU A 324 23.465 15.739 -7.957 1.00 36.75 C ATOM 762 C LEU A 324 23.455 17.091 -8.639 1.00 40.01 C ATOM 763 O LEU A 324 23.809 18.091 -8.017 1.00 37.69 O ATOM 764 CB LEU A 324 24.632 14.897 -8.492 1.00 38.12 C ATOM 765 CG LEU A 324 25.169 13.824 -7.561 1.00 42.94 C ATOM 766 CD1 LEU A 324 26.068 12.855 -8.337 1.00 44.36 C ATOM 767 CD2 LEU A 324 25.933 14.447 -6.372 1.00 45.10 C ATOM 768 H LEU A 324 22.192 14.119 -8.629 1.00 0.00 H ATOM 769 N LYS A 325 22.995 17.124 -9.903 1.00 38.92 N ATOM 770 CA LYS A 325 22.903 18.339 -10.698 1.00 40.58 C ATOM 771 C LYS A 325 21.985 19.379 -10.095 1.00 44.69 C ATOM 772 O LYS A 325 22.393 20.527 -9.950 1.00 45.13 O ATOM 773 CB LYS A 325 22.486 18.013 -12.136 1.00 45.83 C ATOM 774 CG LYS A 325 23.678 17.717 -13.029 1.00 59.51 C ATOM 775 CD LYS A 325 23.255 17.346 -14.447 1.00 75.68 C ATOM 776 CE LYS A 325 22.906 18.538 -15.308 1.00 91.04 C ATOM 777 NZ LYS A 325 24.117 19.225 -15.814 1.00100.20 N ATOM 778 HZ1 LYS A 325 24.687 19.558 -15.010 1.00 0.00 H ATOM 779 HZ2 LYS A 325 24.677 18.561 -16.386 1.00 0.00 H ATOM 780 HZ3 LYS A 325 23.834 20.037 -16.400 1.00 0.00 H ATOM 781 H LYS A 325 22.688 16.230 -10.336 1.00 0.00 H ATOM 782 N GLY A 326 20.776 18.964 -9.721 1.00 41.14 N ATOM 783 CA GLY A 326 19.767 19.839 -9.135 1.00 41.09 C ATOM 784 C GLY A 326 20.059 20.358 -7.736 1.00 42.16 C ATOM 785 O GLY A 326 19.502 21.382 -7.344 1.00 40.91 O ATOM 786 H GLY A 326 20.538 17.960 -9.854 1.00 0.00 H ATOM 787 N SER A 327 20.928 19.675 -6.968 1.00 38.20 N ATOM 788 CA SER A 327 21.236 20.080 -5.590 1.00 36.78 C ATOM 789 C SER A 327 22.551 20.825 -5.436 1.00 41.48 C ATOM 790 O SER A 327 22.760 21.471 -4.406 1.00 39.75 O ATOM 791 CB SER A 327 21.259 18.864 -4.674 1.00 38.60 C ATOM 792 OG SER A 327 22.430 18.095 -4.886 1.00 45.20 O ATOM 793 HG SER A 327 22.455 17.787 -5.826 1.00 0.00 H ATOM 794 H SER A 327 21.396 18.834 -7.363 1.00 0.00 H ATOM 795 N ALA A 328 23.449 20.693 -6.431 1.00 39.68 N ATOM 796 CA ALA A 328 24.787 21.278 -6.434 1.00 39.57 C ATOM 797 C ALA A 328 24.858 22.721 -5.890 1.00 41.84 C ATOM 798 O ALA A 328 25.615 22.957 -4.959 1.00 41.18 O ATOM 799 CB ALA A 328 25.402 21.187 -7.829 1.00 41.51 C ATOM 800 H ALA A 328 23.168 20.132 -7.260 1.00 0.00 H ATOM 801 N VAL A 329 24.052 23.647 -6.421 1.00 37.62 N ATOM 802 CA VAL A 329 24.047 25.067 -6.026 1.00 37.33 C ATOM 803 C VAL A 329 23.538 25.252 -4.582 1.00 38.83 C ATOM 804 O VAL A 329 24.224 25.897 -3.782 1.00 38.26 O ATOM 805 CB VAL A 329 23.311 25.970 -7.059 1.00 43.49 C ATOM 806 CG1 VAL A 329 23.208 27.416 -6.574 1.00 43.75 C ATOM 807 CG2 VAL A 329 24.006 25.915 -8.418 1.00 44.77 C ATOM 808 H VAL A 329 23.386 23.346 -7.160 1.00 0.00 H ATOM 809 N GLU A 330 22.380 24.650 -4.236 1.00 32.67 N ATOM 810 CA GLU A 330 21.810 24.712 -2.893 1.00 31.31 C ATOM 811 C GLU A 330 22.781 24.125 -1.825 1.00 33.77 C ATOM 812 O GLU A 330 22.969 24.738 -0.774 1.00 33.36 O ATOM 813 CB GLU A 330 20.473 23.970 -2.842 1.00 32.74 C ATOM 814 CG GLU A 330 19.294 24.710 -3.461 1.00 43.06 C ATOM 815 CD GLU A 330 18.025 23.879 -3.531 1.00 59.10 C ATOM 816 OE1 GLU A 330 17.851 22.979 -2.680 1.00 47.22 O ATOM 817 OE2 GLU A 330 17.194 24.129 -4.433 1.00 60.99 O ATOM 818 H GLU A 330 21.867 24.114 -4.965 1.00 0.00 H ATOM 819 N ALA A 331 23.399 22.966 -2.102 1.00 29.29 N ATOM 820 CA ALA A 331 24.345 22.323 -1.163 1.00 28.33 C ATOM 821 C ALA A 331 25.549 23.236 -0.930 1.00 32.64 C ATOM 822 O ALA A 331 26.040 23.300 0.193 1.00 31.55 O ATOM 823 CB ALA A 331 24.807 20.980 -1.710 1.00 28.32 C ATOM 824 H ALA A 331 23.205 22.502 -3.012 1.00 0.00 H ATOM 825 N MET A 332 26.014 23.934 -2.001 1.00 31.30 N ATOM 826 CA MET A 332 27.136 24.864 -1.930 1.00 31.89 C ATOM 827 C MET A 332 26.839 26.013 -0.960 1.00 37.15 C ATOM 828 O MET A 332 27.651 26.279 -0.069 1.00 36.78 O ATOM 829 CB MET A 332 27.485 25.383 -3.330 1.00 35.41 C ATOM 830 CG MET A 332 28.464 26.532 -3.329 1.00 39.46 C ATOM 831 SD MET A 332 29.009 26.948 -4.984 1.00 45.10 S ATOM 832 CE MET A 332 27.490 27.668 -5.668 1.00 43.29 C ATOM 833 H MET A 332 25.545 23.798 -2.919 1.00 0.00 H ATOM 834 N PHE A 333 25.692 26.686 -1.128 1.00 35.43 N ATOM 835 CA PHE A 333 25.288 27.788 -0.262 1.00 36.43 C ATOM 836 C PHE A 333 25.074 27.346 1.179 1.00 38.34 C ATOM 837 O PHE A 333 25.403 28.104 2.099 1.00 38.69 O ATOM 838 CB PHE A 333 24.052 28.506 -0.796 1.00 40.02 C ATOM 839 CG PHE A 333 24.378 29.528 -1.854 1.00 43.57 C ATOM 840 CD1 PHE A 333 24.882 30.777 -1.506 1.00 48.83 C ATOM 841 CD2 PHE A 333 24.182 29.245 -3.199 1.00 47.61 C ATOM 842 CE1 PHE A 333 25.210 31.716 -2.488 1.00 51.78 C ATOM 843 CE2 PHE A 333 24.483 30.195 -4.185 1.00 52.40 C ATOM 844 CZ PHE A 333 25.000 31.421 -3.822 1.00 51.95 C ATOM 845 H PHE A 333 25.063 26.411 -1.909 1.00 0.00 H ATOM 846 N LEU A 334 24.527 26.127 1.380 1.00 31.78 N ATOM 847 CA LEU A 334 24.327 25.604 2.731 1.00 31.07 C ATOM 848 C LEU A 334 25.681 25.337 3.408 1.00 33.55 C ATOM 849 O LEU A 334 25.869 25.698 4.572 1.00 32.80 O ATOM 850 CB LEU A 334 23.447 24.335 2.723 1.00 30.59 C ATOM 851 CG LEU A 334 23.061 23.772 4.101 1.00 34.46 C ATOM 852 CD1 LEU A 334 22.432 24.868 5.009 1.00 34.36 C ATOM 853 CD2 LEU A 334 22.126 22.569 3.946 1.00 36.47 C ATOM 854 H LEU A 334 24.244 25.552 0.561 1.00 0.00 H ATOM 855 N ARG A 335 26.614 24.711 2.676 1.00 30.47 N ATOM 856 CA ARG A 335 27.947 24.436 3.203 1.00 30.16 C ATOM 857 C ARG A 335 28.703 25.757 3.478 1.00 33.39 C ATOM 858 O ARG A 335 29.379 25.866 4.500 1.00 32.35 O ATOM 859 CB ARG A 335 28.717 23.502 2.246 1.00 31.13 C ATOM 860 CG ARG A 335 30.144 23.141 2.676 1.00 34.28 C ATOM 861 CD ARG A 335 30.270 22.517 4.048 1.00 35.26 C ATOM 862 NE ARG A 335 31.684 22.269 4.325 1.00 54.98 N ATOM 863 CZ ARG A 335 32.213 22.099 5.531 1.00 66.26 C ATOM 864 NH1 ARG A 335 31.449 22.156 6.614 1.00 54.55 N ATOM 865 NH2 ARG A 335 33.514 21.885 5.664 1.00 51.84 N ATOM 866 HE ARG A 335 32.329 22.222 3.510 1.00 0.00 H ATOM 867 HH12 ARG A 335 31.870 22.022 7.555 1.00 0.00 H ATOM 868 HH11 ARG A 335 30.429 22.335 6.522 1.00 0.00 H ATOM 869 HH22 ARG A 335 33.925 21.752 6.610 1.00 0.00 H ATOM 870 HH21 ARG A 335 34.124 21.850 4.822 1.00 0.00 H ATOM 871 H ARG A 335 26.382 24.414 1.707 1.00 0.00 H ATOM 872 N SER A 336 28.561 26.754 2.572 1.00 30.30 N ATOM 873 CA SER A 336 29.214 28.045 2.746 1.00 30.82 C ATOM 874 C SER A 336 28.660 28.777 3.984 1.00 36.01 C ATOM 875 O SER A 336 29.429 29.429 4.697 1.00 35.58 O ATOM 876 CB SER A 336 29.136 28.878 1.469 1.00 32.63 C ATOM 877 OG SER A 336 27.842 29.391 1.204 1.00 33.88 O ATOM 878 HG SER A 336 27.204 28.640 1.107 1.00 0.00 H ATOM 879 H SER A 336 27.971 26.594 1.731 1.00 0.00 H ATOM 880 N ALA A 337 27.358 28.613 4.287 1.00 33.74 N ATOM 881 CA ALA A 337 26.738 29.193 5.481 1.00 34.71 C ATOM 882 C ALA A 337 27.318 28.572 6.751 1.00 37.74 C ATOM 883 O ALA A 337 27.595 29.292 7.706 1.00 37.18 O ATOM 884 CB ALA A 337 25.230 29.009 5.445 1.00 35.63 C ATOM 885 H ALA A 337 26.766 28.049 3.644 1.00 0.00 H ATOM 886 N GLU A 338 27.549 27.242 6.739 1.00 33.44 N ATOM 887 CA GLU A 338 28.098 26.506 7.877 1.00 32.89 C ATOM 888 C GLU A 338 29.500 26.997 8.224 1.00 37.65 C ATOM 889 O GLU A 338 29.746 27.316 9.388 1.00 36.97 O ATOM 890 CB GLU A 338 28.141 24.987 7.576 1.00 32.78 C ATOM 891 CG GLU A 338 28.574 24.162 8.784 1.00 41.00 C ATOM 892 CD GLU A 338 28.699 22.671 8.544 1.00 60.70 C ATOM 893 OE1 GLU A 338 28.780 22.269 7.363 1.00 46.83 O ATOM 894 OE2 GLU A 338 28.740 21.904 9.533 1.00 58.94 O ATOM 895 H GLU A 338 27.324 26.712 5.873 1.00 0.00 H ATOM 896 N ILE A 339 30.398 27.056 7.210 1.00 35.11 N ATOM 897 CA ILE A 339 31.793 27.512 7.300 1.00 35.70 C ATOM 898 C ILE A 339 31.853 28.938 7.878 1.00 40.85 C ATOM 899 O ILE A 339 32.692 29.240 8.727 1.00 42.02 O ATOM 900 CB ILE A 339 32.456 27.414 5.884 1.00 38.46 C ATOM 901 CG1 ILE A 339 32.815 25.958 5.526 1.00 38.17 C ATOM 902 CG2 ILE A 339 33.673 28.344 5.717 1.00 39.82 C ATOM 903 CD1 ILE A 339 33.092 25.707 4.012 1.00 43.71 C ATOM 904 H ILE A 339 30.067 26.748 6.274 1.00 0.00 H ATOM 905 N PHE A 340 30.957 29.814 7.389 1.00 36.62 N ATOM 906 CA PHE A 340 30.903 31.221 7.807 1.00 38.18 C ATOM 907 C PHE A 340 30.560 31.331 9.299 1.00 45.48 C ATOM 908 O PHE A 340 31.202 32.093 10.010 1.00 46.02 O ATOM 909 CB PHE A 340 29.905 32.023 6.940 1.00 39.15 C ATOM 910 CG PHE A 340 29.652 33.451 7.387 1.00 41.24 C ATOM 911 CD1 PHE A 340 30.447 34.494 6.925 1.00 44.05 C ATOM 912 CD2 PHE A 340 28.605 33.753 8.248 1.00 43.28 C ATOM 913 CE1 PHE A 340 30.214 35.810 7.341 1.00 47.11 C ATOM 914 CE2 PHE A 340 28.371 35.075 8.662 1.00 48.12 C ATOM 915 CZ PHE A 340 29.174 36.092 8.200 1.00 47.31 C ATOM 916 H PHE A 340 30.271 29.480 6.682 1.00 0.00 H ATOM 917 N ASN A 341 29.557 30.566 9.756 1.00 43.72 N ATOM 918 CA ASN A 341 29.087 30.559 11.140 1.00 45.95 C ATOM 919 C ASN A 341 29.905 29.650 12.084 1.00 54.36 C ATOM 920 O ASN A 341 29.705 29.703 13.301 1.00 55.13 O ATOM 921 CB ASN A 341 27.600 30.220 11.168 1.00 43.96 C ATOM 922 CG ASN A 341 26.750 31.290 10.518 1.00 55.56 C ATOM 923 OD1 ASN A 341 26.600 32.397 11.036 1.00 50.10 O ATOM 924 ND2 ASN A 341 26.205 31.014 9.343 1.00 41.74 N ATOM 925 HD22 ASN A 341 26.339 30.075 8.915 1.00 0.00 H ATOM 926 HD21 ASN A 341 25.643 31.736 8.848 1.00 0.00 H ATOM 927 H ASN A 341 29.082 29.935 9.080 1.00 0.00 H ATOM 928 N LYS A 342 30.853 28.863 11.535 1.00 54.28 N ATOM 929 CA LYS A 342 31.684 27.942 12.315 1.00 56.75 C ATOM 930 C LYS A 342 33.159 27.939 11.889 1.00 66.76 C ATOM 931 O LYS A 342 33.889 28.898 12.168 1.00 67.35 O ATOM 932 CB LYS A 342 31.110 26.506 12.265 1.00 57.56 C ATOM 933 CG LYS A 342 30.264 26.104 13.469 1.00 76.57 C ATOM 934 CD LYS A 342 29.592 24.744 13.241 1.00 83.46 C ATOM 935 CE LYS A 342 28.348 24.568 14.084 1.00 87.65 C ATOM 936 NZ LYS A 342 27.614 23.320 13.744 1.00 85.01 N ATOM 937 HZ1 LYS A 342 27.327 23.349 12.745 1.00 0.00 H ATOM 938 HZ2 LYS A 342 28.234 22.500 13.905 1.00 0.00 H ATOM 939 HZ3 LYS A 342 26.770 23.241 14.346 1.00 0.00 H ATOM 940 H LYS A 342 31.002 28.912 10.507 1.00 0.00 H ATOM 941 N LYS A 343 33.560 26.834 11.211 1.00 65.98 N ATOM 942 CA LYS A 343 34.861 26.378 10.694 1.00 67.75 C ATOM 943 C LYS A 343 36.016 27.398 10.691 1.00 76.39 C ATOM 944 O LYS A 343 36.934 27.243 11.502 1.00 77.87 O ATOM 945 CB LYS A 343 34.701 25.776 9.282 1.00 69.01 C ATOM 946 CG LYS A 343 35.927 25.022 8.748 1.00 88.68 C ATOM 947 CD LYS A 343 35.991 23.570 9.227 1.00100.46 C ATOM 948 CE LYS A 343 37.303 22.914 8.873 1.00110.91 C ATOM 949 NZ LYS A 343 37.400 21.544 9.439 1.00119.34 N ATOM 950 HZ1 LYS A 343 37.326 21.592 10.475 1.00 0.00 H ATOM 951 HZ2 LYS A 343 36.627 20.959 9.062 1.00 0.00 H ATOM 952 HZ3 LYS A 343 38.315 21.125 9.175 1.00 0.00 H ATOM 953 H LYS A 343 32.785 26.169 11.015 1.00 0.00 H ATOM 954 N LEU A 344 36.008 28.373 9.752 1.00 74.67 N ATOM 955 CA LEU A 344 37.097 29.333 9.569 1.00 76.77 C ATOM 956 C LEU A 344 37.349 30.269 10.771 1.00 84.39 C ATOM 957 O LEU A 344 36.397 30.824 11.333 1.00 84.44 O ATOM 958 CB LEU A 344 36.926 30.143 8.273 1.00 76.57 C ATOM 959 CG LEU A 344 37.664 29.580 7.050 1.00 80.64 C ATOM 960 CD1 LEU A 344 36.964 29.951 5.786 1.00 80.02 C ATOM 961 CD2 LEU A 344 39.106 30.077 6.975 1.00 85.01 C ATOM 962 H LEU A 344 35.181 28.444 9.125 1.00 0.00 H ATOM 963 N PRO A 345 38.652 30.458 11.137 1.00 83.13 N ATOM 964 CA PRO A 345 39.008 31.343 12.270 1.00 85.54 C ATOM 965 C PRO A 345 38.501 32.782 12.153 1.00 90.21 C ATOM 966 O PRO A 345 38.205 33.225 11.048 1.00 88.91 O ATOM 967 CB PRO A 345 40.541 31.329 12.253 1.00 88.82 C ATOM 968 CG PRO A 345 40.909 30.074 11.580 1.00 91.40 C ATOM 969 CD PRO A 345 39.859 29.837 10.551 1.00 84.52 C ATOM 970 N SER A 346 38.442 33.519 13.289 1.00 88.55 N ATOM 971 CA SER A 346 37.979 34.914 13.367 1.00 89.69 C ATOM 972 C SER A 346 38.661 35.849 12.352 1.00 92.99 C ATOM 973 O SER A 346 37.967 36.497 11.566 1.00 92.32 O ATOM 974 CB SER A 346 38.142 35.448 14.785 1.00 93.47 C ATOM 975 H SER A 346 38.747 33.064 14.173 1.00 0.00 H ATOM 976 N GLY A 347 39.998 35.869 12.355 1.00 88.91 N ATOM 977 CA GLY A 347 40.810 36.684 11.454 1.00 88.22 C ATOM 978 C GLY A 347 40.903 36.150 10.037 1.00 85.40 C ATOM 979 O GLY A 347 41.003 36.935 9.087 1.00 84.65 O ATOM 980 H GLY A 347 40.492 35.265 13.043 1.00 0.00 H ATOM 981 N HIS A 348 40.894 34.804 9.887 1.00 76.88 N ATOM 982 CA HIS A 348 40.970 34.126 8.587 1.00 72.82 C ATOM 983 C HIS A 348 39.668 34.273 7.788 1.00 69.01 C ATOM 984 O HIS A 348 39.724 34.493 6.576 1.00 66.92 O ATOM 985 CB HIS A 348 41.384 32.656 8.746 1.00 72.65 C ATOM 986 CG HIS A 348 42.756 32.348 8.217 1.00 76.99 C ATOM 987 ND1 HIS A 348 42.936 31.587 7.069 1.00 77.25 N ATOM 988 CD2 HIS A 348 43.971 32.701 8.699 1.00 80.99 C ATOM 989 CE1 HIS A 348 44.245 31.502 6.893 1.00 77.85 C ATOM 990 NE2 HIS A 348 44.910 32.158 7.848 1.00 80.54 N ATOM 991 H HIS A 348 40.829 34.216 10.743 1.00 0.00 H ATOM 992 N SER A 349 38.501 34.193 8.473 1.00 61.20 N ATOM 993 CA SER A 349 37.184 34.384 7.860 1.00 58.07 C ATOM 994 C SER A 349 37.014 35.834 7.429 1.00 59.87 C ATOM 995 O SER A 349 36.372 36.087 6.413 1.00 59.11 O ATOM 996 CB SER A 349 36.056 33.970 8.804 1.00 60.82 C ATOM 997 OG SER A 349 36.072 34.719 10.008 1.00 71.74 O ATOM 998 HG SER A 349 36.934 34.576 10.473 1.00 0.00 H ATOM 999 H SER A 349 38.543 33.984 9.491 1.00 0.00 H ATOM 1000 N ASP A 350 37.625 36.785 8.175 1.00 56.37 N ATOM 1001 CA ASP A 350 37.582 38.202 7.829 1.00 57.21 C ATOM 1002 C ASP A 350 38.299 38.430 6.500 1.00 57.29 C ATOM 1003 O ASP A 350 37.841 39.233 5.687 1.00 56.73 O ATOM 1004 CB ASP A 350 38.192 39.068 8.950 1.00 62.84 C ATOM 1005 CG ASP A 350 37.295 39.271 10.164 1.00 78.91 C ATOM 1006 OD1 ASP A 350 36.055 39.111 10.028 1.00 79.26 O ATOM 1007 OD2 ASP A 350 37.827 39.617 11.244 1.00 88.95 O ATOM 1008 H ASP A 350 38.145 36.494 9.027 1.00 0.00 H ATOM 1009 N LEU A 351 39.409 37.694 6.270 1.00 51.96 N ATOM 1010 CA LEU A 351 40.191 37.755 5.029 1.00 51.16 C ATOM 1011 C LEU A 351 39.384 37.155 3.858 1.00 48.00 C ATOM 1012 O LEU A 351 39.363 37.735 2.774 1.00 46.43 O ATOM 1013 CB LEU A 351 41.518 36.996 5.204 1.00 51.86 C ATOM 1014 CG LEU A 351 42.779 37.722 4.775 1.00 60.52 C ATOM 1015 CD1 LEU A 351 44.000 37.142 5.470 1.00 61.71 C ATOM 1016 CD2 LEU A 351 42.947 37.692 3.263 1.00 64.74 C ATOM 1017 H LEU A 351 39.728 37.045 7.017 1.00 0.00 H ATOM 1018 N LEU A 352 38.703 36.019 4.083 1.00 42.59 N ATOM 1019 CA LEU A 352 37.875 35.396 3.042 1.00 40.79 C ATOM 1020 C LEU A 352 36.682 36.286 2.663 1.00 46.71 C ATOM 1021 O LEU A 352 36.378 36.416 1.471 1.00 46.89 O ATOM 1022 CB LEU A 352 37.422 33.976 3.407 1.00 38.38 C ATOM 1023 CG LEU A 352 36.548 33.250 2.355 1.00 41.42 C ATOM 1024 CD1 LEU A 352 37.247 33.123 1.006 1.00 41.14 C ATOM 1025 CD2 LEU A 352 36.116 31.906 2.838 1.00 40.62 C ATOM 1026 H LEU A 352 38.764 35.569 5.019 1.00 0.00 H ATOM 1027 N GLU A 353 36.044 36.932 3.666 1.00 44.15 N ATOM 1028 CA GLU A 353 34.935 37.863 3.435 1.00 45.36 C ATOM 1029 C GLU A 353 35.421 39.031 2.566 1.00 50.31 C ATOM 1030 O GLU A 353 34.755 39.384 1.587 1.00 49.87 O ATOM 1031 CB GLU A 353 34.345 38.351 4.768 1.00 48.26 C ATOM 1032 CG GLU A 353 33.207 39.344 4.607 1.00 58.09 C ATOM 1033 CD GLU A 353 32.249 39.478 5.773 1.00 71.51 C ATOM 1034 OE1 GLU A 353 32.371 38.717 6.762 1.00 63.37 O ATOM 1035 OE2 GLU A 353 31.344 40.335 5.672 1.00 62.48 O ATOM 1036 H GLU A 353 36.354 36.761 4.644 1.00 0.00 H ATOM 1037 N ALA A 354 36.623 39.570 2.879 1.00 49.16 N ATOM 1038 CA ALA A 354 37.264 40.640 2.114 1.00 51.55 C ATOM 1039 C ALA A 354 37.441 40.219 0.653 1.00 54.49 C ATOM 1040 O ALA A 354 37.111 40.995 -0.244 1.00 55.94 O ATOM 1041 CB ALA A 354 38.614 40.997 2.727 1.00 53.89 C ATOM 1042 H ALA A 354 37.121 39.201 3.714 1.00 0.00 H ATOM 1043 N ARG A 355 37.891 38.967 0.423 1.00 50.14 N ATOM 1044 CA ARG A 355 38.080 38.400 -0.913 1.00 49.25 C ATOM 1045 C ARG A 355 36.769 38.235 -1.673 1.00 53.93 C ATOM 1046 O ARG A 355 36.721 38.583 -2.850 1.00 55.20 O ATOM 1047 CB ARG A 355 38.856 37.081 -0.860 1.00 45.18 C ATOM 1048 CG ARG A 355 40.310 37.275 -0.488 1.00 50.80 C ATOM 1049 CD ARG A 355 41.121 36.060 -0.849 1.00 48.83 C ATOM 1050 NE ARG A 355 42.405 36.063 -0.156 1.00 48.26 N ATOM 1051 CZ ARG A 355 43.540 36.515 -0.671 1.00 60.21 C ATOM 1052 NH1 ARG A 355 43.569 37.012 -1.900 1.00 53.44 N ATOM 1053 NH2 ARG A 355 44.654 36.475 0.039 1.00 48.58 N ATOM 1054 HE ARG A 355 42.432 35.683 0.812 1.00 0.00 H ATOM 1055 HH12 ARG A 355 44.463 37.365 -2.297 1.00 0.00 H ATOM 1056 HH11 ARG A 355 42.698 37.049 -2.467 1.00 0.00 H ATOM 1057 HH22 ARG A 355 45.543 36.830 -0.368 1.00 0.00 H ATOM 1058 HH21 ARG A 355 44.642 36.088 1.004 1.00 0.00 H ATOM 1059 H ARG A 355 38.117 38.370 1.244 1.00 0.00 H ATOM 1060 N ILE A 356 35.708 37.725 -1.009 1.00 49.80 N ATOM 1061 CA ILE A 356 34.381 37.547 -1.621 1.00 48.95 C ATOM 1062 C ILE A 356 33.797 38.895 -2.037 1.00 55.48 C ATOM 1063 O ILE A 356 33.283 39.017 -3.151 1.00 56.60 O ATOM 1064 CB ILE A 356 33.428 36.723 -0.704 1.00 50.25 C ATOM 1065 CG1 ILE A 356 33.829 35.234 -0.719 1.00 48.04 C ATOM 1066 CG2 ILE A 356 31.945 36.887 -1.106 1.00 51.36 C ATOM 1067 CD1 ILE A 356 33.362 34.436 0.425 1.00 54.96 C ATOM 1068 H ILE A 356 35.835 37.444 -0.016 1.00 0.00 H ATOM 1069 N ARG A 357 33.935 39.918 -1.172 1.00 53.18 N ATOM 1070 CA ARG A 357 33.429 41.273 -1.445 1.00 55.81 C ATOM 1071 C ARG A 357 34.272 42.049 -2.493 1.00 62.70 C ATOM 1072 O ARG A 357 33.924 43.179 -2.849 1.00 65.16 O ATOM 1073 CB ARG A 357 33.267 42.071 -0.136 1.00 54.75 C ATOM 1074 CG ARG A 357 32.285 41.441 0.851 1.00 57.16 C ATOM 1075 CD ARG A 357 32.071 42.342 2.052 1.00 61.69 C ATOM 1076 NE ARG A 357 31.184 41.744 3.053 1.00 63.49 N ATOM 1077 CZ ARG A 357 29.859 41.856 3.047 1.00 73.85 C ATOM 1078 NH1 ARG A 357 29.245 42.517 2.075 1.00 60.57 N ATOM 1079 NH2 ARG A 357 29.138 41.297 4.007 1.00 63.15 N ATOM 1080 HE ARG A 357 31.620 41.194 3.821 1.00 0.00 H ATOM 1081 HH12 ARG A 357 28.208 42.600 2.077 1.00 0.00 H ATOM 1082 HH11 ARG A 357 29.800 42.952 1.311 1.00 0.00 H ATOM 1083 HH22 ARG A 357 28.102 41.387 3.999 1.00 0.00 H ATOM 1084 HH21 ARG A 357 29.608 40.768 4.769 1.00 0.00 H ATOM 1085 H ARG A 357 34.421 39.743 -0.270 1.00 0.00 H ATOM 1086 N ASN A 358 35.374 41.437 -2.982 1.00 58.27 N ATOM 1087 CA ASN A 358 36.276 41.997 -3.994 1.00 59.93 C ATOM 1088 C ASN A 358 36.679 40.904 -5.015 1.00 62.28 C ATOM 1089 O ASN A 358 37.863 40.737 -5.335 1.00 60.83 O ATOM 1090 CB ASN A 358 37.505 42.633 -3.328 1.00 61.89 C ATOM 1091 CG ASN A 358 37.198 43.842 -2.480 1.00 77.97 C ATOM 1092 OD1 ASN A 358 37.319 44.984 -2.928 1.00 78.64 O ATOM 1093 ND2 ASN A 358 36.818 43.617 -1.226 1.00 65.55 N ATOM 1094 HD22 ASN A 358 36.725 42.641 -0.878 1.00 0.00 H ATOM 1095 HD21 ASN A 358 36.614 44.417 -0.593 1.00 0.00 H ATOM 1096 H ASN A 358 35.600 40.492 -2.610 1.00 0.00 H ATOM 1097 N SER A 359 35.677 40.159 -5.521 1.00 58.68 N ATOM 1098 CA SER A 359 35.876 39.059 -6.473 1.00 57.57 C ATOM 1099 C SER A 359 35.170 39.281 -7.819 1.00 65.86 C ATOM 1100 O SER A 359 35.210 38.405 -8.690 1.00 65.26 O ATOM 1101 CB SER A 359 35.412 37.744 -5.858 1.00 55.68 C ATOM 1102 OG SER A 359 34.020 37.816 -5.606 1.00 59.06 O ATOM 1103 HG SER A 359 33.837 38.560 -4.979 1.00 0.00 H ATOM 1104 H SER A 359 34.706 40.376 -5.220 1.00 0.00 H ATOM 1105 N GLY A 360 34.528 40.431 -7.972 1.00 66.59 N ATOM 1106 CA GLY A 360 33.803 40.766 -9.192 1.00 68.89 C ATOM 1107 C GLY A 360 32.342 40.365 -9.159 1.00 72.66 C ATOM 1108 O GLY A 360 31.637 40.536 -10.158 1.00 74.89 O ATOM 1109 H GLY A 360 34.542 41.120 -7.193 1.00 0.00 H ATOM 1110 N ILE A 361 31.876 39.829 -8.010 1.00 66.65 N ATOM 1111 CA ILE A 361 30.476 39.439 -7.798 1.00 65.75 C ATOM 1112 C ILE A 361 29.707 40.727 -7.484 1.00 71.21 C ATOM 1113 O ILE A 361 30.138 41.498 -6.621 1.00 72.00 O ATOM 1114 CB ILE A 361 30.310 38.398 -6.646 1.00 65.73 C ATOM 1115 CG1 ILE A 361 31.035 37.065 -6.939 1.00 64.22 C ATOM 1116 CG2 ILE A 361 28.827 38.155 -6.301 1.00 65.85 C ATOM 1117 CD1 ILE A 361 31.231 36.161 -5.663 1.00 66.48 C ATOM 1118 H ILE A 361 32.548 39.684 -7.230 1.00 0.00 H ATOM 1119 N SER A 362 28.569 40.945 -8.160 1.00 67.95 N ATOM 1120 CA SER A 362 27.716 42.111 -7.932 1.00 70.65 C ATOM 1121 C SER A 362 27.108 42.085 -6.525 1.00 73.37 C ATOM 1122 O SER A 362 26.883 41.003 -5.981 1.00 69.21 O ATOM 1123 CB SER A 362 26.599 42.156 -8.970 1.00 75.84 C ATOM 1124 OG SER A 362 25.612 43.114 -8.625 1.00 86.29 O ATOM 1125 HG SER A 362 24.903 43.119 -9.316 1.00 0.00 H ATOM 1126 H SER A 362 28.280 40.252 -8.880 1.00 0.00 H ATOM 1127 N ASP A 363 26.814 43.277 -5.958 1.00 73.19 N ATOM 1128 CA ASP A 363 26.188 43.423 -4.637 1.00 73.84 C ATOM 1129 C ASP A 363 24.768 42.848 -4.627 1.00 78.71 C ATOM 1130 O ASP A 363 24.266 42.482 -3.564 1.00 77.20 O ATOM 1131 CB ASP A 363 26.185 44.893 -4.172 1.00 79.66 C ATOM 1132 CG ASP A 363 27.555 45.450 -3.821 1.00 93.69 C ATOM 1133 OD1 ASP A 363 28.383 44.693 -3.257 1.00 92.00 O ATOM 1134 OD2 ASP A 363 27.787 46.653 -4.072 1.00103.53 O ATOM 1135 H ASP A 363 27.045 44.141 -6.488 1.00 0.00 H ATOM 1136 N GLU A 364 24.143 42.734 -5.824 1.00 77.10 N ATOM 1137 CA GLU A 364 22.811 42.162 -6.050 1.00 77.01 C ATOM 1138 C GLU A 364 22.799 40.678 -5.631 1.00 76.30 C ATOM 1139 O GLU A 364 21.738 40.126 -5.335 1.00 74.95 O ATOM 1140 CB GLU A 364 22.444 42.292 -7.538 1.00 80.57 C ATOM 1141 CG GLU A 364 20.953 42.233 -7.830 1.00 93.46 C ATOM 1142 CD GLU A 364 20.578 41.925 -9.268 1.00113.00 C ATOM 1143 OE1 GLU A 364 21.359 42.271 -10.185 1.00106.90 O ATOM 1144 OE2 GLU A 364 19.488 41.344 -9.479 1.00104.50 O ATOM 1145 H GLU A 364 24.655 43.084 -6.659 1.00 0.00 H ATOM 1146 N TYR A 365 23.986 40.050 -5.602 1.00 70.50 N ATOM 1147 CA TYR A 365 24.162 38.653 -5.218 1.00 66.82 C ATOM 1148 C TYR A 365 24.884 38.483 -3.876 1.00 68.13 C ATOM 1149 O TYR A 365 24.624 37.499 -3.186 1.00 65.05 O ATOM 1150 CB TYR A 365 24.852 37.865 -6.342 1.00 67.13 C ATOM 1151 CG TYR A 365 24.225 38.095 -7.701 1.00 71.50 C ATOM 1152 CD1 TYR A 365 22.986 37.545 -8.023 1.00 73.79 C ATOM 1153 CD2 TYR A 365 24.855 38.888 -8.657 1.00 74.45 C ATOM 1154 CE1 TYR A 365 22.398 37.765 -9.267 1.00 77.19 C ATOM 1155 CE2 TYR A 365 24.278 39.111 -9.907 1.00 77.67 C ATOM 1156 CZ TYR A 365 23.052 38.541 -10.209 1.00 86.39 C ATOM 1157 OH TYR A 365 22.469 38.753 -11.433 1.00 93.22 O ATOM 1158 HH TYR A 365 22.316 39.723 -11.561 1.00 0.00 H ATOM 1159 H TYR A 365 24.832 40.593 -5.870 1.00 0.00 H ATOM 1160 N ILE A 366 25.754 39.444 -3.489 1.00 65.22 N ATOM 1161 CA ILE A 366 26.489 39.399 -2.216 1.00 63.57 C ATOM 1162 C ILE A 366 25.559 39.663 -1.021 1.00 66.49 C ATOM 1163 O ILE A 366 25.683 38.982 -0.001 1.00 63.44 O ATOM 1164 CB ILE A 366 27.745 40.327 -2.248 1.00 68.12 C ATOM 1165 CG1 ILE A 366 28.986 39.533 -2.703 1.00 66.57 C ATOM 1166 CG2 ILE A 366 28.011 41.049 -0.907 1.00 69.77 C ATOM 1167 CD1 ILE A 366 30.100 40.365 -3.376 1.00 77.69 C ATOM 1168 H ILE A 366 25.911 40.254 -4.122 1.00 0.00 H ATOM 1169 N THR A 367 24.638 40.641 -1.155 1.00 65.65 N ATOM 1170 CA THR A 367 23.688 41.049 -0.110 1.00 66.56 C ATOM 1171 C THR A 367 22.719 39.897 0.316 1.00 68.31 C ATOM 1172 O THR A 367 22.642 39.681 1.523 1.00 67.51 O ATOM 1173 CB THR A 367 22.959 42.348 -0.495 1.00 73.41 C ATOM 1174 OG1 THR A 367 23.922 43.282 -0.987 1.00 69.35 O ATOM 1175 CG2 THR A 367 22.203 42.970 0.678 1.00 73.56 C ATOM 1176 HG1 THR A 367 24.374 42.901 -1.781 1.00 0.00 H ATOM 1177 H THR A 367 24.598 41.143 -2.065 1.00 0.00 H ATOM 1178 N PRO A 368 22.002 39.141 -0.573 1.00 64.05 N ATOM 1179 CA PRO A 368 21.140 38.043 -0.074 1.00 61.48 C ATOM 1180 C PRO A 368 21.932 36.852 0.483 1.00 60.95 C ATOM 1181 O PRO A 368 21.419 36.115 1.329 1.00 59.91 O ATOM 1182 CB PRO A 368 20.327 37.630 -1.310 1.00 63.78 C ATOM 1183 CG PRO A 368 20.547 38.723 -2.324 1.00 71.61 C ATOM 1184 CD PRO A 368 21.922 39.227 -2.044 1.00 66.85 C ATOM 1185 N MET A 369 23.178 36.663 -0.006 1.00 54.64 N ATOM 1186 CA MET A 369 24.121 35.621 0.408 1.00 50.81 C ATOM 1187 C MET A 369 24.518 35.808 1.880 1.00 49.35 C ATOM 1188 O MET A 369 24.320 34.893 2.677 1.00 45.57 O ATOM 1189 CB MET A 369 25.362 35.663 -0.496 1.00 53.64 C ATOM 1190 CG MET A 369 26.333 34.510 -0.292 1.00 56.09 C ATOM 1191 SD MET A 369 28.037 34.902 -0.801 1.00 62.31 S ATOM 1192 CE MET A 369 27.783 35.483 -2.488 1.00 60.67 C ATOM 1193 H MET A 369 23.498 37.320 -0.746 1.00 0.00 H ATOM 1194 N PHE A 370 25.059 36.995 2.246 1.00 47.27 N ATOM 1195 CA PHE A 370 25.463 37.275 3.629 1.00 47.47 C ATOM 1196 C PHE A 370 24.264 37.377 4.578 1.00 53.10 C ATOM 1197 O PHE A 370 24.405 37.052 5.764 1.00 51.91 O ATOM 1198 CB PHE A 370 26.405 38.488 3.735 1.00 51.11 C ATOM 1199 CG PHE A 370 27.832 38.121 3.384 1.00 50.61 C ATOM 1200 CD1 PHE A 370 28.331 38.345 2.106 1.00 53.38 C ATOM 1201 CD2 PHE A 370 28.667 37.528 4.325 1.00 50.93 C ATOM 1202 CE1 PHE A 370 29.638 37.973 1.771 1.00 52.91 C ATOM 1203 CE2 PHE A 370 29.970 37.146 3.986 1.00 52.93 C ATOM 1204 CZ PHE A 370 30.452 37.382 2.712 1.00 51.11 C ATOM 1205 H PHE A 370 25.192 37.731 1.524 1.00 0.00 H ATOM 1206 N SER A 371 23.077 37.762 4.048 1.00 51.12 N ATOM 1207 CA SER A 371 21.835 37.794 4.823 1.00 52.04 C ATOM 1208 C SER A 371 21.443 36.349 5.159 1.00 52.12 C ATOM 1209 O SER A 371 21.073 36.068 6.299 1.00 51.35 O ATOM 1210 CB SER A 371 20.720 38.478 4.040 1.00 58.76 C ATOM 1211 OG SER A 371 19.475 38.281 4.687 1.00 72.20 O ATOM 1212 HG SER A 371 18.761 38.730 4.169 1.00 0.00 H ATOM 1213 H SER A 371 23.047 38.047 3.048 1.00 0.00 H ATOM 1214 N PHE A 372 21.562 35.429 4.179 1.00 46.81 N ATOM 1215 CA PHE A 372 21.281 34.007 4.406 1.00 43.34 C ATOM 1216 C PHE A 372 22.233 33.432 5.457 1.00 46.54 C ATOM 1217 O PHE A 372 21.791 32.674 6.323 1.00 46.17 O ATOM 1218 CB PHE A 372 21.356 33.215 3.092 1.00 43.77 C ATOM 1219 CG PHE A 372 21.213 31.714 3.231 1.00 43.28 C ATOM 1220 CD1 PHE A 372 19.986 31.142 3.551 1.00 46.70 C ATOM 1221 CD2 PHE A 372 22.302 30.875 3.030 1.00 43.10 C ATOM 1222 CE1 PHE A 372 19.857 29.754 3.675 1.00 45.32 C ATOM 1223 CE2 PHE A 372 22.172 29.493 3.167 1.00 44.13 C ATOM 1224 CZ PHE A 372 20.950 28.945 3.497 1.00 42.01 C ATOM 1225 H PHE A 372 21.863 35.738 3.232 1.00 0.00 H ATOM 1226 N TYR A 373 23.533 33.808 5.404 1.00 43.47 N ATOM 1227 CA TYR A 373 24.542 33.356 6.375 1.00 41.38 C ATOM 1228 C TYR A 373 24.143 33.759 7.796 1.00 45.77 C ATOM 1229 O TYR A 373 24.231 32.945 8.711 1.00 44.44 O ATOM 1230 CB TYR A 373 25.933 33.941 6.053 1.00 42.05 C ATOM 1231 CG TYR A 373 26.615 33.416 4.803 1.00 41.19 C ATOM 1232 CD1 TYR A 373 26.085 32.345 4.084 1.00 40.63 C ATOM 1233 CD2 TYR A 373 27.788 34.000 4.332 1.00 41.65 C ATOM 1234 CE1 TYR A 373 26.698 31.880 2.925 1.00 40.61 C ATOM 1235 CE2 TYR A 373 28.409 33.543 3.176 1.00 40.90 C ATOM 1236 CZ TYR A 373 27.866 32.477 2.481 1.00 48.26 C ATOM 1237 OH TYR A 373 28.482 32.049 1.338 1.00 47.86 O ATOM 1238 HH TYR A 373 27.978 31.286 0.959 1.00 0.00 H ATOM 1239 H TYR A 373 23.833 34.447 4.640 1.00 0.00 H ATOM 1240 N LYS A 374 23.666 35.000 7.963 1.00 45.94 N ATOM 1241 CA LYS A 374 23.236 35.517 9.259 1.00 48.22 C ATOM 1242 C LYS A 374 21.993 34.806 9.766 1.00 52.20 C ATOM 1243 O LYS A 374 21.976 34.418 10.931 1.00 52.25 O ATOM 1244 CB LYS A 374 23.035 37.054 9.232 1.00 54.54 C ATOM 1245 CG LYS A 374 24.331 37.866 9.076 1.00 76.48 C ATOM 1246 CD LYS A 374 25.232 37.832 10.321 1.00 89.61 C ATOM 1247 CE LYS A 374 26.625 38.339 10.037 1.00102.83 C ATOM 1248 NZ LYS A 374 27.524 38.161 11.207 1.00111.93 N ATOM 1249 HZ1 LYS A 374 27.143 38.687 12.019 1.00 0.00 H ATOM 1250 HZ2 LYS A 374 27.585 37.150 11.445 1.00 0.00 H ATOM 1251 HZ3 LYS A 374 28.471 38.521 10.973 1.00 0.00 H ATOM 1252 H LYS A 374 23.599 35.623 7.133 1.00 0.00 H ATOM 1253 N SER A 375 20.969 34.609 8.902 1.00 49.80 N ATOM 1254 CA SER A 375 19.733 33.912 9.291 1.00 50.60 C ATOM 1255 C SER A 375 19.998 32.450 9.721 1.00 51.83 C ATOM 1256 O SER A 375 19.375 31.973 10.667 1.00 52.71 O ATOM 1257 CB SER A 375 18.676 34.002 8.193 1.00 56.86 C ATOM 1258 OG SER A 375 18.921 33.089 7.136 1.00 67.55 O ATOM 1259 HG SER A 375 19.803 33.284 6.731 1.00 0.00 H ATOM 1260 H SER A 375 21.060 34.963 7.928 1.00 0.00 H ATOM 1261 N ILE A 376 20.965 31.776 9.063 1.00 44.16 N ATOM 1262 CA ILE A 376 21.399 30.418 9.397 1.00 41.75 C ATOM 1263 C ILE A 376 22.085 30.453 10.774 1.00 45.61 C ATOM 1264 O ILE A 376 21.796 29.606 11.625 1.00 43.12 O ATOM 1265 CB ILE A 376 22.314 29.849 8.270 1.00 42.52 C ATOM 1266 CG1 ILE A 376 21.461 29.413 7.054 1.00 42.82 C ATOM 1267 CG2 ILE A 376 23.240 28.695 8.760 1.00 42.28 C ATOM 1268 CD1 ILE A 376 20.855 27.915 7.108 1.00 47.78 C ATOM 1269 H ILE A 376 21.433 32.253 8.266 1.00 0.00 H ATOM 1270 N GLY A 377 22.965 31.446 10.967 1.00 44.46 N ATOM 1271 CA GLY A 377 23.682 31.672 12.219 1.00 45.45 C ATOM 1272 C GLY A 377 22.757 31.807 13.410 1.00 51.59 C ATOM 1273 O GLY A 377 23.018 31.212 14.461 1.00 51.77 O ATOM 1274 H GLY A 377 23.148 32.096 10.176 1.00 0.00 H ATOM 1275 N GLU A 378 21.625 32.522 13.216 1.00 49.83 N ATOM 1276 CA GLU A 378 20.586 32.741 14.228 1.00 52.33 C ATOM 1277 C GLU A 378 19.953 31.452 14.748 1.00 55.63 C ATOM 1278 O GLU A 378 19.547 31.406 15.907 1.00 56.66 O ATOM 1279 CB GLU A 378 19.485 33.665 13.692 1.00 55.72 C ATOM 1280 CG GLU A 378 19.820 35.141 13.755 1.00 68.19 C ATOM 1281 CD GLU A 378 18.586 36.003 13.595 1.00 97.81 C ATOM 1282 OE1 GLU A 378 17.927 36.291 14.621 1.00 98.15 O ATOM 1283 OE2 GLU A 378 18.241 36.336 12.438 1.00 93.82 O ATOM 1284 H GLU A 378 21.481 32.949 12.279 1.00 0.00 H ATOM 1285 N LEU A 379 19.867 30.407 13.906 1.00 50.07 N ATOM 1286 CA LEU A 379 19.283 29.140 14.330 1.00 49.76 C ATOM 1287 C LEU A 379 20.228 28.317 15.195 1.00 53.32 C ATOM 1288 O LEU A 379 19.783 27.339 15.796 1.00 53.68 O ATOM 1289 CB LEU A 379 18.812 28.300 13.120 1.00 48.09 C ATOM 1290 CG LEU A 379 17.716 28.882 12.219 1.00 54.04 C ATOM 1291 CD1 LEU A 379 17.158 27.806 11.328 1.00 53.08 C ATOM 1292 CD2 LEU A 379 16.566 29.483 13.022 1.00 57.98 C ATOM 1293 H LEU A 379 20.224 30.504 12.934 1.00 0.00 H ATOM 1294 N LYS A 380 21.533 28.686 15.233 1.00 48.94 N ATOM 1295 CA LYS A 380 22.592 27.967 15.962 1.00 48.36 C ATOM 1296 C LYS A 380 22.437 26.474 15.688 1.00 51.44 C ATOM 1297 O LYS A 380 22.156 25.685 16.593 1.00 52.22 O ATOM 1298 CB LYS A 380 22.586 28.285 17.471 1.00 52.48 C ATOM 1299 CG LYS A 380 22.984 29.728 17.797 1.00 63.10 C ATOM 1300 CD LYS A 380 23.506 29.858 19.222 1.00 77.52 C ATOM 1301 CE LYS A 380 22.468 30.386 20.182 1.00 94.06 C ATOM 1302 NZ LYS A 380 23.053 30.677 21.519 1.00106.02 N ATOM 1303 HZ1 LYS A 380 23.455 29.805 21.918 1.00 0.00 H ATOM 1304 HZ2 LYS A 380 23.802 31.392 21.420 1.00 0.00 H ATOM 1305 HZ3 LYS A 380 22.309 31.038 22.150 1.00 0.00 H ATOM 1306 H LYS A 380 21.806 29.541 14.708 1.00 0.00 H ATOM 1307 N MET A 381 22.499 26.114 14.399 1.00 46.10 N ATOM 1308 CA MET A 381 22.304 24.742 13.954 1.00 43.75 C ATOM 1309 C MET A 381 23.363 23.816 14.466 1.00 44.81 C ATOM 1310 O MET A 381 24.537 24.175 14.477 1.00 45.13 O ATOM 1311 CB MET A 381 22.239 24.673 12.424 1.00 45.25 C ATOM 1312 CG MET A 381 20.882 25.041 11.879 1.00 50.45 C ATOM 1313 SD MET A 381 20.846 25.251 10.091 1.00 54.41 S ATOM 1314 CE MET A 381 21.130 23.589 9.578 1.00 49.29 C ATOM 1315 H MET A 381 22.695 26.846 13.686 1.00 0.00 H ATOM 1316 N THR A 382 22.957 22.610 14.876 1.00 39.04 N ATOM 1317 CA THR A 382 23.900 21.585 15.310 1.00 38.64 C ATOM 1318 C THR A 382 24.483 20.950 14.043 1.00 41.12 C ATOM 1319 O THR A 382 23.929 21.140 12.953 1.00 38.91 O ATOM 1320 CB THR A 382 23.193 20.508 16.148 1.00 48.37 C ATOM 1321 OG1 THR A 382 22.245 19.817 15.324 1.00 44.70 O ATOM 1322 CG2 THR A 382 22.525 21.075 17.400 1.00 47.51 C ATOM 1323 HG1 THR A 382 21.578 20.462 14.979 1.00 0.00 H ATOM 1324 H THR A 382 21.939 22.396 14.886 1.00 0.00 H ATOM 1325 N GLN A 383 25.586 20.206 14.187 1.00 38.84 N ATOM 1326 CA GLN A 383 26.227 19.487 13.085 1.00 38.06 C ATOM 1327 C GLN A 383 25.224 18.457 12.469 1.00 39.94 C ATOM 1328 O GLN A 383 25.190 18.322 11.247 1.00 38.75 O ATOM 1329 CB GLN A 383 27.507 18.804 13.588 1.00 40.58 C ATOM 1330 CG GLN A 383 28.387 18.224 12.483 1.00 64.28 C ATOM 1331 CD GLN A 383 29.502 19.123 12.022 1.00 89.57 C ATOM 1332 OE1 GLN A 383 29.401 20.355 12.019 1.00 88.88 O ATOM 1333 NE2 GLN A 383 30.585 18.512 11.572 1.00 82.21 N ATOM 1334 HE22 GLN A 383 30.641 17.474 11.587 1.00 0.00 H ATOM 1335 HE21 GLN A 383 31.381 19.070 11.203 1.00 0.00 H ATOM 1336 H GLN A 383 26.011 20.135 15.134 1.00 0.00 H ATOM 1337 N GLU A 384 24.382 17.791 13.318 1.00 35.41 N ATOM 1338 CA GLU A 384 23.325 16.840 12.905 1.00 34.82 C ATOM 1339 C GLU A 384 22.316 17.537 12.001 1.00 37.08 C ATOM 1340 O GLU A 384 21.873 16.954 11.019 1.00 34.73 O ATOM 1341 CB GLU A 384 22.571 16.251 14.126 1.00 37.39 C ATOM 1342 CG GLU A 384 23.374 15.280 14.984 1.00 51.93 C ATOM 1343 CD GLU A 384 24.463 15.868 15.870 1.00 82.92 C ATOM 1344 OE1 GLU A 384 24.474 17.103 16.086 1.00 65.43 O ATOM 1345 OE2 GLU A 384 25.314 15.083 16.348 1.00 89.44 O ATOM 1346 H GLU A 384 24.494 17.967 14.337 1.00 0.00 H ATOM 1347 N GLU A 385 21.944 18.791 12.342 1.00 33.96 N ATOM 1348 CA GLU A 385 20.996 19.563 11.543 1.00 33.16 C ATOM 1349 C GLU A 385 21.591 19.934 10.202 1.00 34.48 C ATOM 1350 O GLU A 385 20.902 19.792 9.187 1.00 33.35 O ATOM 1351 CB GLU A 385 20.475 20.793 12.301 1.00 35.18 C ATOM 1352 CG GLU A 385 19.531 20.432 13.441 1.00 42.46 C ATOM 1353 CD GLU A 385 19.213 21.559 14.409 1.00 59.74 C ATOM 1354 OE1 GLU A 385 20.088 22.429 14.617 1.00 45.06 O ATOM 1355 OE2 GLU A 385 18.117 21.534 15.014 1.00 52.67 O ATOM 1356 H GLU A 385 22.345 19.220 13.200 1.00 0.00 H ATOM 1357 N TYR A 386 22.873 20.362 10.172 1.00 30.26 N ATOM 1358 CA TYR A 386 23.545 20.685 8.895 1.00 29.74 C ATOM 1359 C TYR A 386 23.622 19.444 7.974 1.00 30.88 C ATOM 1360 O TYR A 386 23.329 19.536 6.774 1.00 30.00 O ATOM 1361 CB TYR A 386 24.967 21.223 9.136 1.00 31.98 C ATOM 1362 CG TYR A 386 25.021 22.692 9.503 1.00 35.55 C ATOM 1363 CD1 TYR A 386 24.641 23.676 8.590 1.00 38.15 C ATOM 1364 CD2 TYR A 386 25.567 23.107 10.715 1.00 37.64 C ATOM 1365 CE1 TYR A 386 24.708 25.033 8.917 1.00 39.51 C ATOM 1366 CE2 TYR A 386 25.659 24.462 11.044 1.00 39.62 C ATOM 1367 CZ TYR A 386 25.237 25.421 10.139 1.00 46.22 C ATOM 1368 OH TYR A 386 25.328 26.752 10.470 1.00 49.14 O ATOM 1369 HH TYR A 386 26.274 26.983 10.647 1.00 0.00 H ATOM 1370 H TYR A 386 23.397 20.466 11.064 1.00 0.00 H ATOM 1371 N ALA A 387 23.972 18.284 8.558 1.00 26.65 N ATOM 1372 CA ALA A 387 24.094 17.043 7.810 1.00 26.34 C ATOM 1373 C ALA A 387 22.738 16.592 7.253 1.00 28.38 C ATOM 1374 O ALA A 387 22.663 16.263 6.085 1.00 26.89 O ATOM 1375 CB ALA A 387 24.684 15.958 8.700 1.00 26.96 C ATOM 1376 H ALA A 387 24.162 18.274 9.580 1.00 0.00 H ATOM 1377 N LEU A 388 21.688 16.561 8.095 1.00 27.14 N ATOM 1378 CA LEU A 388 20.348 16.149 7.673 1.00 28.26 C ATOM 1379 C LEU A 388 19.759 17.097 6.653 1.00 30.85 C ATOM 1380 O LEU A 388 19.196 16.626 5.676 1.00 28.97 O ATOM 1381 CB LEU A 388 19.392 15.975 8.853 1.00 29.07 C ATOM 1382 CG LEU A 388 19.590 14.734 9.703 1.00 32.92 C ATOM 1383 CD1 LEU A 388 18.775 14.840 10.940 1.00 34.61 C ATOM 1384 CD2 LEU A 388 19.190 13.463 8.945 1.00 34.30 C ATOM 1385 H LEU A 388 21.835 16.841 9.086 1.00 0.00 H ATOM 1386 N LEU A 389 19.939 18.421 6.835 1.00 28.46 N ATOM 1387 CA LEU A 389 19.416 19.418 5.880 1.00 29.16 C ATOM 1388 C LEU A 389 20.081 19.229 4.516 1.00 30.12 C ATOM 1389 O LEU A 389 19.392 19.269 3.502 1.00 29.96 O ATOM 1390 CB LEU A 389 19.640 20.862 6.367 1.00 30.33 C ATOM 1391 CG LEU A 389 18.511 21.598 7.094 1.00 37.36 C ATOM 1392 CD1 LEU A 389 18.630 23.093 6.846 1.00 39.29 C ATOM 1393 CD2 LEU A 389 17.129 21.143 6.644 1.00 39.62 C ATOM 1394 H LEU A 389 20.461 18.749 7.672 1.00 0.00 H ATOM 1395 N THR A 390 21.405 18.976 4.497 1.00 24.67 N ATOM 1396 CA THR A 390 22.118 18.718 3.245 1.00 23.67 C ATOM 1397 C THR A 390 21.547 17.456 2.565 1.00 25.61 C ATOM 1398 O THR A 390 21.301 17.502 1.370 1.00 26.19 O ATOM 1399 CB THR A 390 23.629 18.616 3.456 1.00 29.07 C ATOM 1400 OG1 THR A 390 24.087 19.771 4.181 1.00 29.59 O ATOM 1401 CG2 THR A 390 24.381 18.486 2.122 1.00 26.23 C ATOM 1402 HG1 THR A 390 23.631 19.810 5.059 1.00 0.00 H ATOM 1403 H THR A 390 21.932 18.964 5.393 1.00 0.00 H ATOM 1404 N ALA A 391 21.335 16.358 3.323 1.00 23.84 N ATOM 1405 CA ALA A 391 20.759 15.116 2.775 1.00 25.23 C ATOM 1406 C ALA A 391 19.336 15.382 2.247 1.00 27.14 C ATOM 1407 O ALA A 391 18.980 14.828 1.213 1.00 26.79 O ATOM 1408 CB ALA A 391 20.722 14.024 3.829 1.00 26.17 C ATOM 1409 H ALA A 391 21.588 16.390 4.331 1.00 0.00 H ATOM 1410 N ILE A 392 18.528 16.204 2.956 1.00 23.85 N ATOM 1411 CA ILE A 392 17.145 16.552 2.515 1.00 24.59 C ATOM 1412 C ILE A 392 17.187 17.340 1.194 1.00 30.53 C ATOM 1413 O ILE A 392 16.384 17.059 0.303 1.00 32.29 O ATOM 1414 CB ILE A 392 16.321 17.247 3.649 1.00 28.56 C ATOM 1415 CG1 ILE A 392 15.967 16.203 4.751 1.00 28.74 C ATOM 1416 CG2 ILE A 392 15.025 17.908 3.104 1.00 30.15 C ATOM 1417 CD1 ILE A 392 15.884 16.740 6.231 1.00 30.99 C ATOM 1418 H ILE A 392 18.885 16.610 3.844 1.00 0.00 H ATOM 1419 N VAL A 393 18.126 18.312 1.065 1.00 26.70 N ATOM 1420 CA VAL A 393 18.362 19.111 -0.156 1.00 27.75 C ATOM 1421 C VAL A 393 18.716 18.192 -1.331 1.00 31.36 C ATOM 1422 O VAL A 393 18.136 18.324 -2.410 1.00 32.32 O ATOM 1423 CB VAL A 393 19.468 20.182 0.092 1.00 32.46 C ATOM 1424 CG1 VAL A 393 20.047 20.743 -1.218 1.00 33.55 C ATOM 1425 CG2 VAL A 393 18.937 21.310 0.963 1.00 32.91 C ATOM 1426 H VAL A 393 18.727 18.510 1.891 1.00 0.00 H ATOM 1427 N ILE A 394 19.678 17.275 -1.124 1.00 28.50 N ATOM 1428 CA ILE A 394 20.139 16.338 -2.157 1.00 27.89 C ATOM 1429 C ILE A 394 19.021 15.403 -2.604 1.00 31.95 C ATOM 1430 O ILE A 394 18.780 15.274 -3.799 1.00 32.39 O ATOM 1431 CB ILE A 394 21.424 15.564 -1.736 1.00 29.54 C ATOM 1432 CG1 ILE A 394 22.608 16.524 -1.496 1.00 28.72 C ATOM 1433 CG2 ILE A 394 21.790 14.517 -2.819 1.00 30.61 C ATOM 1434 CD1 ILE A 394 23.758 15.880 -0.652 1.00 28.57 C ATOM 1435 H ILE A 394 20.119 17.227 -0.183 1.00 0.00 H ATOM 1436 N LEU A 395 18.328 14.781 -1.641 1.00 29.53 N ATOM 1437 CA LEU A 395 17.253 13.841 -1.938 1.00 31.39 C ATOM 1438 C LEU A 395 15.896 14.538 -2.139 1.00 38.22 C ATOM 1439 O LEU A 395 14.900 14.156 -1.530 1.00 38.12 O ATOM 1440 CB LEU A 395 17.200 12.730 -0.880 1.00 30.69 C ATOM 1441 CG LEU A 395 18.407 11.781 -0.863 1.00 35.44 C ATOM 1442 CD1 LEU A 395 18.537 11.103 0.490 1.00 35.49 C ATOM 1443 CD2 LEU A 395 18.305 10.737 -1.956 1.00 38.20 C ATOM 1444 H LEU A 395 18.565 14.975 -0.647 1.00 0.00 H ATOM 1445 N SER A 396 15.871 15.554 -3.016 1.00 37.23 N ATOM 1446 CA SER A 396 14.655 16.301 -3.317 1.00 38.74 C ATOM 1447 C SER A 396 13.907 15.633 -4.465 1.00 44.46 C ATOM 1448 O SER A 396 14.416 15.593 -5.595 1.00 44.44 O ATOM 1449 CB SER A 396 14.968 17.763 -3.619 1.00 42.34 C ATOM 1450 OG SER A 396 15.427 18.409 -2.442 1.00 46.51 O ATOM 1451 HG SER A 396 16.247 17.958 -2.118 1.00 0.00 H ATOM 1452 H SER A 396 16.753 15.819 -3.500 1.00 0.00 H ATOM 1453 N PRO A 397 12.702 15.062 -4.200 1.00 42.10 N ATOM 1454 CA PRO A 397 11.981 14.386 -5.284 1.00 45.41 C ATOM 1455 C PRO A 397 11.394 15.310 -6.346 1.00 53.91 C ATOM 1456 O PRO A 397 10.995 14.812 -7.391 1.00 57.56 O ATOM 1457 CB PRO A 397 10.905 13.598 -4.543 1.00 47.30 C ATOM 1458 CG PRO A 397 10.632 14.398 -3.339 1.00 49.60 C ATOM 1459 CD PRO A 397 11.940 14.987 -2.932 1.00 43.04 C ATOM 1460 N ASP A 398 11.374 16.632 -6.117 1.00 51.17 N ATOM 1461 CA ASP A 398 10.793 17.537 -7.107 1.00 54.94 C ATOM 1462 C ASP A 398 11.851 18.280 -7.967 1.00 60.02 C ATOM 1463 O ASP A 398 11.603 19.405 -8.429 1.00 61.44 O ATOM 1464 CB ASP A 398 9.767 18.498 -6.469 1.00 58.38 C ATOM 1465 CG ASP A 398 10.262 19.352 -5.323 1.00 73.18 C ATOM 1466 OD1 ASP A 398 11.282 20.054 -5.503 1.00 74.65 O ATOM 1467 OD2 ASP A 398 9.582 19.379 -4.267 1.00 78.45 O ATOM 1468 H ASP A 398 11.772 17.013 -5.235 1.00 0.00 H ATOM 1469 N ARG A 399 12.999 17.622 -8.233 1.00 54.58 N ATOM 1470 CA ARG A 399 14.014 18.197 -9.118 1.00 54.34 C ATOM 1471 C ARG A 399 13.607 17.817 -10.525 1.00 62.73 C ATOM 1472 O ARG A 399 12.894 16.829 -10.715 1.00 62.35 O ATOM 1473 CB ARG A 399 15.428 17.643 -8.855 1.00 48.84 C ATOM 1474 CG ARG A 399 15.990 17.894 -7.476 1.00 44.20 C ATOM 1475 CD ARG A 399 16.417 19.323 -7.260 1.00 42.10 C ATOM 1476 NE ARG A 399 17.106 19.460 -5.979 1.00 36.17 N ATOM 1477 CZ ARG A 399 17.188 20.591 -5.298 1.00 45.06 C ATOM 1478 NH1 ARG A 399 16.648 21.706 -5.780 1.00 42.49 N ATOM 1479 NH2 ARG A 399 17.816 20.623 -4.135 1.00 36.10 N ATOM 1480 HE ARG A 399 17.561 18.615 -5.577 1.00 0.00 H ATOM 1481 HH12 ARG A 399 16.716 22.592 -5.240 1.00 0.00 H ATOM 1482 HH11 ARG A 399 16.158 21.692 -6.697 1.00 0.00 H ATOM 1483 HH22 ARG A 399 17.879 21.514 -3.602 1.00 0.00 H ATOM 1484 HH21 ARG A 399 18.247 19.757 -3.753 1.00 0.00 H ATOM 1485 H ARG A 399 13.166 16.690 -7.802 1.00 0.00 H ATOM 1486 N GLN A 400 14.093 18.562 -11.512 1.00 62.63 N ATOM 1487 CA GLN A 400 13.799 18.266 -12.905 1.00 66.53 C ATOM 1488 C GLN A 400 14.542 16.996 -13.342 1.00 71.06 C ATOM 1489 O GLN A 400 15.609 16.680 -12.799 1.00 68.12 O ATOM 1490 CB GLN A 400 14.180 19.460 -13.798 1.00 69.93 C ATOM 1491 CG GLN A 400 13.359 20.727 -13.547 1.00 88.14 C ATOM 1492 CD GLN A 400 13.742 21.860 -14.469 1.00111.41 C ATOM 1493 OE1 GLN A 400 14.853 22.401 -14.412 1.00106.39 O ATOM 1494 NE2 GLN A 400 12.811 22.273 -15.313 1.00107.05 N ATOM 1495 HE22 GLN A 400 11.886 21.799 -15.339 1.00 0.00 H ATOM 1496 HE21 GLN A 400 13.004 23.072 -15.951 1.00 0.00 H ATOM 1497 H GLN A 400 14.698 19.376 -11.283 1.00 0.00 H ATOM 1498 N TYR A 401 13.932 16.253 -14.285 1.00 70.83 N ATOM 1499 CA TYR A 401 14.420 15.056 -14.996 1.00 72.31 C ATOM 1500 C TYR A 401 14.621 13.760 -14.139 1.00 73.52 C ATOM 1501 O TYR A 401 15.383 12.884 -14.559 1.00 74.20 O ATOM 1502 CB TYR A 401 15.703 15.381 -15.808 1.00 74.45 C ATOM 1503 CG TYR A 401 15.641 16.730 -16.500 1.00 79.15 C ATOM 1504 CD1 TYR A 401 14.745 16.963 -17.542 1.00 85.25 C ATOM 1505 CD2 TYR A 401 16.432 17.791 -16.071 1.00 78.20 C ATOM 1506 CE1 TYR A 401 14.645 18.217 -18.144 1.00 88.64 C ATOM 1507 CE2 TYR A 401 16.341 19.049 -16.666 1.00 81.10 C ATOM 1508 CZ TYR A 401 15.447 19.257 -17.703 1.00 94.36 C ATOM 1509 OH TYR A 401 15.369 20.491 -18.300 1.00 99.56 O ATOM 1510 HH TYR A 401 14.686 20.467 -19.016 1.00 0.00 H ATOM 1511 H TYR A 401 12.978 16.569 -14.551 1.00 0.00 H ATOM 1512 N ILE A 402 13.881 13.588 -13.018 1.00 66.72 N ATOM 1513 CA ILE A 402 13.931 12.335 -12.238 1.00 64.57 C ATOM 1514 C ILE A 402 12.868 11.391 -12.826 1.00 70.35 C ATOM 1515 O ILE A 402 11.724 11.810 -12.999 1.00 71.08 O ATOM 1516 CB ILE A 402 13.739 12.543 -10.702 1.00 64.53 C ATOM 1517 CG1 ILE A 402 14.852 13.430 -10.095 1.00 62.21 C ATOM 1518 CG2 ILE A 402 13.627 11.199 -9.950 1.00 63.98 C ATOM 1519 CD1 ILE A 402 14.422 14.145 -8.839 1.00 69.61 C ATOM 1520 H ILE A 402 13.261 14.359 -12.698 1.00 0.00 H ATOM 1521 N LYS A 403 13.246 10.129 -13.132 1.00 67.91 N ATOM 1522 CA LYS A 403 12.352 9.115 -13.721 1.00 70.66 C ATOM 1523 C LYS A 403 11.396 8.453 -12.707 1.00 73.33 C ATOM 1524 O LYS A 403 10.213 8.277 -13.013 1.00 75.66 O ATOM 1525 CB LYS A 403 13.158 8.056 -14.489 1.00 74.85 C ATOM 1526 CG LYS A 403 13.623 8.525 -15.861 1.00 89.85 C ATOM 1527 CD LYS A 403 14.952 7.890 -16.257 1.00100.75 C ATOM 1528 CE LYS A 403 15.351 8.197 -17.683 1.00117.25 C ATOM 1529 NZ LYS A 403 15.678 9.635 -17.891 1.00126.22 N ATOM 1530 HZ1 LYS A 403 14.846 10.215 -17.660 1.00 0.00 H ATOM 1531 HZ2 LYS A 403 16.471 9.902 -17.273 1.00 0.00 H ATOM 1532 HZ3 LYS A 403 15.944 9.789 -18.885 1.00 0.00 H ATOM 1533 H LYS A 403 14.231 9.856 -12.939 1.00 0.00 H ATOM 1534 N ASP A 404 11.910 8.078 -11.516 1.00 65.66 N ATOM 1535 CA ASP A 404 11.133 7.457 -10.444 1.00 63.73 C ATOM 1536 C ASP A 404 11.200 8.344 -9.182 1.00 62.92 C ATOM 1537 O ASP A 404 12.052 8.144 -8.312 1.00 60.80 O ATOM 1538 CB ASP A 404 11.612 6.009 -10.198 1.00 65.46 C ATOM 1539 CG ASP A 404 10.788 5.171 -9.230 1.00 74.58 C ATOM 1540 OD1 ASP A 404 9.719 5.646 -8.781 1.00 74.93 O ATOM 1541 OD2 ASP A 404 11.219 4.045 -8.910 1.00 81.81 O ATOM 1542 H ASP A 404 12.924 8.241 -11.350 1.00 0.00 H ATOM 1543 N ARG A 405 10.277 9.329 -9.119 1.00 57.79 N ATOM 1544 CA ARG A 405 10.165 10.309 -8.029 1.00 54.51 C ATOM 1545 C ARG A 405 9.760 9.696 -6.696 1.00 56.23 C ATOM 1546 O ARG A 405 10.213 10.174 -5.652 1.00 52.68 O ATOM 1547 CB ARG A 405 9.184 11.428 -8.390 1.00 55.17 C ATOM 1548 CG ARG A 405 9.283 11.860 -9.825 1.00 61.16 C ATOM 1549 CD ARG A 405 8.860 13.286 -10.016 1.00 63.30 C ATOM 1550 NE ARG A 405 9.371 13.769 -11.292 1.00 60.77 N ATOM 1551 CZ ARG A 405 10.541 14.373 -11.437 1.00 63.74 C ATOM 1552 NH1 ARG A 405 11.292 14.640 -10.378 1.00 47.24 N ATOM 1553 NH2 ARG A 405 10.939 14.777 -12.633 1.00 48.09 N ATOM 1554 HE ARG A 405 8.783 13.632 -12.139 1.00 0.00 H ATOM 1555 HH12 ARG A 405 12.210 15.114 -10.498 1.00 0.00 H ATOM 1556 HH11 ARG A 405 10.964 14.375 -9.427 1.00 0.00 H ATOM 1557 HH22 ARG A 405 11.858 15.251 -12.743 1.00 0.00 H ATOM 1558 HH21 ARG A 405 10.332 14.621 -13.463 1.00 0.00 H ATOM 1559 H ARG A 405 9.594 9.399 -9.901 1.00 0.00 H ATOM 1560 N GLU A 406 8.902 8.649 -6.720 1.00 53.53 N ATOM 1561 CA GLU A 406 8.423 7.931 -5.534 1.00 52.03 C ATOM 1562 C GLU A 406 9.598 7.257 -4.817 1.00 50.85 C ATOM 1563 O GLU A 406 9.629 7.243 -3.583 1.00 47.56 O ATOM 1564 CB GLU A 406 7.343 6.901 -5.925 1.00 56.85 C ATOM 1565 CG GLU A 406 6.682 6.197 -4.750 1.00 72.51 C ATOM 1566 CD GLU A 406 6.640 4.682 -4.849 1.00 99.47 C ATOM 1567 OE1 GLU A 406 7.684 4.070 -5.178 1.00105.41 O ATOM 1568 OE2 GLU A 406 5.571 4.102 -4.552 1.00 89.92 O ATOM 1569 H GLU A 406 8.557 8.330 -7.648 1.00 0.00 H ATOM 1570 N ALA A 407 10.562 6.706 -5.592 1.00 47.30 N ATOM 1571 CA ALA A 407 11.776 6.089 -5.045 1.00 45.64 C ATOM 1572 C ALA A 407 12.585 7.121 -4.236 1.00 45.09 C ATOM 1573 O ALA A 407 13.118 6.779 -3.186 1.00 43.78 O ATOM 1574 CB ALA A 407 12.634 5.527 -6.169 1.00 47.69 C ATOM 1575 H ALA A 407 10.436 6.721 -6.624 1.00 0.00 H ATOM 1576 N VAL A 408 12.648 8.378 -4.713 1.00 40.24 N ATOM 1577 CA VAL A 408 13.368 9.470 -4.036 1.00 37.50 C ATOM 1578 C VAL A 408 12.602 9.906 -2.778 1.00 41.42 C ATOM 1579 O VAL A 408 13.227 10.144 -1.748 1.00 39.53 O ATOM 1580 CB VAL A 408 13.711 10.665 -4.979 1.00 40.98 C ATOM 1581 CG1 VAL A 408 14.626 11.686 -4.278 1.00 37.99 C ATOM 1582 CG2 VAL A 408 14.346 10.174 -6.284 1.00 41.82 C ATOM 1583 H VAL A 408 12.162 8.590 -5.608 1.00 0.00 H ATOM 1584 N GLU A 409 11.255 9.966 -2.858 1.00 40.78 N ATOM 1585 CA GLU A 409 10.365 10.302 -1.733 1.00 40.09 C ATOM 1586 C GLU A 409 10.583 9.317 -0.591 1.00 42.79 C ATOM 1587 O GLU A 409 10.687 9.735 0.564 1.00 40.21 O ATOM 1588 CB GLU A 409 8.879 10.252 -2.152 1.00 43.61 C ATOM 1589 CG GLU A 409 8.429 11.383 -3.055 1.00 54.33 C ATOM 1590 CD GLU A 409 6.934 11.502 -3.299 1.00 77.41 C ATOM 1591 OE1 GLU A 409 6.263 10.461 -3.490 1.00 61.05 O ATOM 1592 OE2 GLU A 409 6.438 12.651 -3.334 1.00 79.74 O ATOM 1593 H GLU A 409 10.815 9.761 -3.778 1.00 0.00 H ATOM 1594 N LYS A 410 10.691 8.010 -0.921 1.00 41.68 N ATOM 1595 CA LYS A 410 10.911 6.943 0.058 1.00 41.27 C ATOM 1596 C LYS A 410 12.209 7.147 0.818 1.00 42.07 C ATOM 1597 O LYS A 410 12.291 6.738 1.970 1.00 40.56 O ATOM 1598 CB LYS A 410 10.885 5.558 -0.604 1.00 45.86 C ATOM 1599 CG LYS A 410 9.499 4.942 -0.716 1.00 56.85 C ATOM 1600 CD LYS A 410 9.594 3.565 -1.364 1.00 70.00 C ATOM 1601 CE LYS A 410 8.280 3.081 -1.920 1.00 86.94 C ATOM 1602 NZ LYS A 410 8.449 1.828 -2.703 1.00 99.24 N ATOM 1603 HZ1 LYS A 410 9.099 2.001 -3.496 1.00 0.00 H ATOM 1604 HZ2 LYS A 410 8.840 1.086 -2.088 1.00 0.00 H ATOM 1605 HZ3 LYS A 410 7.525 1.523 -3.071 1.00 0.00 H ATOM 1606 H LYS A 410 10.614 7.748 -1.925 1.00 0.00 H ATOM 1607 N LEU A 411 13.214 7.799 0.189 1.00 37.60 N ATOM 1608 CA LEU A 411 14.490 8.084 0.844 1.00 35.57 C ATOM 1609 C LEU A 411 14.464 9.400 1.659 1.00 38.39 C ATOM 1610 O LEU A 411 15.110 9.484 2.697 1.00 37.39 O ATOM 1611 CB LEU A 411 15.646 8.108 -0.172 1.00 35.35 C ATOM 1612 CG LEU A 411 15.928 6.839 -0.981 1.00 42.26 C ATOM 1613 CD1 LEU A 411 17.125 7.044 -1.872 1.00 42.63 C ATOM 1614 CD2 LEU A 411 16.140 5.616 -0.083 1.00 44.26 C ATOM 1615 H LEU A 411 13.074 8.108 -0.794 1.00 0.00 H ATOM 1616 N GLN A 412 13.753 10.429 1.180 1.00 35.59 N ATOM 1617 CA GLN A 412 13.715 11.727 1.852 1.00 33.35 C ATOM 1618 C GLN A 412 12.797 11.767 3.081 1.00 36.95 C ATOM 1619 O GLN A 412 13.160 12.405 4.070 1.00 34.44 O ATOM 1620 CB GLN A 412 13.338 12.853 0.873 1.00 35.38 C ATOM 1621 CG GLN A 412 13.602 14.264 1.432 1.00 35.66 C ATOM 1622 CD GLN A 412 12.865 15.345 0.685 1.00 43.40 C ATOM 1623 OE1 GLN A 412 11.668 15.260 0.458 1.00 38.59 O ATOM 1624 NE2 GLN A 412 13.559 16.398 0.299 1.00 36.31 N ATOM 1625 HE22 GLN A 412 14.578 16.452 0.502 1.00 0.00 H ATOM 1626 HE21 GLN A 412 13.088 17.174 -0.208 1.00 0.00 H ATOM 1627 H GLN A 412 13.211 10.301 0.302 1.00 0.00 H ATOM 1628 N GLU A 413 11.602 11.137 3.005 1.00 35.12 N ATOM 1629 CA GLU A 413 10.625 11.130 4.110 1.00 35.95 C ATOM 1630 C GLU A 413 11.259 10.685 5.468 1.00 39.16 C ATOM 1631 O GLU A 413 11.052 11.396 6.450 1.00 37.80 O ATOM 1632 CB GLU A 413 9.370 10.305 3.743 1.00 39.16 C ATOM 1633 CG GLU A 413 8.210 10.497 4.711 1.00 54.46 C ATOM 1634 CD GLU A 413 6.797 10.370 4.165 1.00 84.97 C ATOM 1635 OE1 GLU A 413 6.622 10.363 2.924 1.00 82.28 O ATOM 1636 OE2 GLU A 413 5.855 10.326 4.991 1.00 83.02 O ATOM 1637 H GLU A 413 11.361 10.634 2.127 1.00 0.00 H ATOM 1638 N PRO A 414 12.064 9.583 5.546 1.00 37.31 N ATOM 1639 CA PRO A 414 12.676 9.204 6.834 1.00 36.43 C ATOM 1640 C PRO A 414 13.627 10.253 7.390 1.00 38.09 C ATOM 1641 O PRO A 414 13.671 10.403 8.598 1.00 37.63 O ATOM 1642 CB PRO A 414 13.451 7.923 6.506 1.00 38.54 C ATOM 1643 CG PRO A 414 12.893 7.432 5.240 1.00 44.46 C ATOM 1644 CD PRO A 414 12.440 8.618 4.491 1.00 39.62 C ATOM 1645 N LEU A 415 14.356 10.992 6.521 1.00 34.43 N ATOM 1646 CA LEU A 415 15.281 12.062 6.932 1.00 33.23 C ATOM 1647 C LEU A 415 14.513 13.234 7.546 1.00 33.89 C ATOM 1648 O LEU A 415 14.948 13.807 8.547 1.00 32.13 O ATOM 1649 CB LEU A 415 16.132 12.548 5.746 1.00 33.06 C ATOM 1650 CG LEU A 415 17.058 11.520 5.086 1.00 39.58 C ATOM 1651 CD1 LEU A 415 17.507 12.021 3.748 1.00 40.65 C ATOM 1652 CD2 LEU A 415 18.277 11.228 5.948 1.00 43.09 C ATOM 1653 H LEU A 415 14.257 10.793 5.505 1.00 0.00 H ATOM 1654 N LEU A 416 13.358 13.592 6.951 1.00 31.54 N ATOM 1655 CA LEU A 416 12.506 14.662 7.491 1.00 31.26 C ATOM 1656 C LEU A 416 11.932 14.207 8.840 1.00 35.39 C ATOM 1657 O LEU A 416 11.782 15.032 9.740 1.00 34.80 O ATOM 1658 CB LEU A 416 11.338 14.988 6.534 1.00 32.55 C ATOM 1659 CG LEU A 416 11.657 15.727 5.238 1.00 37.11 C ATOM 1660 CD1 LEU A 416 10.481 15.616 4.268 1.00 39.76 C ATOM 1661 CD2 LEU A 416 11.987 17.200 5.494 1.00 39.47 C ATOM 1662 H LEU A 416 13.061 13.098 6.086 1.00 0.00 H ATOM 1663 N ASP A 417 11.599 12.903 8.970 1.00 34.16 N ATOM 1664 CA ASP A 417 11.042 12.349 10.217 1.00 35.48 C ATOM 1665 C ASP A 417 12.081 12.450 11.325 1.00 38.02 C ATOM 1666 O ASP A 417 11.788 13.007 12.385 1.00 36.66 O ATOM 1667 CB ASP A 417 10.559 10.898 10.039 1.00 38.84 C ATOM 1668 CG ASP A 417 9.270 10.741 9.250 1.00 58.94 C ATOM 1669 OD1 ASP A 417 8.458 11.689 9.239 1.00 61.02 O ATOM 1670 OD2 ASP A 417 9.054 9.650 8.676 1.00 69.64 O ATOM 1671 H ASP A 417 11.741 12.267 8.160 1.00 0.00 H ATOM 1672 N VAL A 418 13.328 12.017 11.029 1.00 33.05 N ATOM 1673 CA VAL A 418 14.439 12.105 11.971 1.00 32.61 C ATOM 1674 C VAL A 418 14.679 13.574 12.377 1.00 34.20 C ATOM 1675 O VAL A 418 14.767 13.860 13.567 1.00 33.27 O ATOM 1676 CB VAL A 418 15.730 11.441 11.407 1.00 35.80 C ATOM 1677 CG1 VAL A 418 16.943 11.712 12.312 1.00 35.55 C ATOM 1678 CG2 VAL A 418 15.536 9.949 11.243 1.00 36.63 C ATOM 1679 H VAL A 418 13.502 11.604 10.091 1.00 0.00 H ATOM 1680 N LEU A 419 14.769 14.498 11.388 1.00 30.12 N ATOM 1681 CA LEU A 419 15.025 15.906 11.669 1.00 30.02 C ATOM 1682 C LEU A 419 13.958 16.502 12.581 1.00 34.33 C ATOM 1683 O LEU A 419 14.307 17.174 13.551 1.00 34.19 O ATOM 1684 CB LEU A 419 15.206 16.739 10.372 1.00 30.21 C ATOM 1685 CG LEU A 419 15.529 18.256 10.547 1.00 34.58 C ATOM 1686 CD1 LEU A 419 16.871 18.488 11.255 1.00 33.16 C ATOM 1687 CD2 LEU A 419 15.524 18.958 9.207 1.00 35.20 C ATOM 1688 H LEU A 419 14.652 14.193 10.400 1.00 0.00 H ATOM 1689 N GLN A 420 12.665 16.230 12.306 1.00 32.46 N ATOM 1690 CA GLN A 420 11.575 16.758 13.135 1.00 33.83 C ATOM 1691 C GLN A 420 11.656 16.192 14.563 1.00 36.89 C ATOM 1692 O GLN A 420 11.492 16.939 15.528 1.00 37.68 O ATOM 1693 CB GLN A 420 10.212 16.477 12.500 1.00 36.74 C ATOM 1694 CG GLN A 420 9.105 17.366 13.065 1.00 45.10 C ATOM 1695 CD GLN A 420 7.952 16.611 13.681 1.00 70.63 C ATOM 1696 OE1 GLN A 420 8.011 15.402 13.946 1.00 63.46 O ATOM 1697 NE2 GLN A 420 6.870 17.328 13.941 1.00 68.97 N ATOM 1698 HE22 GLN A 420 6.849 18.341 13.708 1.00 0.00 H ATOM 1699 HE21 GLN A 420 6.041 16.878 14.379 1.00 0.00 H ATOM 1700 H GLN A 420 12.435 15.632 11.487 1.00 0.00 H ATOM 1701 N LYS A 421 11.980 14.894 14.690 1.00 33.95 N ATOM 1702 CA LYS A 421 12.161 14.237 15.989 1.00 35.06 C ATOM 1703 C LYS A 421 13.332 14.853 16.774 1.00 39.87 C ATOM 1704 O LYS A 421 13.172 15.104 17.961 1.00 41.41 O ATOM 1705 CB LYS A 421 12.343 12.724 15.827 1.00 37.70 C ATOM 1706 CG LYS A 421 11.799 11.922 17.004 1.00 54.32 C ATOM 1707 CD LYS A 421 11.820 10.436 16.701 1.00 66.27 C ATOM 1708 CE LYS A 421 10.781 9.651 17.463 1.00 69.97 C ATOM 1709 NZ LYS A 421 10.785 8.219 17.063 1.00 70.43 N ATOM 1710 HZ1 LYS A 421 10.578 8.144 16.047 1.00 0.00 H ATOM 1711 HZ2 LYS A 421 11.720 7.808 17.259 1.00 0.00 H ATOM 1712 HZ3 LYS A 421 10.060 7.707 17.605 1.00 0.00 H ATOM 1713 H LYS A 421 12.108 14.329 13.827 1.00 0.00 H ATOM 1714 N LEU A 422 14.472 15.148 16.109 1.00 36.75 N ATOM 1715 CA LEU A 422 15.633 15.780 16.752 1.00 37.86 C ATOM 1716 C LEU A 422 15.303 17.184 17.268 1.00 43.85 C ATOM 1717 O LEU A 422 15.852 17.610 18.284 1.00 44.66 O ATOM 1718 CB LEU A 422 16.852 15.835 15.818 1.00 36.76 C ATOM 1719 CG LEU A 422 17.635 14.521 15.577 1.00 41.84 C ATOM 1720 CD1 LEU A 422 18.765 14.750 14.621 1.00 41.36 C ATOM 1721 CD2 LEU A 422 18.204 13.945 16.855 1.00 45.32 C ATOM 1722 H LEU A 422 14.530 14.917 15.097 1.00 0.00 H ATOM 1723 N CYS A 423 14.412 17.901 16.567 1.00 41.53 N ATOM 1724 CA CYS A 423 13.944 19.223 16.994 1.00 42.86 C ATOM 1725 C CYS A 423 13.121 19.097 18.293 1.00 48.25 C ATOM 1726 O CYS A 423 13.335 19.868 19.229 1.00 48.70 O ATOM 1727 CB CYS A 423 13.137 19.890 15.886 1.00 43.06 C ATOM 1728 SG CYS A 423 14.116 20.367 14.445 1.00 45.09 S ATOM 1729 H CYS A 423 14.037 17.502 15.683 1.00 0.00 H ATOM 1730 N LYS A 424 12.206 18.105 18.351 1.00 46.14 N ATOM 1731 CA LYS A 424 11.344 17.847 19.511 1.00 48.25 C ATOM 1732 C LYS A 424 12.136 17.389 20.741 1.00 55.43 C ATOM 1733 O LYS A 424 11.763 17.730 21.867 1.00 58.52 O ATOM 1734 CB LYS A 424 10.265 16.812 19.178 1.00 50.22 C ATOM 1735 CG LYS A 424 9.139 17.317 18.284 1.00 62.80 C ATOM 1736 CD LYS A 424 8.341 16.135 17.758 1.00 72.77 C ATOM 1737 CE LYS A 424 6.964 16.499 17.273 1.00 85.21 C ATOM 1738 NZ LYS A 424 6.199 15.291 16.863 1.00 91.96 N ATOM 1739 HZ1 LYS A 424 6.704 14.807 16.094 1.00 0.00 H ATOM 1740 HZ2 LYS A 424 6.105 14.649 17.676 1.00 0.00 H ATOM 1741 HZ3 LYS A 424 5.254 15.576 16.534 1.00 0.00 H ATOM 1742 H LYS A 424 12.106 17.485 17.522 1.00 0.00 H ATOM 1743 N ILE A 425 13.217 16.617 20.527 1.00 50.15 N ATOM 1744 CA ILE A 425 14.078 16.100 21.592 1.00 50.64 C ATOM 1745 C ILE A 425 14.990 17.189 22.186 1.00 55.76 C ATOM 1746 O ILE A 425 14.991 17.387 23.400 1.00 57.49 O ATOM 1747 CB ILE A 425 14.889 14.855 21.088 1.00 51.88 C ATOM 1748 CG1 ILE A 425 13.969 13.640 20.847 1.00 51.39 C ATOM 1749 CG2 ILE A 425 16.052 14.483 22.037 1.00 53.88 C ATOM 1750 CD1 ILE A 425 14.536 12.624 19.837 1.00 54.93 C ATOM 1751 H ILE A 425 13.455 16.373 19.545 1.00 0.00 H ATOM 1752 N HIS A 426 15.775 17.863 21.333 1.00 51.22 N ATOM 1753 CA HIS A 426 16.797 18.837 21.718 1.00 52.09 C ATOM 1754 C HIS A 426 16.297 20.249 21.966 1.00 56.19 C ATOM 1755 O HIS A 426 16.972 20.999 22.668 1.00 57.55 O ATOM 1756 CB HIS A 426 17.933 18.835 20.691 1.00 51.55 C ATOM 1757 CG HIS A 426 18.649 17.523 20.679 1.00 54.94 C ATOM 1758 ND1 HIS A 426 18.356 16.554 19.742 1.00 55.69 N ATOM 1759 CD2 HIS A 426 19.541 17.020 21.564 1.00 58.31 C ATOM 1760 CE1 HIS A 426 19.117 15.514 20.050 1.00 55.41 C ATOM 1761 NE2 HIS A 426 19.847 15.748 21.138 1.00 57.36 N ATOM 1762 H HIS A 426 15.647 17.679 20.317 1.00 0.00 H ATOM 1763 N GLN A 427 15.140 20.622 21.405 1.00 52.62 N ATOM 1764 CA GLN A 427 14.532 21.939 21.646 1.00 55.13 C ATOM 1765 C GLN A 427 13.016 21.764 21.947 1.00 60.22 C ATOM 1766 O GLN A 427 12.184 22.275 21.189 1.00 59.58 O ATOM 1767 CB GLN A 427 14.792 22.896 20.465 1.00 55.63 C ATOM 1768 CG GLN A 427 16.231 23.384 20.377 1.00 69.98 C ATOM 1769 CD GLN A 427 16.380 24.616 19.527 1.00 95.55 C ATOM 1770 OE1 GLN A 427 15.579 25.561 19.590 1.00 95.96 O ATOM 1771 NE2 GLN A 427 17.455 24.663 18.757 1.00 85.71 N ATOM 1772 HE22 GLN A 427 18.108 23.854 18.726 1.00 0.00 H ATOM 1773 HE21 GLN A 427 17.647 25.509 18.183 1.00 0.00 H ATOM 1774 H GLN A 427 14.652 19.954 20.774 1.00 0.00 H ATOM 1775 N PRO A 428 12.622 21.023 23.025 1.00 58.70 N ATOM 1776 CA PRO A 428 11.183 20.829 23.293 1.00 60.26 C ATOM 1777 C PRO A 428 10.424 22.107 23.649 1.00 66.70 C ATOM 1778 O PRO A 428 9.200 22.138 23.498 1.00 67.69 O ATOM 1779 CB PRO A 428 11.173 19.837 24.459 1.00 63.42 C ATOM 1780 CG PRO A 428 12.468 20.062 25.156 1.00 68.04 C ATOM 1781 CD PRO A 428 13.442 20.333 24.044 1.00 61.04 C ATOM 1782 N GLU A 429 11.148 23.150 24.115 1.00 63.85 N ATOM 1783 CA GLU A 429 10.589 24.447 24.512 1.00 66.11 C ATOM 1784 C GLU A 429 10.359 25.390 23.312 1.00 68.27 C ATOM 1785 O GLU A 429 9.676 26.406 23.451 1.00 70.07 O ATOM 1786 CB GLU A 429 11.463 25.105 25.610 1.00 69.58 C ATOM 1787 CG GLU A 429 12.703 25.860 25.126 1.00 79.97 C ATOM 1788 CD GLU A 429 13.724 25.128 24.272 1.00 99.93 C ATOM 1789 OE1 GLU A 429 13.970 23.923 24.514 1.00 89.18 O ATOM 1790 OE2 GLU A 429 14.303 25.777 23.370 1.00 97.90 O ATOM 1791 H GLU A 429 12.177 23.023 24.198 1.00 0.00 H ATOM 1792 N ASN A 430 10.919 25.046 22.139 1.00 61.42 N ATOM 1793 CA ASN A 430 10.777 25.847 20.924 1.00 60.01 C ATOM 1794 C ASN A 430 10.077 24.997 19.843 1.00 62.22 C ATOM 1795 O ASN A 430 10.757 24.462 18.956 1.00 59.23 O ATOM 1796 CB ASN A 430 12.153 26.382 20.489 1.00 56.38 C ATOM 1797 CG ASN A 430 12.178 27.332 19.309 1.00 80.23 C ATOM 1798 OD1 ASN A 430 11.160 27.899 18.885 1.00 78.83 O ATOM 1799 ND2 ASN A 430 13.373 27.551 18.772 1.00 68.02 N ATOM 1800 HD22 ASN A 430 14.210 27.061 19.148 1.00 0.00 H ATOM 1801 HD21 ASN A 430 13.472 28.212 17.975 1.00 0.00 H ATOM 1802 H ASN A 430 11.479 24.170 22.094 1.00 0.00 H ATOM 1803 N PRO A 431 8.720 24.837 19.910 1.00 60.01 N ATOM 1804 CA PRO A 431 8.026 23.975 18.929 1.00 58.60 C ATOM 1805 C PRO A 431 8.068 24.441 17.479 1.00 62.18 C ATOM 1806 O PRO A 431 7.728 23.661 16.587 1.00 62.53 O ATOM 1807 CB PRO A 431 6.592 23.911 19.460 1.00 62.89 C ATOM 1808 CG PRO A 431 6.424 25.166 20.236 1.00 69.88 C ATOM 1809 CD PRO A 431 7.760 25.392 20.888 1.00 64.97 C ATOM 1810 N GLN A 432 8.489 25.688 17.237 1.00 57.51 N ATOM 1811 CA GLN A 432 8.615 26.206 15.882 1.00 55.83 C ATOM 1812 C GLN A 432 10.022 25.982 15.288 1.00 54.00 C ATOM 1813 O GLN A 432 10.287 26.468 14.182 1.00 52.07 O ATOM 1814 CB GLN A 432 8.210 27.689 15.814 1.00 59.80 C ATOM 1815 CG GLN A 432 6.730 27.972 16.149 1.00 81.10 C ATOM 1816 CD GLN A 432 5.735 27.186 15.317 1.00 98.03 C ATOM 1817 OE1 GLN A 432 5.820 27.109 14.085 1.00 90.23 O ATOM 1818 NE2 GLN A 432 4.758 26.591 15.982 1.00 93.10 N ATOM 1819 HE22 GLN A 432 4.710 26.672 17.018 1.00 0.00 H ATOM 1820 HE21 GLN A 432 4.038 26.043 15.469 1.00 0.00 H ATOM 1821 H GLN A 432 8.733 26.304 18.039 1.00 0.00 H ATOM 1822 N HIS A 433 10.919 25.246 16.004 1.00 46.95 N ATOM 1823 CA HIS A 433 12.288 25.009 15.518 1.00 43.19 C ATOM 1824 C HIS A 433 12.333 24.310 14.158 1.00 41.03 C ATOM 1825 O HIS A 433 13.082 24.750 13.295 1.00 38.63 O ATOM 1826 CB HIS A 433 13.186 24.288 16.541 1.00 43.07 C ATOM 1827 CG HIS A 433 14.636 24.318 16.152 1.00 44.83 C ATOM 1828 ND1 HIS A 433 15.342 25.507 16.095 1.00 47.20 N ATOM 1829 CD2 HIS A 433 15.447 23.308 15.749 1.00 44.62 C ATOM 1830 CE1 HIS A 433 16.558 25.189 15.683 1.00 45.22 C ATOM 1831 NE2 HIS A 433 16.670 23.876 15.454 1.00 43.94 N ATOM 1832 H HIS A 433 10.628 24.842 16.917 1.00 0.00 H ATOM 1833 N PHE A 434 11.517 23.272 13.955 1.00 38.28 N ATOM 1834 CA PHE A 434 11.481 22.542 12.679 1.00 37.16 C ATOM 1835 C PHE A 434 10.996 23.449 11.533 1.00 42.20 C ATOM 1836 O PHE A 434 11.598 23.431 10.461 1.00 40.60 O ATOM 1837 CB PHE A 434 10.643 21.264 12.796 1.00 38.69 C ATOM 1838 CG PHE A 434 10.618 20.402 11.557 1.00 39.75 C ATOM 1839 CD1 PHE A 434 11.768 19.750 11.118 1.00 39.79 C ATOM 1840 CD2 PHE A 434 9.444 20.236 10.828 1.00 42.90 C ATOM 1841 CE1 PHE A 434 11.746 18.958 9.969 1.00 40.11 C ATOM 1842 CE2 PHE A 434 9.424 19.438 9.680 1.00 44.42 C ATOM 1843 CZ PHE A 434 10.579 18.819 9.250 1.00 40.44 C ATOM 1844 H PHE A 434 10.886 22.970 14.725 1.00 0.00 H ATOM 1845 N ALA A 435 9.958 24.290 11.796 1.00 41.53 N ATOM 1846 CA ALA A 435 9.388 25.274 10.863 1.00 43.63 C ATOM 1847 C ALA A 435 10.458 26.275 10.401 1.00 49.19 C ATOM 1848 O ALA A 435 10.507 26.618 9.218 1.00 48.41 O ATOM 1849 CB ALA A 435 8.228 26.018 11.528 1.00 47.15 C ATOM 1850 H ALA A 435 9.530 24.231 12.742 1.00 0.00 H ATOM 1851 N CYS A 436 11.335 26.711 11.330 1.00 47.96 N ATOM 1852 CA CYS A 436 12.442 27.630 11.040 1.00 48.81 C ATOM 1853 C CYS A 436 13.497 26.959 10.150 1.00 47.29 C ATOM 1854 O CYS A 436 14.066 27.606 9.270 1.00 46.95 O ATOM 1855 CB CYS A 436 13.049 28.162 12.333 1.00 51.55 C ATOM 1856 SG CYS A 436 11.917 29.178 13.314 1.00 60.06 S ATOM 1857 H CYS A 436 11.220 26.376 12.308 1.00 0.00 H ATOM 1858 N LEU A 437 13.721 25.648 10.344 1.00 40.17 N ATOM 1859 CA LEU A 437 14.639 24.876 9.515 1.00 37.05 C ATOM 1860 C LEU A 437 14.081 24.768 8.097 1.00 42.67 C ATOM 1861 O LEU A 437 14.819 24.990 7.135 1.00 41.49 O ATOM 1862 CB LEU A 437 14.937 23.494 10.141 1.00 34.97 C ATOM 1863 CG LEU A 437 15.929 23.511 11.318 1.00 39.20 C ATOM 1864 CD1 LEU A 437 16.056 22.133 11.958 1.00 38.83 C ATOM 1865 CD2 LEU A 437 17.321 23.988 10.890 1.00 40.80 C ATOM 1866 H LEU A 437 13.219 25.165 11.116 1.00 0.00 H ATOM 1867 N LEU A 438 12.750 24.567 7.970 1.00 41.06 N ATOM 1868 CA LEU A 438 12.062 24.528 6.673 1.00 42.14 C ATOM 1869 C LEU A 438 12.174 25.901 5.971 1.00 47.23 C ATOM 1870 O LEU A 438 12.299 25.960 4.744 1.00 44.98 O ATOM 1871 CB LEU A 438 10.581 24.148 6.849 1.00 43.69 C ATOM 1872 CG LEU A 438 10.262 22.735 7.351 1.00 46.94 C ATOM 1873 CD1 LEU A 438 8.765 22.550 7.469 1.00 48.89 C ATOM 1874 CD2 LEU A 438 10.829 21.674 6.436 1.00 48.27 C ATOM 1875 H LEU A 438 12.186 24.433 8.833 1.00 0.00 H ATOM 1876 N GLY A 439 12.177 26.966 6.777 1.00 46.95 N ATOM 1877 CA GLY A 439 12.333 28.344 6.330 1.00 49.74 C ATOM 1878 C GLY A 439 13.663 28.592 5.652 1.00 54.34 C ATOM 1879 O GLY A 439 13.734 29.388 4.712 1.00 55.87 O ATOM 1880 H GLY A 439 12.060 26.800 7.797 1.00 0.00 H ATOM 1881 N ARG A 440 14.726 27.904 6.112 1.00 49.60 N ATOM 1882 CA ARG A 440 16.052 28.027 5.502 1.00 48.09 C ATOM 1883 C ARG A 440 16.120 27.233 4.210 1.00 50.13 C ATOM 1884 O ARG A 440 16.878 27.611 3.318 1.00 50.23 O ATOM 1885 CB ARG A 440 17.177 27.619 6.469 1.00 47.56 C ATOM 1886 CG ARG A 440 17.191 28.392 7.784 1.00 60.12 C ATOM 1887 CD ARG A 440 17.396 29.890 7.647 1.00 67.12 C ATOM 1888 NE ARG A 440 17.048 30.594 8.886 1.00 79.66 N ATOM 1889 CZ ARG A 440 15.812 30.946 9.232 1.00 96.19 C ATOM 1890 NH1 ARG A 440 14.785 30.660 8.439 1.00 86.42 N ATOM 1891 NH2 ARG A 440 15.592 31.576 10.380 1.00 79.93 N ATOM 1892 HE ARG A 440 17.821 30.835 9.539 1.00 0.00 H ATOM 1893 HH12 ARG A 440 13.822 30.938 8.715 1.00 0.00 H ATOM 1894 HH11 ARG A 440 14.945 30.158 7.542 1.00 0.00 H ATOM 1895 HH22 ARG A 440 14.624 31.849 10.646 1.00 0.00 H ATOM 1896 HH21 ARG A 440 16.387 31.796 11.013 1.00 0.00 H ATOM 1897 H ARG A 440 14.601 27.267 6.924 1.00 0.00 H ATOM 1898 N LEU A 441 15.311 26.159 4.095 1.00 45.30 N ATOM 1899 CA LEU A 441 15.222 25.298 2.909 1.00 45.95 C ATOM 1900 C LEU A 441 14.597 26.060 1.717 1.00 50.21 C ATOM 1901 O LEU A 441 15.046 25.914 0.577 1.00 49.57 O ATOM 1902 CB LEU A 441 14.369 24.058 3.250 1.00 46.65 C ATOM 1903 CG LEU A 441 14.762 22.721 2.641 1.00 52.11 C ATOM 1904 CD1 LEU A 441 16.092 22.251 3.183 1.00 51.34 C ATOM 1905 CD2 LEU A 441 13.722 21.665 2.961 1.00 54.57 C ATOM 1906 H LEU A 441 14.705 25.924 4.907 1.00 0.00 H ATOM 1907 N THR A 442 13.554 26.851 1.986 1.00 47.63 N ATOM 1908 CA THR A 442 12.876 27.650 0.965 1.00 49.91 C ATOM 1909 C THR A 442 13.771 28.831 0.566 1.00 55.79 C ATOM 1910 O THR A 442 13.926 29.110 -0.627 1.00 56.18 O ATOM 1911 CB THR A 442 11.465 28.038 1.421 1.00 60.21 C ATOM 1912 OG1 THR A 442 11.560 28.767 2.644 1.00 57.97 O ATOM 1913 CG2 THR A 442 10.556 26.820 1.606 1.00 58.80 C ATOM 1914 HG1 THR A 442 11.991 28.200 3.332 1.00 0.00 H ATOM 1915 H THR A 442 13.209 26.901 2.966 1.00 0.00 H ATOM 1916 N GLU A 443 14.420 29.471 1.561 1.00 52.68 N ATOM 1917 CA GLU A 443 15.381 30.562 1.350 1.00 53.08 C ATOM 1918 C GLU A 443 16.558 30.058 0.475 1.00 52.37 C ATOM 1919 O GLU A 443 17.042 30.805 -0.371 1.00 52.68 O ATOM 1920 CB GLU A 443 15.876 31.099 2.705 1.00 54.35 C ATOM 1921 CG GLU A 443 16.490 32.490 2.658 1.00 68.08 C ATOM 1922 CD GLU A 443 17.001 33.036 3.982 1.00 88.99 C ATOM 1923 OE1 GLU A 443 16.617 32.498 5.049 1.00 80.81 O ATOM 1924 OE2 GLU A 443 17.766 34.028 3.951 1.00 79.44 O ATOM 1925 H GLU A 443 14.228 29.173 2.539 1.00 0.00 H ATOM 1926 N LEU A 444 16.964 28.776 0.640 1.00 44.17 N ATOM 1927 CA LEU A 444 18.019 28.121 -0.143 1.00 41.75 C ATOM 1928 C LEU A 444 17.639 27.990 -1.613 1.00 46.12 C ATOM 1929 O LEU A 444 18.491 28.183 -2.482 1.00 46.30 O ATOM 1930 CB LEU A 444 18.304 26.704 0.391 1.00 39.13 C ATOM 1931 CG LEU A 444 19.569 26.449 1.183 1.00 39.75 C ATOM 1932 CD1 LEU A 444 19.708 24.965 1.447 1.00 36.40 C ATOM 1933 CD2 LEU A 444 20.806 26.961 0.466 1.00 39.72 C ATOM 1934 H LEU A 444 16.493 28.214 1.377 1.00 0.00 H ATOM 1935 N ARG A 445 16.367 27.637 -1.884 1.00 43.66 N ATOM 1936 CA ARG A 445 15.811 27.486 -3.231 1.00 45.11 C ATOM 1937 C ARG A 445 15.929 28.753 -4.079 1.00 49.23 C ATOM 1938 O ARG A 445 16.126 28.635 -5.285 1.00 50.25 O ATOM 1939 CB ARG A 445 14.355 27.024 -3.179 1.00 49.05 C ATOM 1940 CG ARG A 445 14.199 25.546 -2.833 1.00 60.17 C ATOM 1941 CD ARG A 445 13.693 24.780 -4.035 1.00 71.96 C ATOM 1942 NE ARG A 445 13.857 23.337 -3.863 1.00 76.20 N ATOM 1943 CZ ARG A 445 13.471 22.425 -4.751 1.00 87.02 C ATOM 1944 NH1 ARG A 445 12.887 22.795 -5.887 1.00 70.03 N ATOM 1945 NH2 ARG A 445 13.671 21.137 -4.513 1.00 69.33 N ATOM 1946 HE ARG A 445 14.306 23.001 -2.987 1.00 0.00 H ATOM 1947 HH12 ARG A 445 12.588 22.076 -6.576 1.00 0.00 H ATOM 1948 HH11 ARG A 445 12.729 23.803 -6.086 1.00 0.00 H ATOM 1949 HH22 ARG A 445 13.368 20.426 -5.209 1.00 0.00 H ATOM 1950 HH21 ARG A 445 14.131 20.837 -3.630 1.00 0.00 H ATOM 1951 H ARG A 445 15.734 27.459 -1.078 1.00 0.00 H ATOM 1952 N THR A 446 15.863 29.947 -3.458 1.00 45.30 N ATOM 1953 CA THR A 446 15.989 31.231 -4.172 1.00 48.43 C ATOM 1954 C THR A 446 17.390 31.418 -4.775 1.00 51.00 C ATOM 1955 O THR A 446 17.517 32.083 -5.791 1.00 50.63 O ATOM 1956 CB THR A 446 15.592 32.433 -3.291 1.00 56.94 C ATOM 1957 OG1 THR A 446 16.608 32.654 -2.308 1.00 56.92 O ATOM 1958 CG2 THR A 446 14.225 32.263 -2.629 1.00 55.27 C ATOM 1959 HG1 THR A 446 16.702 31.846 -1.744 1.00 0.00 H ATOM 1960 H THR A 446 15.717 29.964 -2.428 1.00 0.00 H ATOM 1961 N PHE A 447 18.429 30.804 -4.177 1.00 46.68 N ATOM 1962 CA PHE A 447 19.801 30.907 -4.681 1.00 45.85 C ATOM 1963 C PHE A 447 19.988 30.244 -6.037 1.00 48.95 C ATOM 1964 O PHE A 447 20.955 30.557 -6.721 1.00 47.40 O ATOM 1965 CB PHE A 447 20.825 30.413 -3.649 1.00 45.63 C ATOM 1966 CG PHE A 447 20.961 31.397 -2.509 1.00 47.94 C ATOM 1967 CD1 PHE A 447 21.740 32.545 -2.648 1.00 52.54 C ATOM 1968 CD2 PHE A 447 20.250 31.221 -1.330 1.00 49.68 C ATOM 1969 CE1 PHE A 447 21.827 33.481 -1.616 1.00 54.08 C ATOM 1970 CE2 PHE A 447 20.333 32.160 -0.298 1.00 53.58 C ATOM 1971 CZ PHE A 447 21.119 33.285 -0.449 1.00 52.94 C ATOM 1972 H PHE A 447 18.251 30.235 -3.325 1.00 0.00 H ATOM 1973 N ASN A 448 19.034 29.402 -6.463 1.00 47.70 N ATOM 1974 CA ASN A 448 19.067 28.763 -7.780 1.00 49.69 C ATOM 1975 C ASN A 448 18.948 29.815 -8.852 1.00 57.65 C ATOM 1976 O ASN A 448 19.762 29.820 -9.773 1.00 57.91 O ATOM 1977 CB ASN A 448 17.964 27.704 -7.914 1.00 52.78 C ATOM 1978 CG ASN A 448 18.308 26.396 -7.230 1.00 63.37 C ATOM 1979 OD1 ASN A 448 19.446 25.925 -7.268 1.00 51.57 O ATOM 1980 ND2 ASN A 448 17.328 25.774 -6.599 1.00 53.10 N ATOM 1981 HD22 ASN A 448 16.375 26.190 -6.580 1.00 0.00 H ATOM 1982 HD21 ASN A 448 17.509 24.868 -6.121 1.00 0.00 H ATOM 1983 H ASN A 448 18.236 29.194 -5.830 1.00 0.00 H ATOM 1984 N HIS A 449 17.996 30.761 -8.677 1.00 57.33 N ATOM 1985 CA HIS A 449 17.771 31.875 -9.589 1.00 61.46 C ATOM 1986 C HIS A 449 18.869 32.931 -9.434 1.00 64.57 C ATOM 1987 O HIS A 449 19.396 33.381 -10.448 1.00 66.13 O ATOM 1988 CB HIS A 449 16.328 32.430 -9.467 1.00 65.87 C ATOM 1989 CG HIS A 449 16.144 33.649 -8.611 1.00 71.08 C ATOM 1990 ND1 HIS A 449 16.234 34.926 -9.146 1.00 76.00 N ATOM 1991 CD2 HIS A 449 15.790 33.747 -7.307 1.00 72.15 C ATOM 1992 CE1 HIS A 449 15.981 35.754 -8.144 1.00 76.17 C ATOM 1993 NE2 HIS A 449 15.715 35.092 -7.016 1.00 74.32 N ATOM 1994 H HIS A 449 17.386 30.688 -7.838 1.00 0.00 H ATOM 1995 N HIS A 450 19.267 33.270 -8.183 1.00 58.92 N ATOM 1996 CA HIS A 450 20.350 34.225 -7.921 1.00 58.62 C ATOM 1997 C HIS A 450 21.663 33.775 -8.595 1.00 59.06 C ATOM 1998 O HIS A 450 22.304 34.587 -9.253 1.00 60.06 O ATOM 1999 CB HIS A 450 20.570 34.434 -6.411 1.00 58.26 C ATOM 2000 CG HIS A 450 19.526 35.272 -5.739 1.00 63.91 C ATOM 2001 ND1 HIS A 450 18.829 34.806 -4.638 1.00 64.82 N ATOM 2002 CD2 HIS A 450 19.121 36.535 -6.009 1.00 69.31 C ATOM 2003 CE1 HIS A 450 18.008 35.783 -4.292 1.00 66.84 C ATOM 2004 NE2 HIS A 450 18.149 36.844 -5.087 1.00 70.03 N ATOM 2005 H HIS A 450 18.783 32.834 -7.373 1.00 0.00 H ATOM 2006 N HIS A 451 22.030 32.478 -8.468 1.00 50.88 N ATOM 2007 CA HIS A 451 23.241 31.898 -9.069 1.00 48.33 C ATOM 2008 C HIS A 451 23.179 31.840 -10.611 1.00 53.96 C ATOM 2009 O HIS A 451 24.167 32.178 -11.263 1.00 51.76 O ATOM 2010 CB HIS A 451 23.518 30.502 -8.491 1.00 45.59 C ATOM 2011 CG HIS A 451 24.855 29.938 -8.863 1.00 47.50 C ATOM 2012 ND1 HIS A 451 25.996 30.256 -8.151 1.00 47.61 N ATOM 2013 CD2 HIS A 451 25.186 29.081 -9.857 1.00 49.12 C ATOM 2014 CE1 HIS A 451 26.979 29.603 -8.741 1.00 46.30 C ATOM 2015 NE2 HIS A 451 26.541 28.885 -9.772 1.00 47.80 N ATOM 2016 H HIS A 451 21.416 31.851 -7.909 1.00 0.00 H ATOM 2017 N ALA A 452 22.040 31.385 -11.180 1.00 54.60 N ATOM 2018 CA ALA A 452 21.840 31.266 -12.636 1.00 58.82 C ATOM 2019 C ALA A 452 21.932 32.620 -13.335 1.00 69.10 C ATOM 2020 O ALA A 452 22.459 32.703 -14.448 1.00 70.38 O ATOM 2021 CB ALA A 452 20.505 30.612 -12.933 1.00 60.81 C ATOM 2022 H ALA A 452 21.259 31.102 -10.554 1.00 0.00 H ATOM 2023 N GLU A 453 21.449 33.681 -12.659 1.00 69.09 N ATOM 2024 CA GLU A 453 21.514 35.061 -13.126 1.00 73.13 C ATOM 2025 C GLU A 453 22.961 35.541 -13.070 1.00 77.63 C ATOM 2026 O GLU A 453 23.426 36.186 -14.012 1.00 79.23 O ATOM 2027 CB GLU A 453 20.639 35.958 -12.245 1.00 75.98 C ATOM 2028 CG GLU A 453 19.225 36.124 -12.763 1.00 93.01 C ATOM 2029 CD GLU A 453 18.294 36.829 -11.798 1.00120.78 C ATOM 2030 OE1 GLU A 453 18.561 38.005 -11.462 1.00118.57 O ATOM 2031 OE2 GLU A 453 17.292 36.204 -11.384 1.00117.95 O ATOM 2032 H GLU A 453 20.998 33.503 -11.739 1.00 0.00 H ATOM 2033 N MET A 454 23.669 35.212 -11.964 1.00 72.17 N ATOM 2034 CA MET A 454 25.067 35.561 -11.706 1.00 71.96 C ATOM 2035 C MET A 454 25.984 35.020 -12.812 1.00 76.87 C ATOM 2036 O MET A 454 26.847 35.755 -13.297 1.00 76.98 O ATOM 2037 CB MET A 454 25.486 35.051 -10.317 1.00 71.56 C ATOM 2038 CG MET A 454 26.840 35.530 -9.863 1.00 75.46 C ATOM 2039 SD MET A 454 27.090 35.305 -8.089 1.00 78.29 S ATOM 2040 CE MET A 454 27.299 33.516 -7.997 1.00 72.06 C ATOM 2041 H MET A 454 23.175 34.662 -11.232 1.00 0.00 H ATOM 2042 N LEU A 455 25.764 33.754 -13.230 1.00 74.02 N ATOM 2043 CA LEU A 455 26.518 33.091 -14.300 1.00 75.15 C ATOM 2044 C LEU A 455 26.248 33.741 -15.659 1.00 85.97 C ATOM 2045 O LEU A 455 27.151 33.800 -16.492 1.00 86.65 O ATOM 2046 CB LEU A 455 26.172 31.593 -14.385 1.00 73.36 C ATOM 2047 CG LEU A 455 26.496 30.699 -13.196 1.00 74.02 C ATOM 2048 CD1 LEU A 455 26.003 29.299 -13.447 1.00 73.17 C ATOM 2049 CD2 LEU A 455 27.984 30.675 -12.902 1.00 74.78 C ATOM 2050 H LEU A 455 25.009 33.213 -12.762 1.00 0.00 H ATOM 2051 N MET A 456 25.002 34.214 -15.880 1.00 87.54 N ATOM 2052 CA MET A 456 24.561 34.862 -17.117 1.00 92.66 C ATOM 2053 C MET A 456 25.224 36.226 -17.340 1.00 99.70 C ATOM 2054 O MET A 456 25.284 36.692 -18.478 1.00102.74 O ATOM 2055 CB MET A 456 23.028 34.979 -17.151 1.00 97.37 C ATOM 2056 CG MET A 456 22.405 34.477 -18.444 1.00104.56 C ATOM 2057 SD MET A 456 22.549 32.685 -18.707 1.00107.26 S ATOM 2058 CE MET A 456 21.262 32.079 -17.604 1.00102.09 C ATOM 2059 H MET A 456 24.305 34.110 -15.115 1.00 0.00 H ATOM 2060 N SER A 457 25.738 36.849 -16.259 1.00 95.31 N ATOM 2061 CA SER A 457 26.432 38.140 -16.288 1.00 97.18 C ATOM 2062 C SER A 457 27.798 38.066 -16.988 1.00101.70 C ATOM 2063 O SER A 457 28.298 39.096 -17.446 1.00104.06 O ATOM 2064 CB SER A 457 26.603 38.684 -14.873 1.00 98.86 C ATOM 2065 OG SER A 457 25.349 38.848 -14.235 1.00107.63 O ATOM 2066 HG SER A 457 24.796 39.484 -14.755 1.00 0.00 H ATOM 2067 H SER A 457 25.634 36.379 -15.337 1.00 0.00 H ATOM 2068 N TRP A 458 28.400 36.860 -17.063 1.00 95.68 N ATOM 2069 CA TRP A 458 29.701 36.646 -17.698 1.00130.02 C ATOM 2070 C TRP A 458 29.596 35.721 -18.906 1.00150.55 C ATOM 2071 O TRP A 458 29.643 36.188 -20.043 1.00113.86 O ATOM 2072 CB TRP A 458 30.720 36.103 -16.683 1.00125.43 C ATOM 2073 CG TRP A 458 30.826 36.916 -15.424 1.00125.47 C ATOM 2074 CD1 TRP A 458 31.241 38.211 -15.314 1.00130.22 C ATOM 2075 CD2 TRP A 458 30.533 36.473 -14.092 1.00122.47 C ATOM 2076 NE1 TRP A 458 31.216 38.606 -13.996 1.00128.24 N ATOM 2077 CE2 TRP A 458 30.786 37.558 -13.224 1.00126.74 C ATOM 2078 CE3 TRP A 458 30.084 35.258 -13.544 1.00121.20 C ATOM 2079 CZ2 TRP A 458 30.603 37.467 -11.838 1.00123.90 C ATOM 2080 CZ3 TRP A 458 29.899 35.171 -12.172 1.00120.50 C ATOM 2081 CH2 TRP A 458 30.157 36.266 -11.335 1.00121.55 C ATOM 2082 HE1 TRP A 458 31.481 39.548 -13.643 1.00 0.00 H ATOM 2083 H TRP A 458 27.914 36.040 -16.648 1.00 0.00 H TER 2084 TRP A 458 ATOM 2085 N HIS A 463 36.895 35.759 -17.227 1.00102.95 N ATOM 2086 CA HIS A 463 37.102 34.620 -16.335 1.00 99.35 C ATOM 2087 C HIS A 463 36.091 33.496 -16.576 1.00101.35 C ATOM 2088 O HIS A 463 34.880 33.736 -16.591 1.00101.07 O ATOM 2089 CB HIS A 463 37.122 35.048 -14.854 1.00 98.10 C ATOM 2090 CG HIS A 463 36.011 35.974 -14.462 1.00102.09 C ATOM 2091 ND1 HIS A 463 34.689 35.564 -14.471 1.00103.27 N ATOM 2092 CD2 HIS A 463 36.067 37.262 -14.051 1.00105.03 C ATOM 2093 CE1 HIS A 463 33.987 36.612 -14.075 1.00103.67 C ATOM 2094 NE2 HIS A 463 34.771 37.656 -13.810 1.00105.15 N ATOM 2095 HN3 HIS A 463 35.942 36.147 -17.077 1.00 0.00 H ATOM 2096 HN2 HIS A 463 36.992 35.447 -18.214 1.00 0.00 H ATOM 2097 HN1 HIS A 463 37.605 36.491 -17.023 1.00 0.00 H ATOM 2098 N LYS A 464 36.603 32.266 -16.762 1.00 95.97 N ATOM 2099 CA LYS A 464 35.776 31.094 -17.021 1.00 94.34 C ATOM 2100 C LYS A 464 35.564 30.224 -15.765 1.00 92.82 C ATOM 2101 O LYS A 464 35.794 30.686 -14.641 1.00 91.19 O ATOM 2102 CB LYS A 464 36.305 30.291 -18.221 1.00 98.79 C ATOM 2103 CG LYS A 464 35.305 30.244 -19.374 1.00117.52 C ATOM 2104 CD LYS A 464 35.921 30.638 -20.712 1.00129.45 C ATOM 2105 CE LYS A 464 34.887 30.669 -21.813 1.00140.21 C ATOM 2106 NZ LYS A 464 35.470 31.094 -23.112 1.00150.40 N ATOM 2107 HZ1 LYS A 464 35.871 32.049 -23.015 1.00 0.00 H ATOM 2108 HZ2 LYS A 464 36.220 30.428 -23.388 1.00 0.00 H ATOM 2109 HZ3 LYS A 464 34.726 31.101 -23.839 1.00 0.00 H ATOM 2110 H LYS A 464 37.635 32.146 -16.719 1.00 0.00 H ATOM 2111 N PHE A 465 35.115 28.973 -15.981 1.00 86.37 N ATOM 2112 CA PHE A 465 34.684 27.940 -15.039 1.00 83.46 C ATOM 2113 C PHE A 465 35.655 26.771 -14.938 1.00 85.66 C ATOM 2114 O PHE A 465 36.520 26.638 -15.804 1.00 87.96 O ATOM 2115 CB PHE A 465 33.369 27.356 -15.608 1.00 86.03 C ATOM 2116 CG PHE A 465 33.520 26.579 -16.911 1.00 89.77 C ATOM 2117 CD1 PHE A 465 33.692 27.240 -18.124 1.00 95.98 C ATOM 2118 CD2 PHE A 465 33.469 25.190 -16.923 1.00 91.17 C ATOM 2119 CE1 PHE A 465 33.846 26.523 -19.315 1.00 99.06 C ATOM 2120 CE2 PHE A 465 33.611 24.475 -18.115 1.00 96.36 C ATOM 2121 CZ PHE A 465 33.799 25.146 -19.304 1.00 97.43 C ATOM 2122 H PHE A 465 35.067 28.696 -16.982 1.00 0.00 H ATOM 2123 N THR A 466 35.414 25.836 -13.972 1.00 76.95 N ATOM 2124 CA THR A 466 36.109 24.547 -13.875 1.00 75.28 C ATOM 2125 C THR A 466 35.177 23.445 -14.447 1.00 79.85 C ATOM 2126 O THR A 466 33.960 23.671 -14.513 1.00 79.62 O ATOM 2127 CB THR A 466 36.643 24.216 -12.468 1.00 73.39 C ATOM 2128 OG1 THR A 466 35.597 23.750 -11.625 1.00 68.57 O ATOM 2129 CG2 THR A 466 37.413 25.331 -11.848 1.00 68.66 C ATOM 2130 HG1 THR A 466 35.964 23.544 -10.729 1.00 0.00 H ATOM 2131 H THR A 466 34.690 26.052 -13.258 1.00 0.00 H ATOM 2132 N PRO A 467 35.697 22.255 -14.843 1.00 76.47 N ATOM 2133 CA PRO A 467 34.828 21.219 -15.427 1.00 76.98 C ATOM 2134 C PRO A 467 33.655 20.762 -14.567 1.00 78.60 C ATOM 2135 O PRO A 467 32.630 20.381 -15.121 1.00 78.93 O ATOM 2136 CB PRO A 467 35.795 20.076 -15.718 1.00 79.66 C ATOM 2137 CG PRO A 467 36.953 20.317 -14.831 1.00 83.26 C ATOM 2138 CD PRO A 467 37.096 21.797 -14.825 1.00 78.72 C ATOM 2139 N LEU A 468 33.795 20.798 -13.232 1.00 72.41 N ATOM 2140 CA LEU A 468 32.700 20.438 -12.336 1.00 69.98 C ATOM 2141 C LEU A 468 31.697 21.576 -12.214 1.00 70.79 C ATOM 2142 O LEU A 468 30.526 21.322 -11.932 1.00 70.35 O ATOM 2143 CB LEU A 468 33.218 20.064 -10.939 1.00 68.33 C ATOM 2144 CG LEU A 468 33.612 18.604 -10.723 1.00 73.40 C ATOM 2145 CD1 LEU A 468 34.218 18.412 -9.360 1.00 71.75 C ATOM 2146 CD2 LEU A 468 32.432 17.652 -10.933 1.00 75.96 C ATOM 2147 H LEU A 468 34.707 21.090 -12.826 1.00 0.00 H ATOM 2148 N LEU A 469 32.152 22.826 -12.427 1.00 65.28 N ATOM 2149 CA LEU A 469 31.326 24.020 -12.281 1.00 63.47 C ATOM 2150 C LEU A 469 30.287 24.183 -13.404 1.00 67.18 C ATOM 2151 O LEU A 469 29.182 23.705 -13.193 1.00 65.32 O ATOM 2152 CB LEU A 469 32.166 25.294 -12.062 1.00 62.96 C ATOM 2153 CG LEU A 469 33.067 25.306 -10.805 1.00 64.27 C ATOM 2154 CD1 LEU A 469 33.605 26.687 -10.527 1.00 64.44 C ATOM 2155 CD2 LEU A 469 32.369 24.743 -9.576 1.00 64.07 C ATOM 2156 H LEU A 469 33.145 22.946 -12.711 1.00 0.00 H ATOM 2157 N CYS A 470 30.605 24.790 -14.582 1.00 66.61 N ATOM 2158 CA CYS A 470 29.590 24.992 -15.640 1.00 69.50 C ATOM 2159 C CYS A 470 28.930 23.693 -16.181 1.00 72.81 C ATOM 2160 O CYS A 470 27.940 23.808 -16.898 1.00 74.42 O ATOM 2161 CB CYS A 470 30.109 25.860 -16.781 1.00 73.07 C ATOM 2162 SG CYS A 470 29.924 27.642 -16.500 1.00 77.91 S ATOM 2163 H CYS A 470 31.579 25.117 -14.740 1.00 0.00 H ATOM 2164 N GLU A 471 29.407 22.489 -15.788 1.00 67.68 N ATOM 2165 CA GLU A 471 28.778 21.224 -16.184 1.00 68.10 C ATOM 2166 C GLU A 471 27.687 20.817 -15.195 1.00 69.78 C ATOM 2167 O GLU A 471 26.652 20.309 -15.627 1.00 70.76 O ATOM 2168 CB GLU A 471 29.805 20.120 -16.312 1.00 68.88 C ATOM 2169 H GLU A 471 30.252 22.459 -15.182 1.00 0.00 H ATOM 2170 N ILE A 472 27.909 21.026 -13.873 1.00 62.47 N ATOM 2171 CA ILE A 472 26.895 20.731 -12.856 1.00 60.39 C ATOM 2172 C ILE A 472 25.951 21.925 -12.748 1.00 63.86 C ATOM 2173 O ILE A 472 24.804 21.775 -12.313 1.00 64.28 O ATOM 2174 CB ILE A 472 27.552 20.463 -11.506 1.00 58.76 C ATOM 2175 H ILE A 472 28.828 21.408 -13.571 1.00 0.00 H ATOM 2176 N TRP A 473 26.442 23.114 -13.143 1.00 60.04 N ATOM 2177 CA TRP A 473 25.701 24.375 -13.105 1.00 60.41 C ATOM 2178 C TRP A 473 24.924 24.698 -14.389 1.00 68.60 C ATOM 2179 O TRP A 473 24.117 25.632 -14.374 1.00 70.75 O ATOM 2180 CB TRP A 473 26.644 25.538 -12.783 1.00 58.10 C ATOM 2181 CG TRP A 473 27.246 25.540 -11.410 1.00 56.05 C ATOM 2182 CD1 TRP A 473 26.883 24.774 -10.338 1.00 56.98 C ATOM 2183 CD2 TRP A 473 28.275 26.416 -10.947 1.00 55.20 C ATOM 2184 NE1 TRP A 473 27.644 25.103 -9.243 1.00 54.58 N ATOM 2185 CE2 TRP A 473 28.495 26.123 -9.583 1.00 56.93 C ATOM 2186 CE3 TRP A 473 29.033 27.430 -11.553 1.00 57.82 C ATOM 2187 CZ2 TRP A 473 29.447 26.802 -8.818 1.00 55.48 C ATOM 2188 CZ3 TRP A 473 29.978 28.100 -10.796 1.00 58.42 C ATOM 2189 CH2 TRP A 473 30.177 27.786 -9.446 1.00 56.96 C ATOM 2190 HE1 TRP A 473 27.584 24.652 -8.308 1.00 0.00 H ATOM 2191 H TRP A 473 27.418 23.138 -13.501 1.00 0.00 H ATOM 2192 N ASP A 474 25.183 23.959 -15.495 1.00 66.29 N ATOM 2193 CA ASP A 474 24.557 24.133 -16.821 1.00 97.18 C ATOM 2194 C ASP A 474 24.836 25.503 -17.436 1.00128.63 C ATOM 2195 O ASP A 474 25.939 26.027 -17.305 1.00 93.47 O ATOM 2196 CB ASP A 474 23.041 23.850 -16.798 1.00100.13 C ATOM 2197 CG ASP A 474 22.671 22.473 -16.289 1.00109.54 C ATOM 2198 OD1 ASP A 474 22.952 21.483 -16.998 1.00111.06 O ATOM 2199 OD2 ASP A 474 22.069 22.387 -15.196 1.00114.25 O ATOM 2200 H ASP A 474 25.887 23.200 -15.401 1.00 0.00 H TER 2201 ASP A 474 HETATM 2202 O HOH 1 28.404 6.817 6.166 1.00 47.07 O HETATM 2203 O HOH 2 16.058 2.385 -1.702 1.00 64.07 O HETATM 2204 O HOH 3 18.736 17.202 -5.653 1.00 35.75 O HETATM 2205 O HOH 4 31.678 11.604 2.811 1.00 38.56 O HETATM 2206 O HOH 5 20.854 23.496 -6.389 1.00 40.24 O HETATM 2207 O HOH 6 9.344 12.770 13.487 1.00 58.82 O HETATM 2208 O HOH 7 29.970 19.686 2.250 1.00 64.11 O HETATM 2209 O HOH 8 24.099 43.376 -10.849 1.00 61.56 O HETATM 2210 O HOH 9 16.948 7.866 3.841 1.00 51.53 O HETATM 2211 O HOH 10 34.473 13.093 -5.406 1.00 43.17 O HETATM 2212 O HOH 11 13.854 5.608 9.809 1.00 66.00 O HETATM 2213 O HOH 12 10.187 7.455 9.789 1.00 56.28 O HETATM 2214 O HOH 13 26.363 21.182 3.672 1.00 35.74 O HETATM 2215 O HOH 14 9.231 10.803 -13.372 1.00 58.19 O HETATM 2216 O HOH 15 20.629 25.075 -9.560 1.00 53.71 O HETATM 2217 O HOH 16 9.312 13.908 0.577 1.00 59.27 O HETATM 2218 O HOH 17 23.716 27.864 12.451 1.00 43.54 O HETATM 2219 O HOH 18 23.441 40.525 -13.260 1.00 75.31 O HETATM 2220 O HOH 19 7.523 7.181 -9.264 1.00 67.17 O HETATM 2221 O HOH 20 34.904 8.865 0.306 1.00 70.60 O HETATM 2222 O HOH 21 8.075 13.410 15.803 1.00 58.92 O HETATM 2223 O HOH 22 32.085 18.284 7.621 1.00 53.94 O HETATM 2224 O HOH 23 27.906 26.847 11.351 1.00 56.55 O HETATM 2225 O HOH 24 36.240 20.694 2.159 1.00 63.49 O HETATM 2226 O HOH 25 18.553 2.533 9.507 1.00 52.52 O HETATM 2227 O HOH 26 24.611 12.447 16.411 1.00 62.68 O HETATM 2228 O HOH 27 48.953 36.209 -5.800 1.00 61.63 O HETATM 2229 O HOH 28 18.028 17.785 -12.181 1.00 49.28 O HETATM 2230 O HOH 29 27.548 19.965 1.086 1.00 43.07 O HETATM 2231 O HOH 30 9.783 17.147 -0.132 1.00 68.51 O HETATM 2232 O HOH 31 19.900 24.164 16.839 1.00 60.05 O HETATM 2233 O HOH 32 19.299 8.577 2.789 1.00 54.74 O HETATM 2234 O HOH 33 10.262 5.463 3.290 1.00 47.53 O HETATM 2235 O HOH 34 17.858 22.633 -9.138 1.00 70.03 O HETATM 2236 O HOH 35 12.989 8.167 10.047 1.00 42.22 O HETATM 2237 O HOH 36 7.820 23.183 13.866 1.00 52.36 O HETATM 2238 O HOH 37 39.723 22.639 -6.074 1.00 64.38 O HETATM 2239 O HOH 38 28.419 17.508 1.681 1.00 47.59 O HETATM 2240 O HOH 39 16.360 1.337 7.295 1.00 59.67 O HETATM 2241 O HOH 40 10.963 16.034 -15.132 1.00 47.47 O HETATM 2242 O HOH 41 26.618 4.277 3.202 1.00 59.64 O HETATM 2243 O HOH 42 12.132 31.169 9.180 1.00 72.77 O HETATM 2244 O HOH 43 15.042 3.732 21.068 1.00 72.33 O HETATM 2245 O HOH 44 51.052 24.668 4.745 1.00 67.88 O HETATM 2246 O HOH 45 37.115 38.560 -17.192 1.00 65.51 O HETATM 2247 O HOH 46 6.408 12.187 7.024 1.00 52.31 O HETATM 2248 O HOH 47 32.395 13.931 1.580 1.00 43.24 O HETATM 2249 O HOH 48 37.092 13.581 -6.138 1.00 60.41 O HETATM 2250 O HOH 49 20.360 13.580 -15.806 1.00 68.03 O HETATM 2251 O HOH 50 40.164 19.985 -6.525 1.00 53.46 O HETATM 2252 O HOH 51 11.971 29.299 -2.684 1.00 44.45 O HETATM 2253 O HOH 52 31.044 20.149 9.274 1.00 50.67 O HETATM 2254 O HOH 53 22.972 8.490 15.594 1.00 45.77 O HETATM 2255 O HOH 54 30.286 23.724 -4.983 1.00 46.45 O HETATM 2256 O HOH 55 50.613 32.305 -6.204 1.00 67.03 O HETATM 2257 O HOH 56 26.485 43.886 0.270 1.00 65.26 O HETATM 2258 O HOH 57 45.329 19.451 3.227 1.00 58.34 O HETATM 2259 O HOH 58 27.002 20.355 16.760 1.00 58.92 O HETATM 2260 O HOH 59 6.943 12.675 -12.558 1.00 59.87 O HETATM 2261 O HOH 60 20.417 2.255 -13.093 1.00 63.93 O HETATM 2262 O HOH 61 13.729 4.011 -2.325 1.00 49.33 O HETATM 2263 O HOH 62 12.069 18.617 -0.994 1.00 53.28 O HETATM 2264 O HOH 63 26.311 42.479 2.609 1.00 59.28 O HETATM 2265 O HOH 64 35.751 24.132 -0.269 1.00 44.18 O HETATM 2266 O HOH 65 17.421 9.777 20.791 1.00 59.54 O HETATM 2267 O HOH 66 33.910 36.685 8.374 1.00 61.41 O HETATM 2268 O HOH 67 19.024 22.093 18.448 1.00 78.46 O HETATM 2269 O HOH 68 28.051 39.137 -10.556 1.00 59.90 O HETATM 2270 O HOH 69 22.877 2.722 -0.410 1.00 45.14 O HETATM 2271 O HOH 70 38.181 15.568 7.969 1.00 88.72 O HETATM 2272 O HOH 71 10.133 21.683 16.229 1.00 49.87 O HETATM 2273 O HOH 72 25.836 9.784 3.801 1.00 83.63 O HETATM 2274 O HOH 73 33.074 20.924 1.885 1.00 57.61 O HETATM 2275 O HOH 74 14.831 22.194 -8.272 1.00 59.80 O HETATM 2276 O HOH 75 11.964 31.851 5.488 1.00 67.42 O HETATM 2277 O HOH 76 15.781 21.193 -10.623 1.00 53.18 O HETATM 2278 O HOH 77 11.104 2.821 -4.369 1.00 75.88 O HETATM 2279 O HOH 78 48.196 42.538 -3.306 1.00 60.68 O HETATM 2280 O HOH 79 22.594 28.124 -11.510 1.00 71.18 O HETATM 2281 O HOH 80 22.728 24.599 -11.516 1.00 66.94 O HETATM 2282 O HOH 81 10.886 24.303 -8.149 1.00 67.20 O HETATM 2283 O HOH 82 36.911 16.033 2.320 1.00 68.43 O HETATM 2284 O HOH 83 25.693 29.025 13.936 1.00 65.32 O HETATM 2285 O HOH 84 19.042 12.332 20.408 1.00 65.19 O HETATM 2286 O HOH 85 27.486 9.818 14.751 1.00 54.24 O HETATM 2287 O HOH 86 24.833 10.354 14.689 1.00 47.49 O HETATM 2288 O HOH 87 20.032 23.183 -11.425 1.00 74.78 O HETATM 2289 O HOH 88 8.316 7.933 12.121 1.00 76.46 O HETATM 2290 O HOH 89 9.402 5.545 12.824 1.00 64.92 O HETATM 2291 O HOH 90 31.732 27.751 16.097 1.00 60.80 O HETATM 2292 O HOH 91 20.612 18.283 24.209 1.00 90.29 O HETATM 2293 O HOH 92 14.299 36.535 -3.491 1.00 67.22 O HETATM 2294 O HOH 93 33.223 38.022 -19.091 1.00 76.60 O HETATM 2295 O HOH 94 3.269 16.447 -3.733 1.00 53.11 O HETATM 2296 O HOH 95 12.673 12.669 -18.032 1.00 77.00 O HETATM 2297 O HOH 96 15.596 4.305 -18.344 1.00 59.91 O HETATM 2298 O HOH 97 24.660 7.271 17.270 1.00 51.61 O HETATM 2299 O HOH 98 14.385 39.351 -4.938 1.00 76.33 O HETATM 2300 O HOH 99 35.261 14.056 1.082 1.00 54.11 O HETATM 2301 O HOH 100 10.595 27.024 -2.951 1.00 51.82 O HETATM 2302 O HOH 101 31.803 15.309 18.371 1.00 68.76 O HETATM 2303 O HOH 102 22.163 9.196 -17.187 1.00 72.63 O HETATM 2304 O HOH 103 29.231 2.178 -11.014 1.00 79.05 O HETATM 2305 O HOH 104 31.797 17.522 -16.618 1.00 50.42 O HETATM 2306 O HOH 105 30.145 16.295 -27.049 1.00 77.55 O HETATM 2307 C4 UNN A 106 31.695 31.170 -0.411 1.00 0.11 C HETATM 2308 C8 UNN A 106 30.675 32.013 -0.926 1.00 -0.07 C HETATM 2309 C7 UNN A 106 30.508 31.791 -2.234 1.00 -0.05 C HETATM 2310 C17 UNN A 106 29.571 32.417 -3.221 1.00 -0.02 C HETATM 2311 C15 UNN A 106 30.135 32.259 -4.618 1.00 0.03 C HETATM 2312 N5 UNN A 106 30.426 30.821 -4.901 1.00 -0.22 N HETATM 2313 S1 UNN A 106 30.372 30.354 -6.473 1.00 0.07 S HETATM 2314 C6 UNN A 106 31.751 31.067 -7.336 1.00 0.14 C HETATM 2315 C21 UNN A 106 32.696 30.200 -7.876 1.00 -0.04 C HETATM 2316 C29 UNN A 106 33.787 30.721 -8.560 1.00 -0.06 C HETATM 2317 C30 UNN A 106 33.940 32.088 -8.706 1.00 -0.06 C HETATM 2318 C24 UNN A 106 33.004 32.962 -8.174 1.00 -0.03 C HETATM 2319 C16 UNN A 106 31.927 32.436 -7.500 1.00 0.16 C HETATM 2320 F20 UNN A 106 31.014 33.287 -6.982 1.00 -0.18 F HETATM 2321 H9 UNN A 106 33.119 34.034 -8.287 1.00 0.06 H HETATM 2322 H12 UNN A 106 34.798 32.479 -9.240 1.00 0.06 H HETATM 2323 H13 UNN A 106 34.526 30.050 -8.983 1.00 0.06 H HETATM 2324 H8 UNN A 106 32.582 29.128 -7.764 1.00 0.06 H HETATM 2325 O11 UNN A 106 30.565 28.939 -6.490 1.00 -0.15 O HETATM 2326 O12 UNN A 106 29.177 30.911 -7.026 1.00 -0.15 O HETATM 2327 C9 UNN A 106 31.521 30.266 -4.054 1.00 0.08 C HETATM 2328 C3 UNN A 106 31.394 30.798 -2.654 1.00 0.06 C HETATM 2329 N2 UNN A 106 32.161 30.398 -1.482 1.00 -0.26 N HETATM 2330 C13 UNN A 106 33.186 29.359 -1.552 1.00 0.09 C HETATM 2331 C22 UNN A 106 32.631 28.005 -1.193 1.00 -0.01 C HETATM 2332 C26 UNN A 106 32.186 27.133 -2.182 1.00 -0.06 C HETATM 2333 C32 UNN A 106 31.672 25.888 -1.847 1.00 -0.07 C HETATM 2334 C36 UNN A 106 31.592 25.498 -0.518 1.00 -0.07 C HETATM 2335 C31 UNN A 106 32.029 26.355 0.472 1.00 -0.07 C HETATM 2336 C25 UNN A 106 32.545 27.604 0.139 1.00 -0.06 C HETATM 2337 H21 UNN A 106 32.883 28.271 0.923 1.00 0.06 H HETATM 2338 H22 UNN A 106 31.970 26.054 1.512 1.00 0.06 H HETATM 2339 H23 UNN A 106 31.189 24.526 -0.259 1.00 0.06 H HETATM 2340 H24 UNN A 106 31.331 25.217 -2.627 1.00 0.06 H HETATM 2341 H10 UNN A 106 32.241 27.429 -3.223 1.00 0.06 H HETATM 2342 H2 UNN A 106 33.586 29.321 -2.576 1.00 0.08 H HETATM 2343 H3 UNN A 106 33.996 29.610 -0.852 1.00 0.08 H HETATM 2344 H25 UNN A 106 32.494 30.564 -4.472 1.00 0.06 H HETATM 2345 H26 UNN A 106 31.450 29.169 -4.036 1.00 0.06 H HETATM 2346 H4 UNN A 106 31.065 32.840 -4.702 1.00 0.05 H HETATM 2347 H5 UNN A 106 29.402 32.632 -5.349 1.00 0.05 H HETATM 2348 H6 UNN A 106 29.455 33.486 -2.990 1.00 0.03 H HETATM 2349 H7 UNN A 106 28.591 31.921 -3.162 1.00 0.03 H HETATM 2350 H1 UNN A 106 30.110 32.736 -0.340 1.00 0.03 H HETATM 2351 C10 UNN A 106 32.238 31.022 0.948 1.00 0.21 C HETATM 2352 O18 UNN A 106 33.394 30.662 1.155 1.00 -0.40 O HETATM 2353 N14 UNN A 106 31.371 31.305 1.935 1.00 -0.28 N HETATM 2354 C19 UNN A 106 31.712 31.208 3.360 1.00 0.06 C HETATM 2355 C23 UNN A 106 32.449 32.355 4.014 1.00 -0.02 C HETATM 2356 C28 UNN A 106 33.282 32.111 5.104 1.00 -0.06 C HETATM 2357 C34 UNN A 106 33.971 33.154 5.724 1.00 -0.07 C HETATM 2358 C35 UNN A 106 33.828 34.451 5.260 1.00 -0.07 C HETATM 2359 C33 UNN A 106 33.002 34.705 4.180 1.00 -0.07 C HETATM 2360 C27 UNN A 106 32.315 33.665 3.562 1.00 -0.06 C HETATM 2361 H17 UNN A 106 31.668 33.877 2.719 1.00 0.06 H HETATM 2362 H18 UNN A 106 32.889 35.719 3.813 1.00 0.06 H HETATM 2363 H19 UNN A 106 34.361 35.263 5.741 1.00 0.06 H HETATM 2364 H20 UNN A 106 34.618 32.949 6.569 1.00 0.06 H HETATM 2365 H11 UNN A 106 33.396 31.099 5.475 1.00 0.06 H HETATM 2366 H15 UNN A 106 32.337 30.311 3.482 1.00 0.07 H HETATM 2367 H16 UNN A 106 30.768 31.075 3.910 1.00 0.07 H HETATM 2368 H14 UNN A 106 30.447 31.596 1.687 1.00 0.19 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2085 2086 2095 2096 2097 CONECT 2095 2085 CONECT 2096 2085 CONECT 2097 2085 CONECT 2307 2308 2329 2351 CONECT 2308 2307 2309 2350 CONECT 2309 2308 2310 2328 CONECT 2310 2309 2311 2348 2349 CONECT 2311 2310 2312 2346 2347 CONECT 2312 2311 2313 2327 CONECT 2313 2312 2314 2325 2326 CONECT 2314 2313 2315 2319 CONECT 2315 2314 2316 2324 CONECT 2316 2315 2317 2323 CONECT 2317 2316 2318 2322 CONECT 2318 2317 2319 2321 CONECT 2319 2314 2318 2320 CONECT 2320 2319 CONECT 2321 2318 CONECT 2322 2317 CONECT 2323 2316 CONECT 2324 2315 CONECT 2325 2313 CONECT 2326 2313 CONECT 2327 2312 2328 2344 2345 CONECT 2328 2309 2327 2329 CONECT 2329 2307 2328 2330 CONECT 2330 2329 2331 2342 2343 CONECT 2331 2330 2332 2336 CONECT 2332 2331 2333 2341 CONECT 2333 2332 2334 2340 CONECT 2334 2333 2335 2339 CONECT 2335 2334 2336 2338 CONECT 2336 2331 2335 2337 CONECT 2337 2336 CONECT 2338 2335 CONECT 2339 2334 CONECT 2340 2333 CONECT 2341 2332 CONECT 2342 2330 CONECT 2343 2330 CONECT 2344 2327 CONECT 2345 2327 CONECT 2346 2311 CONECT 2347 2311 CONECT 2348 2310 CONECT 2349 2310 CONECT 2350 2308 CONECT 2351 2307 2352 2353 CONECT 2352 2351 CONECT 2353 2351 2354 2368 CONECT 2354 2353 2355 2366 2367 CONECT 2355 2354 2356 2360 CONECT 2356 2355 2357 2365 CONECT 2357 2356 2358 2364 CONECT 2358 2357 2359 2363 CONECT 2359 2358 2360 2362 CONECT 2360 2355 2359 2361 CONECT 2361 2360 CONECT 2362 2359 CONECT 2363 2358 CONECT 2364 2357 CONECT 2365 2356 CONECT 2366 2354 CONECT 2367 2354 CONECT 2368 2353 MASTER 0 0 0 0 0 0 0 0 2366 2 70 18 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5q0r
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3dct
RCSB PDB
PDBbind
21aa, >3DCT_2|Chain... *
3fei
RCSB PDB
PDBbind
13aa, >3FEI_2|Chain... at 100%
3fxv
RCSB PDB
PDBbind
13aa, >3FXV_2|Chain... at 100%
3g8i
RCSB PDB
PDBbind
13aa, >3G8I_2|Chain... at 100%
3okh
RCSB PDB
PDBbind
14aa, >3OKH_2|Chain... at 100%
3oki
RCSB PDB
PDBbind
14aa, >3OKI_2|Chains... at 100%
3olf
RCSB PDB
PDBbind
14aa, >3OLF_2|Chains... at 100%
3omm
RCSB PDB
PDBbind
14aa, >3OMM_2|Chains... at 100%
3oof
RCSB PDB
PDBbind
14aa, >3OOF_2|Chains... at 100%
3ook
RCSB PDB
PDBbind
14aa, >3OOK_2|Chains... at 100%
4dk7
RCSB PDB
PDBbind
12aa, >4DK7_2|Chains... at 100%
4dk8
RCSB PDB
PDBbind
12aa, >4DK8_2|Chains... at 100%
5q0j
RCSB PDB
PDBbind
14aa, >5Q0J_2|Chains... at 100%
5q0l
RCSB PDB
PDBbind
14aa, >5Q0L_2|Chains... at 100%
5q0m
RCSB PDB
PDBbind
14aa, >5Q0M_2|Chain... at 100%
5q0n
RCSB PDB
PDBbind
14aa, >5Q0N_2|Chains... at 100%
5q0o
RCSB PDB
PDBbind
14aa, >5Q0O_2|Chains... at 100%
5q0p
RCSB PDB
PDBbind
14aa, >5Q0P_2|Chains... at 100%
5q0q
RCSB PDB
PDBbind
14aa, >5Q0Q_2|Chains... at 100%
5q0s
RCSB PDB
PDBbind
14aa, >5Q0S_2|Chains... at 100%
5q0t
RCSB PDB
PDBbind
14aa, >5Q0T_2|Chain... at 100%
5q0u
RCSB PDB
PDBbind
14aa, >5Q0U_2|Chains... at 100%
5q0v
RCSB PDB
PDBbind
14aa, >5Q0V_2|Chains... at 100%
5q0w
RCSB PDB
PDBbind
14aa, >5Q0W_2|Chain... at 100%
5q0x
RCSB PDB
PDBbind
14aa, >5Q0X_2|Chain... at 100%
5q0y
RCSB PDB
PDBbind
14aa, >5Q0Y_2|Chains... at 100%
5q0z
RCSB PDB
PDBbind
14aa, >5Q0Z_2|Chains... at 100%
5q10
RCSB PDB
PDBbind
14aa, >5Q10_2|Chain... at 100%
5q11
RCSB PDB
PDBbind
14aa, >5Q11_2|Chain... at 100%
5q12
RCSB PDB
PDBbind
14aa, >5Q12_2|Chain... at 100%
5q13
RCSB PDB
PDBbind
14aa, >5Q13_2|Chains... at 100%
5q14
RCSB PDB
PDBbind
14aa, >5Q14_2|Chains... at 100%
5q15
RCSB PDB
PDBbind
14aa, >5Q15_2|Chains... at 100%
5q16
RCSB PDB
PDBbind
14aa, >5Q16_2|Chains... at 100%
5q18
RCSB PDB
PDBbind
14aa, >5Q18_2|Chains... at 100%
5q19
RCSB PDB
PDBbind
14aa, >5Q19_2|Chains... at 100%
5q1a
RCSB PDB
PDBbind
14aa, >5Q1A_2|Chains... at 100%
5q1b
RCSB PDB
PDBbind
14aa, >5Q1B_2|Chains... at 100%
5q1c
RCSB PDB
PDBbind
14aa, >5Q1C_2|Chains... at 100%
5q1d
RCSB PDB
PDBbind
14aa, >5Q1D_2|Chains... at 100%
5q1e
RCSB PDB
PDBbind
14aa, >5Q1E_2|Chain... at 100%
5q1f
RCSB PDB
PDBbind
14aa, >5Q1F_2|Chains... at 100%
5q1g
RCSB PDB
PDBbind
14aa, >5Q1G_2|Chain... at 100%
5q1h
RCSB PDB
PDBbind
14aa, >5Q1H_2|Chains... at 100%
5q1i
RCSB PDB
PDBbind
14aa, >5Q1I_2|Chain... at 100%
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
5q0r
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bile acid receptor
Ligand Name
9LG
EC.Number
E.C.2.3.1.48
Resolution
1.91(Å)
Affinity (Kd/Ki/IC50)
IC50=27uM
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
6
FN
3
O
3
S
Molecular Weight
503.588
Exact Mass
503.168
No. of atoms
62
No. of bonds
66
Polar Surface Area
79.79
LOGP Value
4.17 (
Computed with XLOGP3
)
5.76 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 5
Canonical SMILES
O=C(c1cc2c(n1Cc1ccccc1)CN(CC2)S(=O)(=O)c1ccccc1F)NCc1ccccc1
InChI String
InChI=1S/C28H26FN3O3S/c29-24-13-7-8-14-27(24)36(34,35)31-16-15-23-17-25(28(33)30-18-21-9-3-1-4-10-21)32(26(23)20-31)19-22-11-5-2-6-12-22/h1-14,17H,15-16,18-20H2,(H,30,33)
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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