Browse entries in the PDBbind-CN Database
HEADER 5K8S_COMPLEX COMPND 5K8S_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 146 GLY PRO GLY ALA LYS LYS ARG LYS MET TYR GLU ASP ILE SEQRES 2 A 146 LEU SER HIS VAL ASN ILE LEU LYS ASP MET ASP PRO TYR SEQRES 3 A 146 GLU ARG CYS LYS VAL ALA ASP CYS LEU LYS SER LYS SER SEQRES 4 A 146 TYR ASN ASP GLY GLU ILE ILE ILE LYS GLU GLY GLU GLU SEQRES 5 A 146 GLY ASP THR PHE PHE ILE LEU ILE ASP GLY ASN ALA VAL SEQRES 6 A 146 ALA SER LYS ASP ASN LYS VAL ILE LYS THR TYR THR LYS SEQRES 7 A 146 GLY ASP TYR PHE GLY GLU LEU ALA LEU LEU LYS ASN LYS SEQRES 8 A 146 PRO ARG ALA ALA THR ILE LYS ALA GLN ASN PHE CYS GLN SEQRES 9 A 146 VAL VAL TYR LEU ASP ARG LYS SER PHE LYS ARG LEU LEU SEQRES 10 A 146 GLY PRO ILE GLU ASP ILE LEU HIS ARG ASN VAL GLU ASN SEQRES 11 A 146 TYR LYS LYS VAL LEU ASN GLU LEU GLY LEU ASP THR THR SEQRES 12 A 146 CYS ILE ASP HET CMP A 313 33 ATOM 1 N GLY A 294 2.439 -1.621 -29.509 1.00 46.82 N ATOM 2 CA GLY A 294 2.199 -2.282 -28.240 1.00 46.48 C ATOM 3 C GLY A 294 0.982 -3.188 -28.269 1.00 45.90 C ATOM 4 O GLY A 294 0.415 -3.438 -29.334 1.00 45.88 O ATOM 5 HN3 GLY A 294 1.614 -1.038 -29.756 1.00 0.00 H ATOM 6 HN2 GLY A 294 2.593 -2.337 -30.248 1.00 0.00 H ATOM 7 HN1 GLY A 294 3.281 -1.016 -29.430 1.00 0.00 H ATOM 8 N PRO A 295 0.615 -3.683 -27.098 1.00 44.54 N ATOM 9 CA PRO A 295 -0.487 -4.619 -26.990 1.00 43.88 C ATOM 10 C PRO A 295 -1.875 -4.097 -27.447 1.00 42.99 C ATOM 11 O PRO A 295 -2.619 -4.838 -28.072 1.00 43.63 O ATOM 12 CB PRO A 295 -0.508 -4.934 -25.507 1.00 43.80 C ATOM 13 CG PRO A 295 0.830 -4.630 -24.992 1.00 44.05 C ATOM 14 CD PRO A 295 1.347 -3.523 -25.829 1.00 43.82 C ATOM 15 N GLY A 296 -2.177 -2.856 -27.152 1.00 40.75 N ATOM 16 CA GLY A 296 -3.514 -2.285 -27.243 1.00 38.52 C ATOM 17 C GLY A 296 -4.171 -2.327 -25.881 1.00 35.81 C ATOM 18 O GLY A 296 -3.901 -3.241 -25.123 1.00 37.63 O ATOM 19 H GLY A 296 -1.407 -2.235 -26.830 1.00 0.00 H ATOM 20 N ALA A 297 -5.120 -1.439 -25.630 1.00 46.29 N ATOM 21 CA ALA A 297 -5.661 -1.160 -24.316 1.00 34.28 C ATOM 22 C ALA A 297 -6.203 -2.442 -23.751 1.00 51.47 C ATOM 23 O ALA A 297 -6.067 -2.724 -22.573 1.00 51.53 O ATOM 24 CB ALA A 297 -6.743 -0.092 -24.408 1.00 56.80 C ATOM 25 H ALA A 297 -5.505 -0.903 -26.434 1.00 0.00 H ATOM 26 N LYS A 298 -6.750 -3.252 -24.631 1.00 49.98 N ATOM 27 CA LYS A 298 -7.299 -4.550 -24.353 1.00 31.38 C ATOM 28 C LYS A 298 -6.358 -5.689 -23.751 1.00 61.04 C ATOM 29 O LYS A 298 -6.530 -6.188 -22.626 1.00 37.50 O ATOM 30 CB LYS A 298 -7.795 -5.036 -25.744 1.00 48.30 C ATOM 31 CG LYS A 298 -8.251 -3.952 -26.789 1.00 62.28 C ATOM 32 CD LYS A 298 -7.400 -3.844 -28.052 1.00 65.44 C ATOM 33 CE LYS A 298 -7.610 -2.521 -28.820 1.00 75.57 C ATOM 34 NZ LYS A 298 -6.423 -1.754 -29.328 1.00 53.53 N ATOM 35 HZ1 LYS A 298 -5.815 -1.488 -28.527 1.00 0.00 H ATOM 36 HZ2 LYS A 298 -5.885 -2.349 -29.990 1.00 0.00 H ATOM 37 HZ3 LYS A 298 -6.750 -0.896 -29.817 1.00 0.00 H ATOM 38 H LYS A 298 -6.789 -2.923 -25.617 1.00 0.00 H ATOM 39 N LYS A 299 -5.318 -6.019 -24.484 1.00 65.92 N ATOM 40 CA LYS A 299 -4.333 -7.025 -24.095 1.00 43.01 C ATOM 41 C LYS A 299 -3.553 -6.476 -22.937 1.00 26.90 C ATOM 42 O LYS A 299 -3.141 -7.166 -22.107 1.00 23.95 O ATOM 43 CB LYS A 299 -3.441 -7.401 -25.261 1.00 32.69 C ATOM 44 CG LYS A 299 -2.415 -8.493 -24.995 1.00 47.71 C ATOM 45 CD LYS A 299 -2.609 -9.678 -25.916 1.00 55.59 C ATOM 46 CE LYS A 299 -1.466 -9.863 -26.886 1.00 52.80 C ATOM 47 NZ LYS A 299 -1.429 -11.296 -27.293 1.00 57.02 N ATOM 48 HZ1 LYS A 299 -1.285 -11.890 -26.452 1.00 0.00 H ATOM 49 HZ2 LYS A 299 -2.329 -11.549 -27.748 1.00 0.00 H ATOM 50 HZ3 LYS A 299 -0.647 -11.445 -27.962 1.00 0.00 H ATOM 51 H LYS A 299 -5.189 -5.535 -25.395 1.00 0.00 H ATOM 52 N ARG A 300 -3.340 -5.201 -22.977 1.00 21.91 N ATOM 53 CA ARG A 300 -2.571 -4.528 -21.984 1.00 30.27 C ATOM 54 C ARG A 300 -3.248 -4.689 -20.608 1.00 22.23 C ATOM 55 O ARG A 300 -2.573 -4.925 -19.620 1.00 20.61 O ATOM 56 CB ARG A 300 -2.365 -3.070 -22.383 1.00 26.71 C ATOM 57 CG ARG A 300 -1.433 -2.379 -21.462 1.00 34.28 C ATOM 58 CD ARG A 300 -1.120 -0.982 -21.884 1.00 43.27 C ATOM 59 NE ARG A 300 -2.160 -0.066 -21.517 1.00 29.71 N ATOM 60 CZ ARG A 300 -2.891 0.546 -22.412 1.00 47.05 C ATOM 61 NH1 ARG A 300 -2.669 0.337 -23.702 1.00 49.24 N ATOM 62 NH2 ARG A 300 -3.824 1.363 -22.028 1.00 55.24 N ATOM 63 HE ARG A 300 -2.338 0.117 -20.509 1.00 0.00 H ATOM 64 HH12 ARG A 300 -3.250 0.823 -24.415 1.00 0.00 H ATOM 65 HH11 ARG A 300 -1.914 -0.313 -24.001 1.00 0.00 H ATOM 66 HH22 ARG A 300 -4.409 1.853 -22.734 1.00 0.00 H ATOM 67 HH21 ARG A 300 -3.986 1.527 -21.014 1.00 0.00 H ATOM 68 H ARG A 300 -3.744 -4.648 -23.760 1.00 0.00 H ATOM 69 N LYS A 301 -4.578 -4.593 -20.549 1.00 23.21 N ATOM 70 CA LYS A 301 -5.242 -4.800 -19.257 1.00 21.90 C ATOM 71 C LYS A 301 -5.199 -6.253 -18.791 1.00 21.15 C ATOM 72 O LYS A 301 -5.033 -6.524 -17.654 1.00 21.72 O ATOM 73 CB LYS A 301 -6.643 -4.156 -19.202 1.00 29.80 C ATOM 74 CG LYS A 301 -6.609 -2.658 -19.415 1.00 43.99 C ATOM 75 CD LYS A 301 -6.023 -1.809 -18.336 1.00 28.40 C ATOM 76 CE LYS A 301 -5.327 -0.581 -18.866 1.00 59.03 C ATOM 77 NZ LYS A 301 -6.155 0.614 -19.204 1.00 56.48 N ATOM 78 HZ1 LYS A 301 -6.845 0.359 -19.940 1.00 0.00 H ATOM 79 HZ2 LYS A 301 -6.657 0.938 -18.353 1.00 0.00 H ATOM 80 HZ3 LYS A 301 -5.538 1.374 -19.554 1.00 0.00 H ATOM 81 H LYS A 301 -5.133 -4.376 -21.402 1.00 0.00 H ATOM 82 N MET A 302 -5.290 -7.174 -19.707 1.00 24.07 N ATOM 83 CA MET A 302 -5.045 -8.579 -19.413 1.00 22.48 C ATOM 84 C MET A 302 -3.634 -8.852 -18.887 1.00 20.56 C ATOM 85 O MET A 302 -3.475 -9.508 -17.912 1.00 18.91 O ATOM 86 CB MET A 302 -5.302 -9.423 -20.654 1.00 24.71 C ATOM 87 CG MET A 302 -5.206 -10.898 -20.391 1.00 33.85 C ATOM 88 SD MET A 302 -3.587 -11.440 -20.874 1.00 97.94 S ATOM 89 CE MET A 302 -3.431 -10.887 -22.551 1.00 48.78 C ATOM 90 H MET A 302 -5.545 -6.898 -20.677 1.00 0.00 H ATOM 91 N TYR A 303 -2.638 -8.282 -19.550 1.00 17.71 N ATOM 92 CA TYR A 303 -1.282 -8.362 -19.052 1.00 15.98 C ATOM 93 C TYR A 303 -1.146 -7.816 -17.621 1.00 15.26 C ATOM 94 O TYR A 303 -0.542 -8.406 -16.793 1.00 15.62 O ATOM 95 CB TYR A 303 -0.337 -7.610 -19.966 1.00 15.66 C ATOM 96 CG TYR A 303 0.033 -8.243 -21.286 1.00 16.40 C ATOM 97 CD1 TYR A 303 -0.032 -9.622 -21.503 1.00 17.33 C ATOM 98 CD2 TYR A 303 0.490 -7.460 -22.314 1.00 17.16 C ATOM 99 CE1 TYR A 303 0.338 -10.156 -22.730 1.00 17.97 C ATOM 100 CE2 TYR A 303 0.873 -7.994 -23.524 1.00 20.30 C ATOM 101 CZ TYR A 303 0.799 -9.326 -23.718 1.00 18.69 C ATOM 102 OH TYR A 303 1.221 -9.778 -24.923 1.00 20.26 O ATOM 103 HH TYR A 303 1.124 -10.763 -24.957 1.00 0.00 H ATOM 104 H TYR A 303 -2.833 -7.773 -20.436 1.00 0.00 H ATOM 105 N GLU A 304 -1.751 -6.659 -17.352 1.00 15.96 N ATOM 106 CA GLU A 304 -1.688 -6.062 -16.020 1.00 17.10 C ATOM 107 C GLU A 304 -2.329 -6.985 -14.989 1.00 16.62 C ATOM 108 O GLU A 304 -1.811 -7.132 -13.879 1.00 19.28 O ATOM 109 CB GLU A 304 -2.354 -4.687 -16.022 1.00 17.18 C ATOM 110 CG GLU A 304 -1.461 -3.629 -16.640 1.00 17.99 C ATOM 111 CD GLU A 304 -2.204 -2.383 -17.065 1.00 21.25 C ATOM 112 OE1 GLU A 304 -3.410 -2.244 -16.768 1.00 21.70 O ATOM 113 OE2 GLU A 304 -1.564 -1.527 -17.711 1.00 22.22 O ATOM 114 H GLU A 304 -2.278 -6.172 -18.105 1.00 0.00 H ATOM 115 N ASP A 305 -3.426 -7.632 -15.369 1.00 17.92 N ATOM 116 CA ASP A 305 -4.061 -8.656 -14.530 1.00 20.21 C ATOM 117 C ASP A 305 -3.092 -9.771 -14.180 1.00 21.37 C ATOM 118 O ASP A 305 -2.945 -10.142 -13.010 1.00 25.90 O ATOM 119 CB ASP A 305 -5.285 -9.259 -15.226 1.00 22.74 C ATOM 120 CG ASP A 305 -6.489 -8.359 -15.165 1.00 53.17 C ATOM 121 OD1 ASP A 305 -6.659 -7.682 -14.128 1.00 53.62 O ATOM 122 OD2 ASP A 305 -7.262 -8.315 -16.149 1.00 68.60 O ATOM 123 H ASP A 305 -3.849 -7.405 -16.292 1.00 0.00 H ATOM 124 N ILE A 306 -2.429 -10.303 -15.200 1.00 18.15 N ATOM 125 CA ILE A 306 -1.445 -11.351 -14.999 1.00 17.69 C ATOM 126 C ILE A 306 -0.340 -10.885 -14.056 1.00 17.19 C ATOM 127 O ILE A 306 -0.003 -11.572 -13.087 1.00 19.56 O ATOM 128 CB ILE A 306 -0.832 -11.797 -16.338 1.00 19.01 C ATOM 129 CG1 ILE A 306 -1.891 -12.486 -17.197 1.00 29.84 C ATOM 130 CG2 ILE A 306 0.359 -12.729 -16.104 1.00 23.37 C ATOM 131 CD1 ILE A 306 -1.382 -12.884 -18.559 1.00 23.76 C ATOM 132 H ILE A 306 -2.619 -9.961 -16.164 1.00 0.00 H ATOM 133 N LEU A 307 0.234 -9.720 -14.342 1.00 15.91 N ATOM 134 CA LEU A 307 1.397 -9.249 -13.592 1.00 14.00 C ATOM 135 C LEU A 307 1.102 -8.995 -12.124 1.00 17.31 C ATOM 136 O LEU A 307 2.011 -9.050 -11.295 1.00 17.97 O ATOM 137 CB LEU A 307 1.963 -7.978 -14.211 1.00 15.67 C ATOM 138 CG LEU A 307 2.516 -8.136 -15.624 1.00 14.75 C ATOM 139 CD1 LEU A 307 3.244 -6.861 -16.014 1.00 15.85 C ATOM 140 CD2 LEU A 307 3.436 -9.334 -15.771 1.00 17.40 C ATOM 141 H LEU A 307 -0.150 -9.135 -15.111 1.00 0.00 H ATOM 142 N SER A 308 -0.161 -8.738 -11.799 1.00 17.61 N ATOM 143 CA SER A 308 -0.540 -8.467 -10.419 1.00 31.86 C ATOM 144 C SER A 308 -0.410 -9.719 -9.559 1.00 24.81 C ATOM 145 O SER A 308 -0.484 -9.640 -8.338 1.00 26.68 O ATOM 146 CB SER A 308 -1.968 -7.923 -10.346 1.00 23.56 C ATOM 147 OG SER A 308 -2.916 -8.940 -10.608 1.00 24.08 O ATOM 148 HG SER A 308 -2.763 -9.307 -11.515 1.00 0.00 H ATOM 149 H SER A 308 -0.889 -8.730 -12.541 1.00 0.00 H ATOM 150 N HIS A 309 -0.205 -10.869 -10.197 1.00 22.06 N ATOM 151 CA HIS A 309 -0.073 -12.133 -9.478 1.00 22.35 C ATOM 152 C HIS A 309 1.283 -12.794 -9.702 1.00 23.37 C ATOM 153 O HIS A 309 1.498 -13.933 -9.290 1.00 25.34 O ATOM 154 CB HIS A 309 -1.187 -13.095 -9.890 1.00 28.39 C ATOM 155 CG HIS A 309 -2.563 -12.569 -9.629 1.00 55.11 C ATOM 156 ND1 HIS A 309 -3.131 -12.562 -8.373 1.00 39.14 N ATOM 157 CD2 HIS A 309 -3.483 -12.026 -10.461 1.00 48.79 C ATOM 158 CE1 HIS A 309 -4.342 -12.041 -8.443 1.00 52.76 C ATOM 159 NE2 HIS A 309 -4.581 -11.707 -9.699 1.00 63.49 N ATOM 160 H HIS A 309 -0.137 -10.867 -11.235 1.00 0.00 H ATOM 161 N VAL A 310 2.196 -12.085 -10.352 1.00 16.63 N ATOM 162 CA VAL A 310 3.530 -12.612 -10.600 1.00 16.98 C ATOM 163 C VAL A 310 4.432 -12.234 -9.421 1.00 15.72 C ATOM 164 O VAL A 310 4.661 -11.053 -9.152 1.00 15.39 O ATOM 165 CB VAL A 310 4.089 -12.084 -11.937 1.00 14.64 C ATOM 166 CG1 VAL A 310 5.560 -12.422 -12.075 1.00 15.42 C ATOM 167 CG2 VAL A 310 3.290 -12.663 -13.099 1.00 16.19 C ATOM 168 H VAL A 310 1.954 -11.132 -10.692 1.00 0.00 H ATOM 169 N ASN A 311 4.935 -13.236 -8.708 1.00 16.28 N ATOM 170 CA ASN A 311 5.675 -13.000 -7.470 1.00 17.08 C ATOM 171 C ASN A 311 6.898 -12.098 -7.636 1.00 15.89 C ATOM 172 O ASN A 311 7.163 -11.244 -6.789 1.00 16.94 O ATOM 173 CB ASN A 311 6.098 -14.335 -6.845 1.00 18.96 C ATOM 174 CG ASN A 311 4.924 -15.100 -6.244 1.00 28.41 C ATOM 175 OD1 ASN A 311 3.931 -14.506 -5.824 1.00 31.75 O ATOM 176 ND2 ASN A 311 5.045 -16.423 -6.185 1.00 25.99 N ATOM 177 HD22 ASN A 311 5.902 -16.884 -6.552 1.00 0.00 H ATOM 178 HD21 ASN A 311 4.283 -16.997 -5.772 1.00 0.00 H ATOM 179 H ASN A 311 4.799 -14.212 -9.039 1.00 0.00 H ATOM 180 N ILE A 312 7.647 -12.267 -8.720 1.00 14.92 N ATOM 181 CA ILE A 312 8.861 -11.474 -8.889 1.00 14.41 C ATOM 182 C ILE A 312 8.563 -9.971 -9.065 1.00 14.53 C ATOM 183 O ILE A 312 9.443 -9.137 -8.848 1.00 15.10 O ATOM 184 CB ILE A 312 9.713 -11.988 -10.078 1.00 14.73 C ATOM 185 CG1 ILE A 312 11.085 -11.309 -10.115 1.00 15.21 C ATOM 186 CG2 ILE A 312 8.991 -11.795 -11.399 1.00 15.25 C ATOM 187 CD1 ILE A 312 11.877 -11.405 -8.815 1.00 17.99 C ATOM 188 H ILE A 312 7.370 -12.960 -9.444 1.00 0.00 H ATOM 189 N LEU A 313 7.329 -9.618 -9.423 1.00 13.06 N ATOM 190 CA LEU A 313 6.972 -8.207 -9.539 1.00 15.35 C ATOM 191 C LEU A 313 6.176 -7.657 -8.366 1.00 16.97 C ATOM 192 O LEU A 313 5.666 -6.528 -8.447 1.00 16.14 O ATOM 193 CB LEU A 313 6.178 -7.967 -10.819 1.00 15.27 C ATOM 194 CG LEU A 313 6.848 -8.476 -12.099 1.00 14.77 C ATOM 195 CD1 LEU A 313 5.965 -8.153 -13.293 1.00 18.63 C ATOM 196 CD2 LEU A 313 8.234 -7.874 -12.270 1.00 15.70 C ATOM 197 H LEU A 313 6.617 -10.350 -9.621 1.00 0.00 H ATOM 198 N LYS A 314 6.065 -8.414 -7.280 1.00 15.29 N ATOM 199 CA LYS A 314 5.172 -7.994 -6.207 1.00 19.20 C ATOM 200 C LYS A 314 5.641 -6.724 -5.497 1.00 20.62 C ATOM 201 O LYS A 314 4.830 -6.007 -4.921 1.00 20.40 O ATOM 202 CB LYS A 314 4.980 -9.122 -5.195 1.00 22.25 C ATOM 203 CG LYS A 314 6.151 -9.408 -4.284 1.00 33.55 C ATOM 204 CD LYS A 314 5.785 -10.532 -3.322 1.00 36.12 C ATOM 205 CE LYS A 314 6.846 -10.724 -2.260 1.00 36.33 C ATOM 206 NZ LYS A 314 7.089 -9.461 -1.514 1.00 43.77 N ATOM 207 HZ1 LYS A 314 7.408 -8.725 -2.176 1.00 0.00 H ATOM 208 HZ2 LYS A 314 6.207 -9.156 -1.054 1.00 0.00 H ATOM 209 HZ3 LYS A 314 7.821 -9.621 -0.792 1.00 0.00 H ATOM 210 H LYS A 314 6.609 -9.296 -7.196 1.00 0.00 H ATOM 211 N ASP A 315 6.937 -6.425 -5.572 1.00 16.98 N ATOM 212 CA ASP A 315 7.449 -5.220 -4.926 1.00 18.19 C ATOM 213 C ASP A 315 7.277 -3.977 -5.798 1.00 17.68 C ATOM 214 O ASP A 315 7.487 -2.864 -5.317 1.00 20.09 O ATOM 215 CB ASP A 315 8.924 -5.378 -4.546 1.00 18.69 C ATOM 216 CG ASP A 315 9.127 -6.262 -3.326 1.00 32.33 C ATOM 217 OD1 ASP A 315 8.130 -6.638 -2.675 1.00 28.67 O ATOM 218 OD2 ASP A 315 10.292 -6.563 -2.998 1.00 42.91 O ATOM 219 H ASP A 315 7.585 -7.051 -6.092 1.00 0.00 H ATOM 220 N MET A 316 6.899 -4.148 -7.060 1.00 16.94 N ATOM 221 CA MET A 316 6.564 -2.998 -7.891 1.00 16.58 C ATOM 222 C MET A 316 5.249 -2.379 -7.468 1.00 17.61 C ATOM 223 O MET A 316 4.395 -3.060 -6.890 1.00 25.00 O ATOM 224 CB MET A 316 6.465 -3.400 -9.350 1.00 18.70 C ATOM 225 CG MET A 316 7.774 -3.684 -9.997 1.00 16.48 C ATOM 226 SD MET A 316 7.479 -3.942 -11.750 1.00 16.86 S ATOM 227 CE MET A 316 9.169 -4.071 -12.311 1.00 18.31 C ATOM 228 H MET A 316 6.842 -5.107 -7.457 1.00 0.00 H ATOM 229 N ASP A 317 5.081 -1.088 -7.739 1.00 18.37 N ATOM 230 CA ASP A 317 3.785 -0.455 -7.546 1.00 19.84 C ATOM 231 C ASP A 317 2.991 -0.548 -8.876 1.00 18.86 C ATOM 232 O ASP A 317 3.518 -1.046 -9.876 1.00 17.20 O ATOM 233 CB ASP A 317 3.961 0.988 -6.999 1.00 22.28 C ATOM 234 CG ASP A 317 4.483 1.988 -8.025 1.00 22.42 C ATOM 235 OD1 ASP A 317 4.392 1.764 -9.245 1.00 21.05 O ATOM 236 OD2 ASP A 317 4.980 3.043 -7.582 1.00 25.08 O ATOM 237 H ASP A 317 5.882 -0.526 -8.092 1.00 0.00 H ATOM 238 N PRO A 318 1.715 -0.115 -8.883 1.00 16.45 N ATOM 239 CA PRO A 318 0.907 -0.295 -10.098 1.00 18.08 C ATOM 240 C PRO A 318 1.436 0.464 -11.308 1.00 17.43 C ATOM 241 O PRO A 318 1.290 -0.024 -12.431 1.00 18.64 O ATOM 242 CB PRO A 318 -0.463 0.251 -9.685 1.00 20.72 C ATOM 243 CG PRO A 318 -0.502 0.045 -8.227 1.00 23.46 C ATOM 244 CD PRO A 318 0.880 0.303 -7.741 1.00 19.68 C ATOM 245 N TYR A 319 2.020 1.634 -11.079 1.00 16.60 N ATOM 246 CA TYR A 319 2.562 2.437 -12.167 1.00 20.66 C ATOM 247 C TYR A 319 3.703 1.672 -12.844 1.00 15.63 C ATOM 248 O TYR A 319 3.784 1.579 -14.074 1.00 16.82 O ATOM 249 CB TYR A 319 3.055 3.784 -11.639 1.00 18.64 C ATOM 250 CG TYR A 319 2.013 4.611 -10.903 1.00 23.60 C ATOM 251 CD1 TYR A 319 0.976 5.219 -11.584 1.00 27.12 C ATOM 252 CD2 TYR A 319 2.069 4.784 -9.525 1.00 19.63 C ATOM 253 CE1 TYR A 319 0.031 5.979 -10.934 1.00 24.50 C ATOM 254 CE2 TYR A 319 1.112 5.537 -8.856 1.00 28.56 C ATOM 255 CZ TYR A 319 0.095 6.126 -9.574 1.00 25.17 C ATOM 256 OH TYR A 319 -0.858 6.886 -8.935 1.00 29.12 O ATOM 257 HH TYR A 319 -1.331 6.328 -8.269 1.00 0.00 H ATOM 258 H TYR A 319 2.092 1.985 -10.103 1.00 0.00 H ATOM 259 N GLU A 320 4.577 1.105 -12.022 1.00 15.14 N ATOM 260 CA GLU A 320 5.705 0.333 -12.519 1.00 14.27 C ATOM 261 C GLU A 320 5.247 -0.909 -13.272 1.00 13.75 C ATOM 262 O GLU A 320 5.806 -1.253 -14.320 1.00 14.44 O ATOM 263 CB GLU A 320 6.622 -0.031 -11.352 1.00 14.49 C ATOM 264 CG GLU A 320 7.277 1.197 -10.751 1.00 16.14 C ATOM 265 CD GLU A 320 7.968 0.926 -9.435 1.00 15.22 C ATOM 266 OE1 GLU A 320 7.526 0.037 -8.676 1.00 18.23 O ATOM 267 OE2 GLU A 320 8.940 1.649 -9.140 1.00 18.33 O ATOM 268 H GLU A 320 4.452 1.216 -10.995 1.00 0.00 H ATOM 269 N ARG A 321 4.223 -1.590 -12.769 1.00 13.90 N ATOM 270 CA ARG A 321 3.752 -2.780 -13.470 1.00 14.58 C ATOM 271 C ARG A 321 3.052 -2.420 -14.781 1.00 15.04 C ATOM 272 O ARG A 321 3.162 -3.168 -15.762 1.00 14.39 O ATOM 273 CB ARG A 321 2.848 -3.635 -12.575 1.00 17.21 C ATOM 274 CG ARG A 321 3.656 -4.587 -11.690 1.00 24.94 C ATOM 275 CD ARG A 321 2.780 -5.613 -10.989 1.00 44.19 C ATOM 276 NE ARG A 321 1.813 -4.958 -10.119 1.00 38.51 N ATOM 277 CZ ARG A 321 2.043 -4.646 -8.850 1.00 41.04 C ATOM 278 NH1 ARG A 321 3.209 -4.940 -8.289 1.00 34.07 N ATOM 279 NH2 ARG A 321 1.104 -4.041 -8.139 1.00 33.37 N ATOM 280 HE ARG A 321 0.883 -4.720 -10.518 1.00 0.00 H ATOM 281 HH12 ARG A 321 3.384 -4.693 -7.294 1.00 0.00 H ATOM 282 HH11 ARG A 321 3.948 -5.417 -8.844 1.00 0.00 H ATOM 283 HH22 ARG A 321 1.282 -3.796 -7.144 1.00 0.00 H ATOM 284 HH21 ARG A 321 0.188 -3.811 -8.575 1.00 0.00 H ATOM 285 H ARG A 321 3.764 -1.280 -11.889 1.00 0.00 H ATOM 286 N CYS A 322 2.353 -1.288 -14.824 1.00 14.45 N ATOM 287 CA CYS A 322 1.737 -0.862 -16.079 1.00 15.28 C ATOM 288 C CYS A 322 2.800 -0.620 -17.147 1.00 15.54 C ATOM 289 O CYS A 322 2.608 -0.982 -18.318 1.00 16.43 O ATOM 290 CB CYS A 322 0.903 0.398 -15.887 1.00 17.46 C ATOM 291 SG CYS A 322 -0.638 0.184 -14.959 1.00 22.55 S ATOM 292 H CYS A 322 2.246 -0.708 -13.967 1.00 0.00 H ATOM 293 N LYS A 323 3.932 -0.042 -16.749 1.00 14.31 N ATOM 294 CA LYS A 323 5.053 0.164 -17.664 1.00 15.03 C ATOM 295 C LYS A 323 5.560 -1.157 -18.242 1.00 14.81 C ATOM 296 O LYS A 323 5.886 -1.247 -19.428 1.00 15.18 O ATOM 297 CB LYS A 323 6.202 0.884 -16.960 1.00 15.33 C ATOM 298 CG LYS A 323 5.901 2.307 -16.530 1.00 22.17 C ATOM 299 CD LYS A 323 5.528 3.185 -17.711 1.00 31.21 C ATOM 300 CE LYS A 323 5.624 4.657 -17.346 1.00 34.02 C ATOM 301 NZ LYS A 323 5.063 5.536 -18.409 1.00 32.06 N ATOM 302 HZ1 LYS A 323 5.588 5.386 -19.294 1.00 0.00 H ATOM 303 HZ2 LYS A 323 4.060 5.303 -18.556 1.00 0.00 H ATOM 304 HZ3 LYS A 323 5.150 6.530 -18.117 1.00 0.00 H ATOM 305 H LYS A 323 4.021 0.271 -15.761 1.00 0.00 H ATOM 306 N VAL A 324 5.650 -2.182 -17.401 1.00 12.90 N ATOM 307 CA VAL A 324 6.067 -3.493 -17.886 1.00 13.84 C ATOM 308 C VAL A 324 5.060 -4.018 -18.904 1.00 13.89 C ATOM 309 O VAL A 324 5.427 -4.500 -19.986 1.00 13.23 O ATOM 310 CB VAL A 324 6.198 -4.517 -16.749 1.00 12.91 C ATOM 311 CG1 VAL A 324 6.564 -5.878 -17.327 1.00 14.58 C ATOM 312 CG2 VAL A 324 7.236 -4.077 -15.724 1.00 14.68 C ATOM 313 H VAL A 324 5.423 -2.049 -16.395 1.00 0.00 H ATOM 314 N ALA A 325 3.787 -3.931 -18.543 1.00 12.39 N ATOM 315 CA ALA A 325 2.718 -4.475 -19.373 1.00 15.01 C ATOM 316 C ALA A 325 2.704 -3.863 -20.763 1.00 14.52 C ATOM 317 O ALA A 325 2.386 -4.540 -21.743 1.00 18.43 O ATOM 318 CB ALA A 325 1.386 -4.257 -18.704 1.00 15.21 C ATOM 319 H ALA A 325 3.545 -3.463 -17.646 1.00 0.00 H ATOM 320 N ASP A 326 3.062 -2.588 -20.860 1.00 16.38 N ATOM 321 CA ASP A 326 3.004 -1.884 -22.133 1.00 16.83 C ATOM 322 C ASP A 326 4.026 -2.392 -23.146 1.00 18.19 C ATOM 323 O ASP A 326 3.919 -2.080 -24.330 1.00 20.95 O ATOM 324 CB ASP A 326 3.207 -0.382 -21.916 1.00 21.53 C ATOM 325 CG ASP A 326 2.540 0.455 -22.992 1.00 61.34 C ATOM 326 OD1 ASP A 326 1.526 -0.008 -23.562 1.00 49.58 O ATOM 327 OD2 ASP A 326 3.025 1.572 -23.269 1.00 73.82 O ATOM 328 H ASP A 326 3.390 -2.083 -20.012 1.00 0.00 H ATOM 329 N CYS A 327 4.995 -3.184 -22.692 1.00 15.38 N ATOM 330 CA CYS A 327 6.079 -3.641 -23.561 1.00 15.05 C ATOM 331 C CYS A 327 6.128 -5.153 -23.754 1.00 14.38 C ATOM 332 O CYS A 327 6.944 -5.656 -24.525 1.00 15.44 O ATOM 333 CB CYS A 327 7.427 -3.170 -23.014 1.00 14.63 C ATOM 334 SG CYS A 327 7.621 -1.381 -23.021 1.00 22.84 S ATOM 335 H CYS A 327 4.981 -3.485 -21.697 1.00 0.00 H ATOM 336 N LEU A 328 5.260 -5.892 -23.071 1.00 14.51 N ATOM 337 CA LEU A 328 5.253 -7.342 -23.200 1.00 14.05 C ATOM 338 C LEU A 328 4.773 -7.811 -24.556 1.00 12.71 C ATOM 339 O LEU A 328 3.939 -7.162 -25.205 1.00 14.80 O ATOM 340 CB LEU A 328 4.367 -7.968 -22.131 1.00 13.59 C ATOM 341 CG LEU A 328 4.850 -7.873 -20.691 1.00 13.81 C ATOM 342 CD1 LEU A 328 3.754 -8.361 -19.782 1.00 14.35 C ATOM 343 CD2 LEU A 328 6.098 -8.697 -20.498 1.00 13.48 C ATOM 344 H LEU A 328 4.578 -5.429 -22.437 1.00 0.00 H ATOM 345 N LYS A 329 5.295 -8.968 -24.957 1.00 13.32 N ATOM 346 CA LYS A 329 4.797 -9.714 -26.102 1.00 13.02 C ATOM 347 C LYS A 329 4.508 -11.135 -25.634 1.00 12.66 C ATOM 348 O LYS A 329 4.994 -11.550 -24.582 1.00 13.61 O ATOM 349 CB LYS A 329 5.806 -9.725 -27.248 1.00 16.32 C ATOM 350 CG LYS A 329 6.041 -8.366 -27.879 1.00 18.47 C ATOM 351 CD LYS A 329 7.173 -8.458 -28.899 1.00 28.28 C ATOM 352 CE LYS A 329 7.468 -7.119 -29.549 1.00 44.57 C ATOM 353 NZ LYS A 329 6.386 -6.719 -30.486 1.00 65.37 N ATOM 354 HZ1 LYS A 329 6.294 -7.436 -31.234 1.00 0.00 H ATOM 355 HZ2 LYS A 329 5.489 -6.643 -29.965 1.00 0.00 H ATOM 356 HZ3 LYS A 329 6.620 -5.800 -30.912 1.00 0.00 H ATOM 357 H LYS A 329 6.099 -9.358 -24.425 1.00 0.00 H ATOM 358 N SER A 330 3.702 -11.858 -26.407 1.00 13.22 N ATOM 359 CA SER A 330 3.274 -13.222 -26.067 1.00 14.27 C ATOM 360 C SER A 330 3.728 -14.238 -27.102 1.00 13.21 C ATOM 361 O SER A 330 3.749 -13.939 -28.285 1.00 16.56 O ATOM 362 CB SER A 330 1.749 -13.321 -25.973 1.00 16.14 C ATOM 363 OG SER A 330 1.218 -12.454 -24.988 1.00 18.59 O ATOM 364 HG SER A 330 1.453 -11.519 -25.212 1.00 0.00 H ATOM 365 H SER A 330 3.358 -11.438 -27.294 1.00 0.00 H ATOM 366 N LYS A 331 4.047 -15.453 -26.667 1.00 13.40 N ATOM 367 CA LYS A 331 4.147 -16.571 -27.602 1.00 12.88 C ATOM 368 C LYS A 331 3.980 -17.888 -26.869 1.00 12.21 C ATOM 369 O LYS A 331 3.990 -17.946 -25.637 1.00 12.37 O ATOM 370 CB LYS A 331 5.461 -16.531 -28.389 1.00 16.89 C ATOM 371 CG LYS A 331 6.711 -16.605 -27.557 1.00 16.99 C ATOM 372 CD LYS A 331 7.935 -16.593 -28.472 1.00 22.95 C ATOM 373 CE LYS A 331 9.214 -16.336 -27.704 1.00 44.77 C ATOM 374 NZ LYS A 331 10.390 -16.195 -28.615 1.00 49.71 N ATOM 375 HZ1 LYS A 331 10.509 -17.070 -29.164 1.00 0.00 H ATOM 376 HZ2 LYS A 331 10.232 -15.397 -29.263 1.00 0.00 H ATOM 377 HZ3 LYS A 331 11.246 -16.020 -28.050 1.00 0.00 H ATOM 378 H LYS A 331 4.227 -15.609 -25.655 1.00 0.00 H ATOM 379 N SER A 332 3.809 -18.943 -27.657 1.00 11.86 N ATOM 380 CA SER A 332 3.505 -20.263 -27.137 1.00 12.20 C ATOM 381 C SER A 332 4.491 -21.322 -27.597 1.00 11.26 C ATOM 382 O SER A 332 5.117 -21.216 -28.656 1.00 12.28 O ATOM 383 CB SER A 332 2.104 -20.701 -27.552 1.00 14.78 C ATOM 384 OG SER A 332 1.121 -19.778 -27.116 1.00 16.15 O ATOM 385 HG SER A 332 0.226 -20.091 -27.401 1.00 0.00 H ATOM 386 H SER A 332 3.896 -18.818 -28.686 1.00 0.00 H ATOM 387 N TYR A 333 4.573 -22.366 -26.791 1.00 11.35 N ATOM 388 CA TYR A 333 5.418 -23.513 -27.056 1.00 10.96 C ATOM 389 C TYR A 333 4.620 -24.789 -26.937 1.00 11.53 C ATOM 390 O TYR A 333 3.777 -24.936 -26.037 1.00 12.82 O ATOM 391 CB TYR A 333 6.586 -23.571 -26.075 1.00 12.15 C ATOM 392 CG TYR A 333 7.533 -22.412 -26.214 1.00 12.09 C ATOM 393 CD1 TYR A 333 8.656 -22.502 -27.015 1.00 14.67 C ATOM 394 CD2 TYR A 333 7.299 -21.216 -25.539 1.00 13.04 C ATOM 395 CE1 TYR A 333 9.521 -21.432 -27.145 1.00 15.14 C ATOM 396 CE2 TYR A 333 8.154 -20.149 -25.668 1.00 14.85 C ATOM 397 CZ TYR A 333 9.260 -20.259 -26.467 1.00 15.96 C ATOM 398 OH TYR A 333 10.127 -19.187 -26.590 1.00 19.61 O ATOM 399 HH TYR A 333 10.868 -19.432 -27.199 1.00 0.00 H ATOM 400 H TYR A 333 4.002 -22.364 -25.922 1.00 0.00 H ATOM 401 N ASN A 334 4.915 -25.741 -27.820 1.00 11.35 N ATOM 402 CA ASN A 334 4.333 -27.076 -27.737 1.00 11.38 C ATOM 403 C ASN A 334 5.096 -27.974 -26.799 1.00 11.77 C ATOM 404 O ASN A 334 6.276 -27.745 -26.535 1.00 11.90 O ATOM 405 CB ASN A 334 4.293 -27.715 -29.117 1.00 12.14 C ATOM 406 CG ASN A 334 3.536 -26.885 -30.096 1.00 13.13 C ATOM 407 OD1 ASN A 334 2.334 -26.670 -29.934 1.00 14.93 O ATOM 408 ND2 ASN A 334 4.228 -26.388 -31.123 1.00 14.04 N ATOM 409 HD22 ASN A 334 5.242 -26.598 -31.217 1.00 0.00 H ATOM 410 HD21 ASN A 334 3.753 -25.791 -31.830 1.00 0.00 H ATOM 411 H ASN A 334 5.579 -25.527 -28.591 1.00 0.00 H ATOM 412 N ASP A 335 4.412 -29.002 -26.310 1.00 12.26 N ATOM 413 CA ASP A 335 5.014 -30.049 -25.497 1.00 13.28 C ATOM 414 C ASP A 335 6.336 -30.523 -26.101 1.00 13.45 C ATOM 415 O ASP A 335 6.397 -30.854 -27.291 1.00 14.90 O ATOM 416 CB ASP A 335 4.017 -31.209 -25.363 1.00 14.62 C ATOM 417 CG ASP A 335 4.511 -32.329 -24.472 1.00 26.67 C ATOM 418 OD1 ASP A 335 5.404 -32.096 -23.641 1.00 17.99 O ATOM 419 OD2 ASP A 335 3.965 -33.453 -24.590 1.00 33.31 O ATOM 420 H ASP A 335 3.395 -29.062 -26.518 1.00 0.00 H ATOM 421 N GLY A 336 7.393 -30.527 -25.302 1.00 12.94 N ATOM 422 CA GLY A 336 8.696 -30.995 -25.736 1.00 14.48 C ATOM 423 C GLY A 336 9.601 -29.940 -26.351 1.00 15.52 C ATOM 424 O GLY A 336 10.794 -30.179 -26.542 1.00 16.53 O ATOM 425 H GLY A 336 7.285 -30.182 -24.327 1.00 0.00 H ATOM 426 N GLU A 337 9.059 -28.780 -26.694 1.00 12.28 N ATOM 427 CA GLU A 337 9.893 -27.757 -27.300 1.00 12.97 C ATOM 428 C GLU A 337 10.810 -27.088 -26.286 1.00 11.98 C ATOM 429 O GLU A 337 10.457 -26.866 -25.121 1.00 12.44 O ATOM 430 CB GLU A 337 9.034 -26.718 -28.010 1.00 12.83 C ATOM 431 CG GLU A 337 8.455 -27.240 -29.312 1.00 13.18 C ATOM 432 CD GLU A 337 7.574 -26.249 -30.008 1.00 12.81 C ATOM 433 OE1 GLU A 337 7.255 -25.183 -29.433 1.00 12.98 O ATOM 434 OE2 GLU A 337 7.172 -26.531 -31.161 1.00 13.88 O ATOM 435 H GLU A 337 8.047 -28.604 -26.531 1.00 0.00 H ATOM 436 N ILE A 338 11.996 -26.760 -26.759 1.00 12.46 N ATOM 437 CA ILE A 338 12.980 -26.070 -25.942 1.00 12.95 C ATOM 438 C ILE A 338 12.719 -24.571 -25.980 1.00 12.58 C ATOM 439 O ILE A 338 12.638 -23.970 -27.047 1.00 14.90 O ATOM 440 CB ILE A 338 14.411 -26.397 -26.417 1.00 14.29 C ATOM 441 CG1 ILE A 338 14.741 -27.871 -26.135 1.00 14.09 C ATOM 442 CG2 ILE A 338 15.422 -25.482 -25.757 1.00 14.20 C ATOM 443 CD1 ILE A 338 16.121 -28.299 -26.606 1.00 20.22 C ATOM 444 H ILE A 338 12.234 -27.001 -27.742 1.00 0.00 H ATOM 445 N ILE A 339 12.562 -23.979 -24.807 1.00 11.37 N ATOM 446 CA ILE A 339 12.336 -22.546 -24.687 1.00 14.02 C ATOM 447 C ILE A 339 13.682 -21.831 -24.590 1.00 12.34 C ATOM 448 O ILE A 339 13.912 -20.810 -25.246 1.00 14.03 O ATOM 449 CB ILE A 339 11.460 -22.216 -23.457 1.00 12.39 C ATOM 450 CG1 ILE A 339 10.135 -22.992 -23.534 1.00 13.27 C ATOM 451 CG2 ILE A 339 11.266 -20.687 -23.332 1.00 14.28 C ATOM 452 CD1 ILE A 339 9.231 -22.799 -22.337 1.00 15.43 C ATOM 453 H ILE A 339 12.601 -24.556 -23.943 1.00 0.00 H ATOM 454 N ILE A 340 14.584 -22.394 -23.793 1.00 12.58 N ATOM 455 CA ILE A 340 15.941 -21.888 -23.637 1.00 11.86 C ATOM 456 C ILE A 340 16.874 -23.076 -23.701 1.00 12.51 C ATOM 457 O ILE A 340 16.612 -24.079 -23.041 1.00 11.44 O ATOM 458 CB ILE A 340 16.121 -21.149 -22.285 1.00 12.44 C ATOM 459 CG1 ILE A 340 15.449 -19.775 -22.315 1.00 14.67 C ATOM 460 CG2 ILE A 340 17.593 -21.022 -21.928 1.00 14.10 C ATOM 461 CD1 ILE A 340 15.476 -19.072 -20.980 1.00 14.85 C ATOM 462 H ILE A 340 14.307 -23.239 -23.253 1.00 0.00 H ATOM 463 N LYS A 341 17.944 -22.977 -24.486 1.00 13.97 N ATOM 464 CA LYS A 341 18.921 -24.050 -24.574 1.00 13.33 C ATOM 465 C LYS A 341 20.230 -23.634 -23.925 1.00 13.70 C ATOM 466 O LYS A 341 20.816 -22.606 -24.279 1.00 15.25 O ATOM 467 CB LYS A 341 19.164 -24.452 -26.029 1.00 16.11 C ATOM 468 CG LYS A 341 20.157 -25.597 -26.190 1.00 17.88 C ATOM 469 CD LYS A 341 20.134 -26.161 -27.602 1.00 30.12 C ATOM 470 CE LYS A 341 21.021 -27.389 -27.745 1.00 54.26 C ATOM 471 NZ LYS A 341 22.464 -27.036 -27.760 1.00 54.22 N ATOM 472 HZ1 LYS A 341 22.656 -26.401 -28.561 1.00 0.00 H ATOM 473 HZ2 LYS A 341 22.712 -26.558 -26.870 1.00 0.00 H ATOM 474 HZ3 LYS A 341 23.031 -27.902 -27.859 1.00 0.00 H ATOM 475 H LYS A 341 18.084 -22.114 -25.049 1.00 0.00 H ATOM 476 N GLU A 342 20.728 -24.457 -23.010 1.00 14.36 N ATOM 477 CA GLU A 342 21.956 -24.137 -22.308 1.00 14.29 C ATOM 478 C GLU A 342 23.105 -23.911 -23.291 1.00 15.41 C ATOM 479 O GLU A 342 23.251 -24.649 -24.268 1.00 18.06 O ATOM 480 CB GLU A 342 22.310 -25.256 -21.321 1.00 17.55 C ATOM 481 CG GLU A 342 23.556 -24.992 -20.492 1.00 32.11 C ATOM 482 CD GLU A 342 23.976 -26.188 -19.646 1.00 74.26 C ATOM 483 OE1 GLU A 342 23.241 -27.202 -19.624 1.00 34.11 O ATOM 484 OE2 GLU A 342 25.050 -26.115 -19.005 1.00 36.34 O ATOM 485 H GLU A 342 20.230 -25.344 -22.793 1.00 0.00 H ATOM 486 N GLY A 343 23.916 -22.884 -23.036 1.00 16.07 N ATOM 487 CA GLY A 343 25.073 -22.598 -23.863 1.00 18.41 C ATOM 488 C GLY A 343 24.828 -21.635 -25.010 1.00 18.62 C ATOM 489 O GLY A 343 25.783 -21.143 -25.609 1.00 19.95 O ATOM 490 H GLY A 343 23.713 -22.270 -22.221 1.00 0.00 H ATOM 491 N GLU A 344 23.569 -21.377 -25.339 1.00 19.26 N ATOM 492 CA GLU A 344 23.258 -20.429 -26.402 1.00 19.60 C ATOM 493 C GLU A 344 23.288 -19.013 -25.866 1.00 18.70 C ATOM 494 O GLU A 344 23.178 -18.795 -24.666 1.00 17.55 O ATOM 495 CB GLU A 344 21.892 -20.718 -27.018 1.00 18.22 C ATOM 496 CG GLU A 344 21.833 -22.014 -27.796 1.00 24.19 C ATOM 497 CD GLU A 344 20.590 -22.127 -28.648 1.00 39.23 C ATOM 498 OE1 GLU A 344 19.676 -21.289 -28.487 1.00 24.85 O ATOM 499 OE2 GLU A 344 20.532 -23.056 -29.487 1.00 41.69 O ATOM 500 H GLU A 344 22.796 -21.856 -24.834 1.00 0.00 H ATOM 501 N GLU A 345 23.433 -18.038 -26.754 1.00 19.27 N ATOM 502 CA GLU A 345 23.275 -16.649 -26.342 1.00 19.62 C ATOM 503 C GLU A 345 21.812 -16.385 -26.024 1.00 19.03 C ATOM 504 O GLU A 345 20.916 -17.008 -26.596 1.00 20.94 O ATOM 505 CB GLU A 345 23.781 -15.691 -27.418 1.00 22.72 C ATOM 506 CG GLU A 345 25.291 -15.754 -27.605 1.00 44.73 C ATOM 507 CD GLU A 345 26.042 -15.714 -26.282 1.00 55.10 C ATOM 508 OE1 GLU A 345 25.960 -14.686 -25.576 1.00 60.36 O ATOM 509 OE2 GLU A 345 26.713 -16.714 -25.947 1.00 50.82 O ATOM 510 H GLU A 345 23.659 -18.265 -27.743 1.00 0.00 H ATOM 511 N GLY A 346 21.581 -15.482 -25.086 1.00 18.95 N ATOM 512 CA GLY A 346 20.230 -15.171 -24.669 1.00 21.58 C ATOM 513 C GLY A 346 19.972 -13.680 -24.668 1.00 18.36 C ATOM 514 O GLY A 346 20.820 -12.906 -24.240 1.00 21.68 O ATOM 515 H GLY A 346 22.381 -14.988 -24.642 1.00 0.00 H ATOM 516 N ASP A 347 18.793 -13.288 -25.136 1.00 18.38 N ATOM 517 CA ASP A 347 18.402 -11.886 -25.149 1.00 16.19 C ATOM 518 C ASP A 347 16.973 -11.682 -24.667 1.00 19.46 C ATOM 519 O ASP A 347 16.418 -10.586 -24.840 1.00 19.47 O ATOM 520 CB ASP A 347 18.552 -11.303 -26.558 1.00 30.36 C ATOM 521 CG ASP A 347 19.991 -11.282 -27.032 1.00 54.11 C ATOM 522 OD1 ASP A 347 20.881 -10.936 -26.226 1.00 65.50 O ATOM 523 OD2 ASP A 347 20.230 -11.615 -28.211 1.00 74.93 O ATOM 524 H ASP A 347 18.131 -14.002 -25.503 1.00 0.00 H ATOM 525 N THR A 348 16.385 -12.711 -24.058 1.00 16.77 N ATOM 526 CA THR A 348 14.960 -12.685 -23.740 1.00 15.09 C ATOM 527 C THR A 348 14.674 -13.112 -22.304 1.00 13.60 C ATOM 528 O THR A 348 15.189 -14.128 -21.839 1.00 14.15 O ATOM 529 CB THR A 348 14.172 -13.603 -24.707 1.00 16.47 C ATOM 530 OG1 THR A 348 14.436 -13.199 -26.058 1.00 19.98 O ATOM 531 CG2 THR A 348 12.675 -13.524 -24.444 1.00 16.04 C ATOM 532 HG1 THR A 348 14.149 -12.260 -26.182 1.00 0.00 H ATOM 533 H THR A 348 16.950 -13.546 -23.805 1.00 0.00 H ATOM 534 N PHE A 349 13.858 -12.315 -21.621 1.00 12.62 N ATOM 535 CA PHE A 349 13.346 -12.602 -20.287 1.00 11.92 C ATOM 536 C PHE A 349 11.920 -13.117 -20.409 1.00 11.76 C ATOM 537 O PHE A 349 11.127 -12.543 -21.166 1.00 12.78 O ATOM 538 CB PHE A 349 13.391 -11.330 -19.437 1.00 13.79 C ATOM 539 CG PHE A 349 12.621 -11.420 -18.148 1.00 12.50 C ATOM 540 CD1 PHE A 349 13.218 -11.930 -17.017 1.00 15.39 C ATOM 541 CD2 PHE A 349 11.309 -10.954 -18.056 1.00 13.34 C ATOM 542 CE1 PHE A 349 12.518 -12.000 -15.817 1.00 16.65 C ATOM 543 CE2 PHE A 349 10.612 -11.020 -16.861 1.00 14.25 C ATOM 544 CZ PHE A 349 11.212 -11.547 -15.750 1.00 14.73 C ATOM 545 H PHE A 349 13.564 -11.424 -22.070 1.00 0.00 H ATOM 546 N PHE A 350 11.586 -14.168 -19.661 1.00 10.52 N ATOM 547 CA PHE A 350 10.279 -14.805 -19.752 1.00 10.76 C ATOM 548 C PHE A 350 9.521 -14.848 -18.441 1.00 11.48 C ATOM 549 O PHE A 350 10.105 -15.092 -17.383 1.00 11.04 O ATOM 550 CB PHE A 350 10.390 -16.269 -20.199 1.00 11.19 C ATOM 551 CG PHE A 350 11.004 -16.484 -21.548 1.00 12.15 C ATOM 552 CD1 PHE A 350 12.370 -16.665 -21.689 1.00 12.17 C ATOM 553 CD2 PHE A 350 10.206 -16.551 -22.677 1.00 13.73 C ATOM 554 CE1 PHE A 350 12.935 -16.893 -22.931 1.00 13.86 C ATOM 555 CE2 PHE A 350 10.769 -16.787 -23.925 1.00 15.63 C ATOM 556 CZ PHE A 350 12.133 -16.951 -24.039 1.00 14.03 C ATOM 557 H PHE A 350 12.283 -14.547 -18.989 1.00 0.00 H ATOM 558 N ILE A 351 8.202 -14.717 -18.530 1.00 11.69 N ATOM 559 CA ILE A 351 7.300 -15.126 -17.471 1.00 11.94 C ATOM 560 C ILE A 351 6.368 -16.173 -18.064 1.00 10.35 C ATOM 561 O ILE A 351 5.780 -15.958 -19.127 1.00 11.33 O ATOM 562 CB ILE A 351 6.495 -13.941 -16.902 1.00 11.65 C ATOM 563 CG1 ILE A 351 7.416 -12.919 -16.224 1.00 13.12 C ATOM 564 CG2 ILE A 351 5.430 -14.433 -15.933 1.00 13.92 C ATOM 565 CD1 ILE A 351 6.744 -11.569 -15.946 1.00 15.65 C ATOM 566 H ILE A 351 7.800 -14.304 -19.395 1.00 0.00 H ATOM 567 N LEU A 352 6.250 -17.306 -17.376 1.00 11.33 N ATOM 568 CA LEU A 352 5.363 -18.388 -17.783 1.00 10.97 C ATOM 569 C LEU A 352 3.967 -18.068 -17.302 1.00 10.66 C ATOM 570 O LEU A 352 3.751 -17.951 -16.094 1.00 12.69 O ATOM 571 CB LEU A 352 5.852 -19.709 -17.194 1.00 11.68 C ATOM 572 CG LEU A 352 5.080 -20.975 -17.546 1.00 11.34 C ATOM 573 CD1 LEU A 352 5.087 -21.229 -19.048 1.00 12.31 C ATOM 574 CD2 LEU A 352 5.695 -22.147 -16.796 1.00 12.40 C ATOM 575 H LEU A 352 6.815 -17.424 -16.511 1.00 0.00 H ATOM 576 N ILE A 353 3.011 -17.897 -18.210 1.00 11.66 N ATOM 577 CA ILE A 353 1.683 -17.496 -17.768 1.00 12.65 C ATOM 578 C ILE A 353 0.691 -18.652 -17.804 1.00 12.67 C ATOM 579 O ILE A 353 -0.362 -18.568 -17.197 1.00 16.56 O ATOM 580 CB ILE A 353 1.132 -16.292 -18.577 1.00 14.24 C ATOM 581 CG1 ILE A 353 0.835 -16.665 -20.032 1.00 15.44 C ATOM 582 CG2 ILE A 353 2.098 -15.120 -18.494 1.00 16.74 C ATOM 583 CD1 ILE A 353 0.077 -15.582 -20.801 1.00 17.95 C ATOM 584 H ILE A 353 3.209 -18.047 -19.220 1.00 0.00 H ATOM 585 N ASP A 354 1.037 -19.750 -18.467 1.00 12.80 N ATOM 586 CA ASP A 354 0.201 -20.950 -18.447 1.00 13.29 C ATOM 587 C ASP A 354 1.059 -22.125 -18.886 1.00 12.65 C ATOM 588 O ASP A 354 1.869 -21.985 -19.808 1.00 13.13 O ATOM 589 CB ASP A 354 -1.013 -20.804 -19.364 1.00 20.30 C ATOM 590 CG ASP A 354 -2.123 -21.789 -19.032 1.00 31.82 C ATOM 591 OD1 ASP A 354 -2.187 -22.266 -17.878 1.00 54.43 O ATOM 592 OD2 ASP A 354 -2.944 -22.079 -19.927 1.00 85.83 O ATOM 593 H ASP A 354 1.922 -19.756 -19.013 1.00 0.00 H ATOM 594 N GLY A 355 0.905 -23.272 -18.230 1.00 13.87 N ATOM 595 CA GLY A 355 1.662 -24.453 -18.603 1.00 13.00 C ATOM 596 C GLY A 355 2.685 -24.905 -17.580 1.00 12.14 C ATOM 597 O GLY A 355 2.759 -24.389 -16.464 1.00 14.01 O ATOM 598 H GLY A 355 0.232 -23.323 -17.438 1.00 0.00 H ATOM 599 N ASN A 356 3.498 -25.858 -18.006 1.00 11.19 N ATOM 600 CA ASN A 356 4.455 -26.570 -17.160 1.00 12.01 C ATOM 601 C ASN A 356 5.780 -26.633 -17.908 1.00 10.90 C ATOM 602 O ASN A 356 5.799 -27.127 -19.030 1.00 12.01 O ATOM 603 CB ASN A 356 3.910 -27.981 -16.852 1.00 10.74 C ATOM 604 CG ASN A 356 4.835 -28.822 -15.983 1.00 15.20 C ATOM 605 OD1 ASN A 356 6.016 -28.987 -16.278 1.00 13.78 O ATOM 606 ND2 ASN A 356 4.278 -29.396 -14.916 1.00 14.60 N ATOM 607 HD22 ASN A 356 3.274 -29.230 -14.701 1.00 0.00 H ATOM 608 HD21 ASN A 356 4.848 -30.009 -14.299 1.00 0.00 H ATOM 609 H ASN A 356 3.453 -26.119 -19.012 1.00 0.00 H ATOM 610 N ALA A 357 6.867 -26.159 -17.315 1.00 10.74 N ATOM 611 CA ALA A 357 8.173 -26.271 -17.958 1.00 10.14 C ATOM 612 C ALA A 357 9.193 -26.770 -16.947 1.00 10.02 C ATOM 613 O ALA A 357 8.963 -26.696 -15.740 1.00 12.04 O ATOM 614 CB ALA A 357 8.609 -24.933 -18.571 1.00 11.81 C ATOM 615 H ALA A 357 6.789 -25.703 -16.383 1.00 0.00 H ATOM 616 N VAL A 358 10.317 -27.281 -17.432 1.00 11.06 N ATOM 617 CA VAL A 358 11.313 -27.862 -16.536 1.00 11.37 C ATOM 618 C VAL A 358 12.703 -27.415 -16.957 1.00 11.17 C ATOM 619 O VAL A 358 13.026 -27.399 -18.155 1.00 11.34 O ATOM 620 CB VAL A 358 11.219 -29.423 -16.493 1.00 12.64 C ATOM 621 CG1 VAL A 358 11.419 -30.057 -17.870 1.00 15.32 C ATOM 622 CG2 VAL A 358 12.189 -29.988 -15.463 1.00 14.29 C ATOM 623 H VAL A 358 10.490 -27.268 -18.457 1.00 0.00 H ATOM 624 N ALA A 359 13.505 -27.021 -15.971 1.00 11.12 N ATOM 625 CA ALA A 359 14.892 -26.620 -16.174 1.00 11.38 C ATOM 626 C ALA A 359 15.849 -27.732 -15.815 1.00 10.86 C ATOM 627 O ALA A 359 15.688 -28.391 -14.778 1.00 11.46 O ATOM 628 CB ALA A 359 15.223 -25.400 -15.346 1.00 11.06 C ATOM 629 H ALA A 359 13.122 -26.998 -15.004 1.00 0.00 H ATOM 630 N SER A 360 16.848 -27.921 -16.665 1.00 11.18 N ATOM 631 CA SER A 360 17.887 -28.898 -16.427 1.00 12.70 C ATOM 632 C SER A 360 19.240 -28.304 -16.774 1.00 12.78 C ATOM 633 O SER A 360 19.340 -27.369 -17.573 1.00 13.47 O ATOM 634 CB SER A 360 17.636 -30.172 -17.232 1.00 14.39 C ATOM 635 OG SER A 360 17.672 -29.900 -18.615 1.00 21.67 O ATOM 636 HG SER A 360 16.972 -29.236 -18.838 1.00 0.00 H ATOM 637 H SER A 360 16.886 -27.348 -17.532 1.00 0.00 H ATOM 638 N LYS A 361 20.286 -28.818 -16.153 1.00 13.77 N ATOM 639 CA LYS A 361 21.639 -28.371 -16.444 1.00 14.65 C ATOM 640 C LYS A 361 22.532 -29.599 -16.413 1.00 17.14 C ATOM 641 O LYS A 361 22.439 -30.372 -15.467 1.00 16.95 O ATOM 642 CB LYS A 361 22.094 -27.323 -15.424 1.00 14.76 C ATOM 643 CG LYS A 361 23.473 -26.752 -15.667 1.00 18.26 C ATOM 644 CD LYS A 361 23.820 -25.708 -14.608 1.00 20.50 C ATOM 645 CE LYS A 361 25.226 -25.142 -14.807 1.00 22.90 C ATOM 646 NZ LYS A 361 25.378 -24.495 -16.137 1.00 22.73 N ATOM 647 HZ1 LYS A 361 25.199 -25.196 -16.884 1.00 0.00 H ATOM 648 HZ2 LYS A 361 24.696 -23.714 -16.221 1.00 0.00 H ATOM 649 HZ3 LYS A 361 26.345 -24.124 -16.232 1.00 0.00 H ATOM 650 H LYS A 361 20.139 -29.560 -15.439 1.00 0.00 H ATOM 651 N ASP A 362 23.394 -29.765 -17.420 1.00 20.23 N ATOM 652 CA ASP A 362 24.184 -30.983 -17.652 1.00 23.55 C ATOM 653 C ASP A 362 23.384 -32.262 -17.375 1.00 24.75 C ATOM 654 O ASP A 362 23.874 -33.166 -16.695 1.00 24.36 O ATOM 655 CB ASP A 362 25.471 -31.024 -16.815 1.00 50.61 C ATOM 656 CG ASP A 362 25.249 -30.694 -15.363 1.00 61.29 C ATOM 657 OD1 ASP A 362 25.171 -29.496 -15.006 1.00 84.47 O ATOM 658 OD2 ASP A 362 25.087 -31.655 -14.579 1.00 94.49 O ATOM 659 H ASP A 362 23.515 -28.977 -18.087 1.00 0.00 H ATOM 660 N ASN A 363 22.155 -32.301 -17.893 1.00 23.00 N ATOM 661 CA ASN A 363 21.254 -33.454 -17.781 1.00 26.91 C ATOM 662 C ASN A 363 20.769 -33.767 -16.360 1.00 33.45 C ATOM 663 O ASN A 363 20.359 -34.890 -16.080 1.00 28.00 O ATOM 664 CB ASN A 363 21.913 -34.698 -18.383 1.00 35.04 C ATOM 665 CG ASN A 363 22.176 -34.547 -19.865 1.00 41.52 C ATOM 666 OD1 ASN A 363 21.241 -34.441 -20.659 1.00 44.13 O ATOM 667 ND2 ASN A 363 23.447 -34.522 -20.246 1.00 40.70 N ATOM 668 HD22 ASN A 363 24.204 -34.615 -19.539 1.00 0.00 H ATOM 669 HD21 ASN A 363 23.686 -34.409 -21.252 1.00 0.00 H ATOM 670 H ASN A 363 21.815 -31.463 -18.407 1.00 0.00 H ATOM 671 N LYS A 364 20.806 -32.779 -15.465 1.00 19.54 N ATOM 672 CA LYS A 364 20.184 -32.930 -14.152 1.00 17.08 C ATOM 673 C LYS A 364 19.052 -31.914 -13.995 1.00 13.65 C ATOM 674 O LYS A 364 19.198 -30.751 -14.359 1.00 15.25 O ATOM 675 CB LYS A 364 21.226 -32.769 -13.046 1.00 21.25 C ATOM 676 CG LYS A 364 22.475 -33.593 -13.309 1.00 18.84 C ATOM 677 CD LYS A 364 23.481 -33.495 -12.182 1.00 22.63 C ATOM 678 CE LYS A 364 23.001 -34.178 -10.914 1.00 17.41 C ATOM 679 NZ LYS A 364 22.958 -35.665 -11.063 1.00 19.80 N ATOM 680 HZ1 LYS A 364 22.308 -35.916 -11.835 1.00 0.00 H ATOM 681 HZ2 LYS A 364 23.911 -36.018 -11.283 1.00 0.00 H ATOM 682 HZ3 LYS A 364 22.625 -36.092 -10.175 1.00 0.00 H ATOM 683 H LYS A 364 21.285 -31.888 -15.705 1.00 0.00 H ATOM 684 N VAL A 365 17.913 -32.359 -13.480 1.00 14.53 N ATOM 685 CA VAL A 365 16.760 -31.490 -13.286 1.00 13.72 C ATOM 686 C VAL A 365 17.011 -30.532 -12.128 1.00 12.36 C ATOM 687 O VAL A 365 17.335 -30.965 -11.015 1.00 14.30 O ATOM 688 CB VAL A 365 15.487 -32.311 -13.027 1.00 14.59 C ATOM 689 CG1 VAL A 365 14.330 -31.402 -12.616 1.00 13.81 C ATOM 690 CG2 VAL A 365 15.138 -33.134 -14.258 1.00 15.71 C ATOM 691 H VAL A 365 17.841 -33.360 -13.206 1.00 0.00 H ATOM 692 N ILE A 366 16.887 -29.229 -12.385 1.00 12.14 N ATOM 693 CA ILE A 366 17.185 -28.249 -11.348 1.00 12.41 C ATOM 694 C ILE A 366 15.983 -27.415 -10.921 1.00 12.09 C ATOM 695 O ILE A 366 16.039 -26.791 -9.867 1.00 13.57 O ATOM 696 CB ILE A 366 18.348 -27.289 -11.768 1.00 14.15 C ATOM 697 CG1 ILE A 366 17.959 -26.378 -12.938 1.00 13.52 C ATOM 698 CG2 ILE A 366 19.612 -28.093 -12.071 1.00 15.10 C ATOM 699 CD1 ILE A 366 19.078 -25.429 -13.368 1.00 13.77 C ATOM 700 H ILE A 366 16.577 -28.912 -13.326 1.00 0.00 H ATOM 701 N LYS A 367 14.901 -27.402 -11.696 1.00 12.37 N ATOM 702 CA LYS A 367 13.731 -26.618 -11.326 1.00 13.53 C ATOM 703 C LYS A 367 12.506 -27.019 -12.134 1.00 13.10 C ATOM 704 O LYS A 367 12.590 -27.188 -13.337 1.00 12.09 O ATOM 705 CB LYS A 367 14.006 -25.126 -11.531 1.00 13.89 C ATOM 706 CG LYS A 367 12.810 -24.229 -11.300 1.00 16.36 C ATOM 707 CD LYS A 367 12.415 -24.171 -9.832 1.00 16.16 C ATOM 708 CE LYS A 367 11.316 -23.135 -9.630 1.00 16.73 C ATOM 709 NZ LYS A 367 10.754 -23.145 -8.259 1.00 16.59 N ATOM 710 HZ1 LYS A 367 10.347 -24.081 -8.059 1.00 0.00 H ATOM 711 HZ2 LYS A 367 11.510 -22.941 -7.574 1.00 0.00 H ATOM 712 HZ3 LYS A 367 10.012 -22.420 -8.184 1.00 0.00 H ATOM 713 H LYS A 367 14.891 -27.958 -12.575 1.00 0.00 H ATOM 714 N THR A 368 11.372 -27.171 -11.469 1.00 13.12 N ATOM 715 CA THR A 368 10.098 -27.313 -12.165 1.00 13.43 C ATOM 716 C THR A 368 9.395 -25.947 -12.141 1.00 12.60 C ATOM 717 O THR A 368 9.450 -25.230 -11.137 1.00 15.97 O ATOM 718 CB THR A 368 9.216 -28.395 -11.520 1.00 14.66 C ATOM 719 OG1 THR A 368 9.131 -28.158 -10.111 1.00 16.69 O ATOM 720 CG2 THR A 368 9.802 -29.795 -11.742 1.00 16.91 C ATOM 721 HG1 THR A 368 8.733 -27.266 -9.951 1.00 0.00 H ATOM 722 H THR A 368 11.390 -27.190 -10.429 1.00 0.00 H ATOM 723 N TYR A 369 8.760 -25.568 -13.246 1.00 11.49 N ATOM 724 CA TYR A 369 8.095 -24.274 -13.380 1.00 11.32 C ATOM 725 C TYR A 369 6.616 -24.387 -13.671 1.00 11.50 C ATOM 726 O TYR A 369 6.176 -25.281 -14.401 1.00 12.31 O ATOM 727 CB TYR A 369 8.696 -23.469 -14.512 1.00 12.93 C ATOM 728 CG TYR A 369 10.080 -22.939 -14.299 1.00 11.11 C ATOM 729 CD1 TYR A 369 10.348 -22.006 -13.301 1.00 12.17 C ATOM 730 CD2 TYR A 369 11.112 -23.303 -15.147 1.00 12.33 C ATOM 731 CE1 TYR A 369 11.620 -21.473 -13.144 1.00 12.67 C ATOM 732 CE2 TYR A 369 12.376 -22.786 -14.997 1.00 11.16 C ATOM 733 CZ TYR A 369 12.624 -21.873 -13.997 1.00 11.79 C ATOM 734 OH TYR A 369 13.894 -21.361 -13.877 1.00 13.38 O ATOM 735 HH TYR A 369 13.921 -20.723 -13.121 1.00 0.00 H ATOM 736 H TYR A 369 8.736 -26.224 -14.053 1.00 0.00 H ATOM 737 N THR A 370 5.864 -23.452 -13.104 1.00 12.47 N ATOM 738 CA THR A 370 4.424 -23.359 -13.321 1.00 14.28 C ATOM 739 C THR A 370 4.013 -21.897 -13.514 1.00 12.28 C ATOM 740 O THR A 370 4.851 -20.989 -13.483 1.00 12.43 O ATOM 741 CB THR A 370 3.619 -23.977 -12.144 1.00 19.16 C ATOM 742 OG1 THR A 370 3.943 -23.304 -10.920 1.00 23.86 O ATOM 743 CG2 THR A 370 3.915 -25.463 -11.999 1.00 21.28 C ATOM 744 HG1 THR A 370 4.911 -23.400 -10.738 1.00 0.00 H ATOM 745 H THR A 370 6.320 -22.757 -12.479 1.00 0.00 H ATOM 746 N LYS A 371 2.719 -21.673 -13.713 1.00 15.28 N ATOM 747 CA LYS A 371 2.190 -20.328 -13.919 1.00 16.36 C ATOM 748 C LYS A 371 2.714 -19.324 -12.889 1.00 13.85 C ATOM 749 O LYS A 371 2.663 -19.560 -11.677 1.00 15.53 O ATOM 750 CB LYS A 371 0.660 -20.363 -13.888 1.00 21.94 C ATOM 751 CG LYS A 371 -0.020 -19.018 -14.105 1.00 43.92 C ATOM 752 CD LYS A 371 -1.518 -19.113 -13.828 1.00 45.44 C ATOM 753 CE LYS A 371 -2.197 -20.141 -14.724 1.00 56.65 C ATOM 754 NZ LYS A 371 -2.583 -19.580 -16.049 1.00 48.55 N ATOM 755 HZ1 LYS A 371 -3.245 -18.790 -15.910 1.00 0.00 H ATOM 756 HZ2 LYS A 371 -1.732 -19.239 -16.541 1.00 0.00 H ATOM 757 HZ3 LYS A 371 -3.040 -20.321 -16.618 1.00 0.00 H ATOM 758 H LYS A 371 2.063 -22.480 -13.722 1.00 0.00 H ATOM 759 N GLY A 372 3.216 -18.202 -13.387 1.00 14.07 N ATOM 760 CA GLY A 372 3.719 -17.132 -12.552 1.00 14.86 C ATOM 761 C GLY A 372 5.219 -17.106 -12.368 1.00 14.50 C ATOM 762 O GLY A 372 5.767 -16.097 -11.906 1.00 18.09 O ATOM 763 H GLY A 372 3.250 -18.086 -14.420 1.00 0.00 H ATOM 764 N ASP A 373 5.890 -18.201 -12.698 1.00 12.27 N ATOM 765 CA ASP A 373 7.339 -18.286 -12.587 1.00 15.61 C ATOM 766 C ASP A 373 8.010 -17.473 -13.683 1.00 10.66 C ATOM 767 O ASP A 373 7.407 -17.196 -14.732 1.00 13.00 O ATOM 768 CB ASP A 373 7.812 -19.739 -12.671 1.00 13.18 C ATOM 769 CG ASP A 373 7.691 -20.485 -11.348 1.00 14.76 C ATOM 770 OD1 ASP A 373 7.226 -21.648 -11.352 1.00 15.58 O ATOM 771 OD2 ASP A 373 8.090 -19.922 -10.307 1.00 16.37 O ATOM 772 H ASP A 373 5.363 -19.027 -13.048 1.00 0.00 H ATOM 773 N TYR A 374 9.263 -17.106 -13.441 1.00 10.91 N ATOM 774 CA TYR A 374 10.062 -16.388 -14.432 1.00 10.80 C ATOM 775 C TYR A 374 11.374 -17.103 -14.675 1.00 10.17 C ATOM 776 O TYR A 374 11.852 -17.851 -13.831 1.00 11.12 O ATOM 777 CB TYR A 374 10.334 -14.939 -13.988 1.00 11.72 C ATOM 778 CG TYR A 374 11.346 -14.829 -12.872 1.00 11.53 C ATOM 779 CD1 TYR A 374 12.689 -14.581 -13.139 1.00 12.75 C ATOM 780 CD2 TYR A 374 10.955 -14.968 -11.554 1.00 12.82 C ATOM 781 CE1 TYR A 374 13.617 -14.492 -12.110 1.00 13.53 C ATOM 782 CE2 TYR A 374 11.872 -14.882 -10.520 1.00 14.31 C ATOM 783 CZ TYR A 374 13.194 -14.636 -10.807 1.00 14.04 C ATOM 784 OH TYR A 374 14.092 -14.551 -9.770 1.00 14.79 O ATOM 785 HH TYR A 374 14.996 -14.372 -10.132 1.00 0.00 H ATOM 786 H TYR A 374 9.688 -17.336 -12.520 1.00 0.00 H ATOM 787 N PHE A 375 11.971 -16.861 -15.833 1.00 10.31 N ATOM 788 CA PHE A 375 13.258 -17.446 -16.136 1.00 10.11 C ATOM 789 C PHE A 375 13.882 -16.706 -17.306 1.00 10.69 C ATOM 790 O PHE A 375 13.216 -15.950 -18.015 1.00 11.15 O ATOM 791 CB PHE A 375 13.158 -18.969 -16.414 1.00 11.37 C ATOM 792 CG PHE A 375 12.029 -19.373 -17.312 1.00 10.82 C ATOM 793 CD1 PHE A 375 10.886 -19.968 -16.788 1.00 12.92 C ATOM 794 CD2 PHE A 375 12.128 -19.220 -18.682 1.00 12.33 C ATOM 795 CE1 PHE A 375 9.857 -20.373 -17.609 1.00 14.41 C ATOM 796 CE2 PHE A 375 11.089 -19.618 -19.510 1.00 14.12 C ATOM 797 CZ PHE A 375 9.957 -20.189 -18.964 1.00 14.97 C ATOM 798 H PHE A 375 11.509 -16.244 -16.531 1.00 0.00 H ATOM 799 N GLY A 376 15.172 -16.939 -17.510 1.00 10.98 N ATOM 800 CA GLY A 376 15.904 -16.312 -18.591 1.00 11.33 C ATOM 801 C GLY A 376 16.528 -14.975 -18.244 1.00 12.74 C ATOM 802 O GLY A 376 16.998 -14.266 -19.130 1.00 13.15 O ATOM 803 H GLY A 376 15.673 -17.592 -16.874 1.00 0.00 H ATOM 804 N GLU A 377 16.519 -14.611 -16.961 1.00 11.87 N ATOM 805 CA GLU A 377 17.103 -13.352 -16.504 1.00 12.63 C ATOM 806 C GLU A 377 18.630 -13.423 -16.364 1.00 12.99 C ATOM 807 O GLU A 377 19.314 -12.409 -16.489 1.00 14.80 O ATOM 808 CB GLU A 377 16.485 -12.928 -15.163 1.00 12.97 C ATOM 809 CG GLU A 377 17.139 -13.519 -13.886 1.00 14.02 C ATOM 810 CD GLU A 377 16.838 -15.006 -13.624 1.00 14.09 C ATOM 811 OE1 GLU A 377 16.299 -15.712 -14.509 1.00 12.37 O ATOM 812 OE2 GLU A 377 17.159 -15.456 -12.499 1.00 13.41 O ATOM 813 H GLU A 377 16.081 -15.245 -16.262 1.00 0.00 H ATOM 814 N LEU A 378 19.164 -14.617 -16.117 1.00 13.02 N ATOM 815 CA LEU A 378 20.577 -14.732 -15.740 1.00 14.35 C ATOM 816 C LEU A 378 21.536 -14.324 -16.861 1.00 12.85 C ATOM 817 O LEU A 378 22.502 -13.617 -16.610 1.00 15.21 O ATOM 818 CB LEU A 378 20.896 -16.153 -15.261 1.00 14.09 C ATOM 819 CG LEU A 378 22.272 -16.357 -14.623 1.00 14.09 C ATOM 820 CD1 LEU A 378 22.459 -15.519 -13.372 1.00 17.79 C ATOM 821 CD2 LEU A 378 22.506 -17.822 -14.311 1.00 16.09 C ATOM 822 H LEU A 378 18.577 -15.472 -16.192 1.00 0.00 H ATOM 823 N ALA A 379 21.246 -14.746 -18.089 1.00 12.83 N ATOM 824 CA ALA A 379 22.091 -14.385 -19.222 1.00 14.20 C ATOM 825 C ALA A 379 22.119 -12.879 -19.425 1.00 16.14 C ATOM 826 O ALA A 379 23.121 -12.328 -19.853 1.00 18.19 O ATOM 827 CB ALA A 379 21.601 -15.077 -20.490 1.00 15.99 C ATOM 828 H ALA A 379 20.407 -15.340 -18.243 1.00 0.00 H ATOM 829 N LEU A 380 20.991 -12.232 -19.143 1.00 15.49 N ATOM 830 CA LEU A 380 20.844 -10.788 -19.305 1.00 17.24 C ATOM 831 C LEU A 380 21.611 -10.030 -18.231 1.00 16.86 C ATOM 832 O LEU A 380 22.220 -9.007 -18.504 1.00 21.68 O ATOM 833 CB LEU A 380 19.364 -10.393 -19.262 1.00 17.45 C ATOM 834 CG LEU A 380 18.434 -11.240 -20.127 1.00 20.28 C ATOM 835 CD1 LEU A 380 16.989 -10.768 -20.041 1.00 21.25 C ATOM 836 CD2 LEU A 380 18.913 -11.259 -21.565 1.00 22.38 C ATOM 837 H LEU A 380 20.179 -12.778 -18.792 1.00 0.00 H ATOM 838 N LEU A 381 21.575 -10.534 -17.005 1.00 17.23 N ATOM 839 CA LEU A 381 22.270 -9.886 -15.907 1.00 18.21 C ATOM 840 C LEU A 381 23.777 -10.121 -15.928 1.00 19.87 C ATOM 841 O LEU A 381 24.537 -9.278 -15.463 1.00 23.34 O ATOM 842 CB LEU A 381 21.710 -10.359 -14.573 1.00 18.39 C ATOM 843 CG LEU A 381 20.243 -10.030 -14.290 1.00 17.80 C ATOM 844 CD1 LEU A 381 19.782 -10.761 -13.044 1.00 18.53 C ATOM 845 CD2 LEU A 381 20.066 -8.529 -14.127 1.00 21.36 C ATOM 846 H LEU A 381 21.040 -11.408 -16.827 1.00 0.00 H ATOM 847 N LYS A 382 24.207 -11.265 -16.454 1.00 20.45 N ATOM 848 CA LYS A 382 25.627 -11.624 -16.404 1.00 20.66 C ATOM 849 C LYS A 382 26.359 -11.487 -17.733 1.00 23.61 C ATOM 850 O LYS A 382 27.586 -11.569 -17.770 1.00 23.01 O ATOM 851 CB LYS A 382 25.788 -13.062 -15.908 1.00 21.42 C ATOM 852 CG LYS A 382 25.213 -13.340 -14.535 1.00 24.42 C ATOM 853 CD LYS A 382 25.879 -12.511 -13.454 1.00 33.92 C ATOM 854 CE LYS A 382 25.393 -12.934 -12.075 1.00 41.14 C ATOM 855 NZ LYS A 382 25.736 -11.941 -11.024 1.00 55.11 N ATOM 856 HZ1 LYS A 382 26.769 -11.827 -10.980 1.00 0.00 H ATOM 857 HZ2 LYS A 382 25.295 -11.028 -11.254 1.00 0.00 H ATOM 858 HZ3 LYS A 382 25.384 -12.275 -10.105 1.00 0.00 H ATOM 859 H LYS A 382 23.528 -11.911 -16.905 1.00 0.00 H ATOM 860 N ASN A 383 25.615 -11.301 -18.820 1.00 22.52 N ATOM 861 CA ASN A 383 26.220 -11.209 -20.156 1.00 22.49 C ATOM 862 C ASN A 383 27.014 -12.483 -20.454 1.00 24.74 C ATOM 863 O ASN A 383 28.143 -12.444 -20.935 1.00 25.89 O ATOM 864 CB ASN A 383 27.099 -9.961 -20.285 1.00 26.18 C ATOM 865 CG ASN A 383 26.281 -8.697 -20.413 1.00 48.29 C ATOM 866 OD1 ASN A 383 25.607 -8.480 -21.420 1.00 65.91 O ATOM 867 ND2 ASN A 383 26.330 -7.855 -19.388 1.00 63.39 N ATOM 868 HD22 ASN A 383 26.914 -8.080 -18.557 1.00 0.00 H ATOM 869 HD21 ASN A 383 25.785 -6.970 -19.416 1.00 0.00 H ATOM 870 H ASN A 383 24.583 -11.219 -18.722 1.00 0.00 H ATOM 871 N LYS A 384 26.387 -13.616 -20.146 1.00 23.14 N ATOM 872 CA LYS A 384 26.966 -14.944 -20.324 1.00 22.12 C ATOM 873 C LYS A 384 25.962 -15.816 -21.070 1.00 17.69 C ATOM 874 O LYS A 384 24.793 -15.456 -21.169 1.00 19.21 O ATOM 875 CB LYS A 384 27.307 -15.568 -18.969 1.00 29.01 C ATOM 876 CG LYS A 384 28.515 -14.969 -18.278 1.00 28.94 C ATOM 877 CD LYS A 384 28.723 -15.604 -16.914 1.00 36.61 C ATOM 878 CE LYS A 384 30.197 -15.675 -16.557 1.00 50.24 C ATOM 879 NZ LYS A 384 30.406 -16.254 -15.202 1.00 54.55 N ATOM 880 HZ1 LYS A 384 29.925 -15.662 -14.495 1.00 0.00 H ATOM 881 HZ2 LYS A 384 30.014 -17.217 -15.174 1.00 0.00 H ATOM 882 HZ3 LYS A 384 31.424 -16.286 -14.993 1.00 0.00 H ATOM 883 H LYS A 384 25.426 -13.551 -19.755 1.00 0.00 H ATOM 884 N PRO A 385 26.408 -16.965 -21.601 1.00 19.49 N ATOM 885 CA PRO A 385 25.435 -17.846 -22.255 1.00 17.26 C ATOM 886 C PRO A 385 24.370 -18.371 -21.298 1.00 15.42 C ATOM 887 O PRO A 385 24.570 -18.383 -20.079 1.00 16.61 O ATOM 888 CB PRO A 385 26.297 -19.001 -22.771 1.00 19.77 C ATOM 889 CG PRO A 385 27.658 -18.406 -22.935 1.00 23.88 C ATOM 890 CD PRO A 385 27.792 -17.430 -21.800 1.00 22.25 C ATOM 891 N ARG A 386 23.243 -18.799 -21.855 1.00 13.96 N ATOM 892 CA ARG A 386 22.201 -19.475 -21.078 1.00 13.05 C ATOM 893 C ARG A 386 22.805 -20.579 -20.201 1.00 12.88 C ATOM 894 O ARG A 386 23.572 -21.400 -20.682 1.00 14.61 O ATOM 895 CB ARG A 386 21.133 -20.075 -21.998 1.00 13.28 C ATOM 896 CG ARG A 386 20.419 -19.065 -22.881 1.00 13.38 C ATOM 897 CD ARG A 386 19.596 -18.081 -22.057 1.00 12.43 C ATOM 898 NE ARG A 386 18.550 -17.462 -22.865 1.00 13.29 N ATOM 899 CZ ARG A 386 17.772 -16.474 -22.439 1.00 12.93 C ATOM 900 NH1 ARG A 386 17.940 -15.977 -21.221 1.00 12.96 N ATOM 901 NH2 ARG A 386 16.841 -15.967 -23.233 1.00 14.56 N ATOM 902 HE ARG A 386 18.405 -17.816 -23.832 1.00 0.00 H ATOM 903 HH12 ARG A 386 17.331 -15.203 -20.887 1.00 0.00 H ATOM 904 HH11 ARG A 386 18.681 -16.361 -20.600 1.00 0.00 H ATOM 905 HH22 ARG A 386 16.234 -15.193 -22.895 1.00 0.00 H ATOM 906 HH21 ARG A 386 16.717 -16.343 -24.195 1.00 0.00 H ATOM 907 H ARG A 386 23.096 -18.650 -22.874 1.00 0.00 H ATOM 908 N ALA A 387 22.429 -20.597 -18.921 1.00 12.92 N ATOM 909 CA ALA A 387 23.050 -21.476 -17.928 1.00 14.11 C ATOM 910 C ALA A 387 22.349 -22.822 -17.767 1.00 12.87 C ATOM 911 O ALA A 387 22.852 -23.699 -17.068 1.00 14.97 O ATOM 912 CB ALA A 387 23.089 -20.771 -16.588 1.00 16.26 C ATOM 913 H ALA A 387 21.664 -19.961 -18.616 1.00 0.00 H ATOM 914 N ALA A 388 21.188 -22.974 -18.385 1.00 12.31 N ATOM 915 CA ALA A 388 20.371 -24.164 -18.218 1.00 12.84 C ATOM 916 C ALA A 388 19.455 -24.283 -19.419 1.00 12.71 C ATOM 917 O ALA A 388 19.263 -23.318 -20.156 1.00 12.90 O ATOM 918 CB ALA A 388 19.563 -24.092 -16.932 1.00 13.42 C ATOM 919 H ALA A 388 20.849 -22.216 -19.011 1.00 0.00 H ATOM 920 N THR A 389 18.898 -25.474 -19.612 1.00 13.74 N ATOM 921 CA THR A 389 17.922 -25.729 -20.656 1.00 13.01 C ATOM 922 C THR A 389 16.538 -25.759 -20.031 1.00 12.85 C ATOM 923 O THR A 389 16.330 -26.437 -19.008 1.00 14.55 O ATOM 924 CB THR A 389 18.214 -27.050 -21.370 1.00 13.89 C ATOM 925 OG1 THR A 389 19.452 -26.921 -22.077 1.00 16.67 O ATOM 926 CG2 THR A 389 17.102 -27.417 -22.351 1.00 16.55 C ATOM 927 HG1 THR A 389 19.654 -27.770 -22.545 1.00 0.00 H ATOM 928 H THR A 389 19.174 -26.258 -18.987 1.00 0.00 H ATOM 929 N ILE A 390 15.586 -25.062 -20.637 1.00 11.22 N ATOM 930 CA ILE A 390 14.213 -25.063 -20.159 1.00 10.87 C ATOM 931 C ILE A 390 13.327 -25.565 -21.276 1.00 10.44 C ATOM 932 O ILE A 390 13.351 -25.031 -22.397 1.00 11.05 O ATOM 933 CB ILE A 390 13.785 -23.672 -19.670 1.00 10.76 C ATOM 934 CG1 ILE A 390 14.684 -23.276 -18.495 1.00 13.20 C ATOM 935 CG2 ILE A 390 12.321 -23.663 -19.229 1.00 12.50 C ATOM 936 CD1 ILE A 390 14.516 -21.866 -18.001 1.00 13.98 C ATOM 937 H ILE A 390 15.828 -24.499 -21.477 1.00 0.00 H ATOM 938 N LYS A 391 12.561 -26.602 -20.950 1.00 10.51 N ATOM 939 CA LYS A 391 11.720 -27.291 -21.921 1.00 11.72 C ATOM 940 C LYS A 391 10.261 -27.283 -21.504 1.00 11.36 C ATOM 941 O LYS A 391 9.949 -27.484 -20.328 1.00 12.22 O ATOM 942 CB LYS A 391 12.176 -28.741 -22.092 1.00 14.26 C ATOM 943 CG LYS A 391 13.479 -28.928 -22.841 1.00 23.54 C ATOM 944 CD LYS A 391 13.781 -30.408 -23.037 1.00 24.33 C ATOM 945 CE LYS A 391 12.601 -31.139 -23.667 1.00 37.44 C ATOM 946 NZ LYS A 391 12.946 -32.545 -24.026 1.00 53.80 N ATOM 947 HZ1 LYS A 391 13.732 -32.545 -24.708 1.00 0.00 H ATOM 948 HZ2 LYS A 391 13.230 -33.061 -23.169 1.00 0.00 H ATOM 949 HZ3 LYS A 391 12.117 -33.006 -24.451 1.00 0.00 H ATOM 950 H LYS A 391 12.562 -26.934 -19.964 1.00 0.00 H ATOM 951 N ALA A 392 9.368 -27.054 -22.461 1.00 10.74 N ATOM 952 CA ALA A 392 7.933 -27.159 -22.219 1.00 10.81 C ATOM 953 C ALA A 392 7.532 -28.615 -21.990 1.00 9.99 C ATOM 954 O ALA A 392 7.975 -29.500 -22.724 1.00 12.17 O ATOM 955 CB ALA A 392 7.175 -26.590 -23.398 1.00 11.62 C ATOM 956 H ALA A 392 9.702 -26.792 -23.411 1.00 0.00 H ATOM 957 N GLN A 393 6.672 -28.868 -21.002 1.00 10.80 N ATOM 958 CA GLN A 393 6.184 -30.233 -20.761 1.00 12.17 C ATOM 959 C GLN A 393 4.719 -30.403 -21.141 1.00 11.40 C ATOM 960 O GLN A 393 4.113 -31.451 -20.884 1.00 13.36 O ATOM 961 CB GLN A 393 6.379 -30.636 -19.301 1.00 13.39 C ATOM 962 CG GLN A 393 7.855 -30.696 -18.865 1.00 14.74 C ATOM 963 CD GLN A 393 8.107 -31.739 -17.755 1.00 15.55 C ATOM 964 OE1 GLN A 393 8.811 -32.737 -17.952 1.00 18.70 O ATOM 965 NE2 GLN A 393 7.535 -31.500 -16.595 1.00 17.23 N ATOM 966 HE22 GLN A 393 6.950 -30.649 -16.469 1.00 0.00 H ATOM 967 HE21 GLN A 393 7.668 -32.162 -15.804 1.00 0.00 H ATOM 968 H GLN A 393 6.343 -28.090 -20.395 1.00 0.00 H ATOM 969 N ASN A 394 4.154 -29.354 -21.724 1.00 10.79 N ATOM 970 CA ASN A 394 2.795 -29.338 -22.247 1.00 12.77 C ATOM 971 C ASN A 394 2.706 -28.048 -23.046 1.00 10.86 C ATOM 972 O ASN A 394 3.729 -27.411 -23.290 1.00 11.73 O ATOM 973 CB ASN A 394 1.733 -29.412 -21.133 1.00 12.93 C ATOM 974 CG ASN A 394 1.869 -28.308 -20.097 1.00 12.08 C ATOM 975 OD1 ASN A 394 2.577 -27.323 -20.292 1.00 12.55 O ATOM 976 ND2 ASN A 394 1.167 -28.476 -18.978 1.00 13.77 N ATOM 977 HD22 ASN A 394 0.580 -29.326 -18.855 1.00 0.00 H ATOM 978 HD21 ASN A 394 1.205 -27.757 -18.227 1.00 0.00 H ATOM 979 H ASN A 394 4.719 -28.485 -21.814 1.00 0.00 H ATOM 980 N PHE A 395 1.512 -27.642 -23.442 1.00 11.04 N ATOM 981 CA PHE A 395 1.369 -26.390 -24.168 1.00 12.05 C ATOM 982 C PHE A 395 1.593 -25.221 -23.216 1.00 11.65 C ATOM 983 O PHE A 395 0.832 -25.033 -22.260 1.00 14.20 O ATOM 984 CB PHE A 395 -0.001 -26.309 -24.814 1.00 14.57 C ATOM 985 CG PHE A 395 -0.108 -25.226 -25.852 1.00 16.27 C ATOM 986 CD1 PHE A 395 0.483 -25.389 -27.102 1.00 16.87 C ATOM 987 CD2 PHE A 395 -0.776 -24.050 -25.578 1.00 18.77 C ATOM 988 CE1 PHE A 395 0.388 -24.401 -28.066 1.00 21.43 C ATOM 989 CE2 PHE A 395 -0.877 -23.046 -26.543 1.00 21.22 C ATOM 990 CZ PHE A 395 -0.288 -23.231 -27.783 1.00 19.53 C ATOM 991 H PHE A 395 0.673 -28.220 -23.234 1.00 0.00 H ATOM 992 N CYS A 396 2.647 -24.457 -23.462 1.00 11.16 N ATOM 993 CA CYS A 396 3.070 -23.371 -22.581 1.00 11.16 C ATOM 994 C CYS A 396 2.862 -22.026 -23.242 1.00 12.11 C ATOM 995 O CYS A 396 3.201 -21.847 -24.411 1.00 13.46 O ATOM 996 CB CYS A 396 4.552 -23.504 -22.227 1.00 12.47 C ATOM 997 SG CYS A 396 4.936 -24.779 -21.041 1.00 11.74 S ATOM 998 H CYS A 396 3.200 -24.639 -24.324 1.00 0.00 H ATOM 999 N GLN A 397 2.347 -21.066 -22.488 1.00 10.98 N ATOM 1000 CA GLN A 397 2.230 -19.682 -22.945 1.00 11.55 C ATOM 1001 C GLN A 397 3.136 -18.807 -22.095 1.00 11.58 C ATOM 1002 O GLN A 397 3.143 -18.923 -20.869 1.00 11.39 O ATOM 1003 CB GLN A 397 0.780 -19.201 -22.864 1.00 13.45 C ATOM 1004 CG GLN A 397 -0.166 -20.050 -23.679 1.00 15.80 C ATOM 1005 CD GLN A 397 -1.612 -19.675 -23.466 1.00 39.47 C ATOM 1006 OE1 GLN A 397 -2.026 -18.557 -23.762 1.00 30.22 O ATOM 1007 NE2 GLN A 397 -2.391 -20.611 -22.945 1.00 33.43 N ATOM 1008 HE22 GLN A 397 -1.997 -21.544 -22.710 1.00 0.00 H ATOM 1009 HE21 GLN A 397 -3.397 -20.413 -22.771 1.00 0.00 H ATOM 1010 H GLN A 397 2.013 -21.306 -21.533 1.00 0.00 H ATOM 1011 N VAL A 398 3.914 -17.958 -22.746 1.00 11.07 N ATOM 1012 CA VAL A 398 4.791 -17.038 -22.041 1.00 11.20 C ATOM 1013 C VAL A 398 4.538 -15.621 -22.481 1.00 11.71 C ATOM 1014 O VAL A 398 3.992 -15.377 -23.552 1.00 11.84 O ATOM 1015 CB VAL A 398 6.294 -17.354 -22.270 1.00 10.24 C ATOM 1016 CG1 VAL A 398 6.621 -18.761 -21.835 1.00 12.06 C ATOM 1017 CG2 VAL A 398 6.684 -17.149 -23.748 1.00 13.96 C ATOM 1018 H VAL A 398 3.898 -17.949 -23.786 1.00 0.00 H ATOM 1019 N VAL A 399 4.933 -14.691 -21.627 1.00 10.91 N ATOM 1020 CA VAL A 399 5.126 -13.305 -22.049 1.00 11.82 C ATOM 1021 C VAL A 399 6.600 -12.994 -21.893 1.00 11.36 C ATOM 1022 O VAL A 399 7.282 -13.619 -21.071 1.00 12.99 O ATOM 1023 CB VAL A 399 4.265 -12.309 -21.256 1.00 12.89 C ATOM 1024 CG1 VAL A 399 2.796 -12.573 -21.528 1.00 14.96 C ATOM 1025 CG2 VAL A 399 4.576 -12.348 -19.759 1.00 14.28 C ATOM 1026 H VAL A 399 5.110 -14.951 -20.636 1.00 0.00 H ATOM 1027 N TYR A 400 7.116 -12.066 -22.684 1.00 11.43 N ATOM 1028 CA TYR A 400 8.544 -11.864 -22.689 1.00 12.89 C ATOM 1029 C TYR A 400 8.947 -10.422 -22.994 1.00 12.34 C ATOM 1030 O TYR A 400 8.180 -9.629 -23.564 1.00 13.18 O ATOM 1031 CB TYR A 400 9.214 -12.835 -23.683 1.00 13.27 C ATOM 1032 CG TYR A 400 8.851 -12.633 -25.137 1.00 15.24 C ATOM 1033 CD1 TYR A 400 9.645 -11.859 -25.957 1.00 15.28 C ATOM 1034 CD2 TYR A 400 7.726 -13.239 -25.690 1.00 14.51 C ATOM 1035 CE1 TYR A 400 9.330 -11.678 -27.289 1.00 19.54 C ATOM 1036 CE2 TYR A 400 7.396 -13.065 -27.016 1.00 16.48 C ATOM 1037 CZ TYR A 400 8.202 -12.283 -27.813 1.00 16.16 C ATOM 1038 OH TYR A 400 7.884 -12.102 -29.144 1.00 23.03 O ATOM 1039 HH TYR A 400 6.992 -11.679 -29.214 1.00 0.00 H ATOM 1040 H TYR A 400 6.500 -11.491 -23.293 1.00 0.00 H ATOM 1041 N LEU A 401 10.173 -10.112 -22.586 1.00 13.20 N ATOM 1042 CA LEU A 401 10.845 -8.842 -22.836 1.00 13.58 C ATOM 1043 C LEU A 401 12.218 -9.080 -23.433 1.00 14.07 C ATOM 1044 O LEU A 401 12.893 -10.047 -23.058 1.00 14.89 O ATOM 1045 CB LEU A 401 11.020 -8.051 -21.545 1.00 13.24 C ATOM 1046 CG LEU A 401 9.765 -7.641 -20.806 1.00 12.72 C ATOM 1047 CD1 LEU A 401 10.158 -7.079 -19.446 1.00 15.46 C ATOM 1048 CD2 LEU A 401 8.990 -6.625 -21.613 1.00 15.08 C ATOM 1049 H LEU A 401 10.694 -10.832 -22.046 1.00 0.00 H ATOM 1050 N ASP A 402 12.662 -8.180 -24.309 1.00 15.26 N ATOM 1051 CA ASP A 402 14.033 -8.255 -24.791 1.00 15.70 C ATOM 1052 C ASP A 402 14.989 -7.646 -23.761 1.00 16.66 C ATOM 1053 O ASP A 402 14.564 -7.114 -22.737 1.00 15.87 O ATOM 1054 CB ASP A 402 14.193 -7.589 -26.173 1.00 19.68 C ATOM 1055 CG ASP A 402 13.901 -6.094 -26.177 1.00 31.87 C ATOM 1056 OD1 ASP A 402 13.978 -5.425 -25.134 1.00 23.81 O ATOM 1057 OD2 ASP A 402 13.651 -5.563 -27.283 1.00 61.58 O ATOM 1058 H ASP A 402 12.031 -7.426 -24.647 1.00 0.00 H ATOM 1059 N ARG A 403 16.282 -7.731 -24.045 1.00 17.85 N ATOM 1060 CA ARG A 403 17.321 -7.390 -23.077 1.00 19.67 C ATOM 1061 C ARG A 403 17.242 -5.953 -22.564 1.00 19.93 C ATOM 1062 O ARG A 403 17.283 -5.705 -21.356 1.00 18.44 O ATOM 1063 CB ARG A 403 18.692 -7.650 -23.706 1.00 20.96 C ATOM 1064 CG ARG A 403 19.870 -7.098 -22.931 1.00 28.17 C ATOM 1065 CD ARG A 403 21.158 -7.379 -23.686 1.00 32.77 C ATOM 1066 NE ARG A 403 21.383 -8.816 -23.812 1.00 47.74 N ATOM 1067 CZ ARG A 403 22.024 -9.544 -22.907 1.00 20.74 C ATOM 1068 NH1 ARG A 403 22.508 -8.963 -21.817 1.00 48.13 N ATOM 1069 NH2 ARG A 403 22.187 -10.849 -23.089 1.00 40.24 N ATOM 1070 HE ARG A 403 21.020 -9.296 -24.660 1.00 0.00 H ATOM 1071 HH12 ARG A 403 23.011 -9.530 -21.105 1.00 0.00 H ATOM 1072 HH11 ARG A 403 22.384 -7.940 -21.674 1.00 0.00 H ATOM 1073 HH22 ARG A 403 22.690 -11.415 -22.376 1.00 0.00 H ATOM 1074 HH21 ARG A 403 21.811 -11.306 -23.945 1.00 0.00 H ATOM 1075 H ARG A 403 16.566 -8.052 -24.992 1.00 0.00 H ATOM 1076 N LYS A 404 17.129 -5.013 -23.488 1.00 19.98 N ATOM 1077 CA LYS A 404 17.091 -3.607 -23.131 1.00 19.51 C ATOM 1078 C LYS A 404 15.843 -3.269 -22.320 1.00 18.15 C ATOM 1079 O LYS A 404 15.907 -2.533 -21.333 1.00 18.35 O ATOM 1080 CB LYS A 404 17.148 -2.749 -24.391 1.00 23.84 C ATOM 1081 CG LYS A 404 17.555 -1.309 -24.146 1.00 52.81 C ATOM 1082 CD LYS A 404 17.616 -0.535 -25.453 1.00 41.34 C ATOM 1083 CE LYS A 404 18.496 -1.246 -26.469 1.00 41.58 C ATOM 1084 NZ LYS A 404 19.934 -0.881 -26.330 1.00 50.26 N ATOM 1085 HZ1 LYS A 404 20.045 0.144 -26.469 1.00 0.00 H ATOM 1086 HZ2 LYS A 404 20.266 -1.141 -25.379 1.00 0.00 H ATOM 1087 HZ3 LYS A 404 20.491 -1.392 -27.045 1.00 0.00 H ATOM 1088 H LYS A 404 17.066 -5.287 -24.489 1.00 0.00 H ATOM 1089 N SER A 405 14.709 -3.817 -22.737 1.00 18.94 N ATOM 1090 CA SER A 405 13.456 -3.559 -22.047 1.00 15.77 C ATOM 1091 C SER A 405 13.470 -4.185 -20.657 1.00 16.05 C ATOM 1092 O SER A 405 12.972 -3.588 -19.707 1.00 15.82 O ATOM 1093 CB SER A 405 12.271 -4.097 -22.843 1.00 17.48 C ATOM 1094 OG SER A 405 12.194 -3.466 -24.103 1.00 23.82 O ATOM 1095 HG SER A 405 13.027 -3.639 -24.609 1.00 0.00 H ATOM 1096 H SER A 405 14.717 -4.440 -23.570 1.00 0.00 H ATOM 1097 N PHE A 406 14.028 -5.387 -20.541 1.00 13.35 N ATOM 1098 CA PHE A 406 14.180 -6.041 -19.246 1.00 14.55 C ATOM 1099 C PHE A 406 14.967 -5.153 -18.289 1.00 13.34 C ATOM 1100 O PHE A 406 14.534 -4.881 -17.175 1.00 14.24 O ATOM 1101 CB PHE A 406 14.866 -7.404 -19.412 1.00 14.59 C ATOM 1102 CG PHE A 406 15.475 -7.943 -18.146 1.00 12.53 C ATOM 1103 CD1 PHE A 406 14.693 -8.593 -17.200 1.00 13.83 C ATOM 1104 CD2 PHE A 406 16.839 -7.824 -17.920 1.00 14.62 C ATOM 1105 CE1 PHE A 406 15.262 -9.095 -16.042 1.00 13.66 C ATOM 1106 CE2 PHE A 406 17.414 -8.333 -16.765 1.00 15.97 C ATOM 1107 CZ PHE A 406 16.623 -8.976 -15.831 1.00 15.05 C ATOM 1108 H PHE A 406 14.365 -5.873 -21.396 1.00 0.00 H ATOM 1109 N LYS A 407 16.114 -4.666 -18.731 1.00 14.99 N ATOM 1110 CA LYS A 407 16.929 -3.861 -17.830 1.00 16.42 C ATOM 1111 C LYS A 407 16.224 -2.571 -17.431 1.00 15.78 C ATOM 1112 O LYS A 407 16.261 -2.160 -16.268 1.00 19.79 O ATOM 1113 CB LYS A 407 18.293 -3.571 -18.452 1.00 21.65 C ATOM 1114 CG LYS A 407 19.206 -4.788 -18.400 1.00 21.91 C ATOM 1115 CD LYS A 407 20.582 -4.496 -18.956 1.00 32.46 C ATOM 1116 CE LYS A 407 21.565 -5.570 -18.520 1.00 48.17 C ATOM 1117 NZ LYS A 407 21.005 -6.937 -18.691 1.00 58.70 N ATOM 1118 HZ1 LYS A 407 20.143 -7.031 -18.117 1.00 0.00 H ATOM 1119 HZ2 LYS A 407 20.775 -7.093 -19.693 1.00 0.00 H ATOM 1120 HZ3 LYS A 407 21.707 -7.639 -18.382 1.00 0.00 H ATOM 1121 H LYS A 407 16.429 -4.854 -19.704 1.00 0.00 H ATOM 1122 N ARG A 408 15.555 -1.928 -18.378 1.00 15.33 N ATOM 1123 CA ARG A 408 14.848 -0.694 -18.054 1.00 15.99 C ATOM 1124 C ARG A 408 13.629 -0.917 -17.152 1.00 14.98 C ATOM 1125 O ARG A 408 13.423 -0.194 -16.169 1.00 18.17 O ATOM 1126 CB ARG A 408 14.403 0.015 -19.328 1.00 18.12 C ATOM 1127 CG ARG A 408 13.801 1.372 -19.051 1.00 21.33 C ATOM 1128 CD ARG A 408 13.417 2.088 -20.332 1.00 25.11 C ATOM 1129 NE ARG A 408 12.053 1.784 -20.747 1.00 34.49 N ATOM 1130 CZ ARG A 408 11.735 0.938 -21.719 1.00 27.61 C ATOM 1131 NH1 ARG A 408 10.461 0.733 -22.026 1.00 54.44 N ATOM 1132 NH2 ARG A 408 12.687 0.305 -22.388 1.00 40.37 N ATOM 1133 HE ARG A 408 11.276 2.263 -20.248 1.00 0.00 H ATOM 1134 HH12 ARG A 408 10.210 0.071 -22.787 1.00 0.00 H ATOM 1135 HH11 ARG A 408 9.713 1.235 -21.505 1.00 0.00 H ATOM 1136 HH22 ARG A 408 12.435 -0.357 -23.149 1.00 0.00 H ATOM 1137 HH21 ARG A 408 13.686 0.470 -22.152 1.00 0.00 H ATOM 1138 H ARG A 408 15.534 -2.302 -19.348 1.00 0.00 H ATOM 1139 N LEU A 409 12.798 -1.882 -17.517 1.00 14.55 N ATOM 1140 CA LEU A 409 11.499 -2.049 -16.868 1.00 14.50 C ATOM 1141 C LEU A 409 11.550 -2.823 -15.557 1.00 14.21 C ATOM 1142 O LEU A 409 10.698 -2.612 -14.694 1.00 15.63 O ATOM 1143 CB LEU A 409 10.522 -2.729 -17.823 1.00 14.67 C ATOM 1144 CG LEU A 409 10.159 -1.901 -19.056 1.00 15.88 C ATOM 1145 CD1 LEU A 409 9.444 -2.800 -20.032 1.00 18.16 C ATOM 1146 CD2 LEU A 409 9.305 -0.681 -18.709 1.00 19.93 C ATOM 1147 H LEU A 409 13.075 -2.533 -18.279 1.00 0.00 H ATOM 1148 N LEU A 410 12.527 -3.707 -15.395 1.00 13.25 N ATOM 1149 CA LEU A 410 12.639 -4.437 -14.134 1.00 13.05 C ATOM 1150 C LEU A 410 13.743 -3.853 -13.270 1.00 14.13 C ATOM 1151 O LEU A 410 14.074 -4.397 -12.216 1.00 14.85 O ATOM 1152 CB LEU A 410 12.863 -5.937 -14.369 1.00 14.14 C ATOM 1153 CG LEU A 410 11.548 -6.732 -14.427 1.00 15.22 C ATOM 1154 CD1 LEU A 410 10.654 -6.289 -15.586 1.00 16.78 C ATOM 1155 CD2 LEU A 410 11.781 -8.236 -14.489 1.00 15.89 C ATOM 1156 H LEU A 410 13.209 -3.879 -16.161 1.00 0.00 H ATOM 1157 N GLY A 411 14.282 -2.712 -13.694 1.00 17.38 N ATOM 1158 CA GLY A 411 15.128 -1.887 -12.842 1.00 22.70 C ATOM 1159 C GLY A 411 14.664 -1.726 -11.400 1.00 18.44 C ATOM 1160 O GLY A 411 15.484 -1.852 -10.478 1.00 20.87 O ATOM 1161 H GLY A 411 14.093 -2.399 -14.667 1.00 0.00 H ATOM 1162 N PRO A 412 13.360 -1.457 -11.178 1.00 21.68 N ATOM 1163 CA PRO A 412 12.886 -1.272 -9.802 1.00 20.32 C ATOM 1164 C PRO A 412 13.148 -2.442 -8.862 1.00 18.23 C ATOM 1165 O PRO A 412 13.138 -2.243 -7.651 1.00 20.21 O ATOM 1166 CB PRO A 412 11.379 -1.083 -9.984 1.00 18.28 C ATOM 1167 CG PRO A 412 11.252 -0.449 -11.311 1.00 50.71 C ATOM 1168 CD PRO A 412 12.314 -1.088 -12.156 1.00 17.96 C ATOM 1169 N ILE A 413 13.376 -3.630 -9.404 1.00 17.20 N ATOM 1170 CA ILE A 413 13.520 -4.814 -8.561 1.00 17.09 C ATOM 1171 C ILE A 413 14.834 -5.551 -8.759 1.00 16.03 C ATOM 1172 O ILE A 413 14.941 -6.746 -8.464 1.00 16.31 O ATOM 1173 CB ILE A 413 12.377 -5.803 -8.801 1.00 18.38 C ATOM 1174 CG1 ILE A 413 12.369 -6.255 -10.264 1.00 23.40 C ATOM 1175 CG2 ILE A 413 11.049 -5.173 -8.425 1.00 25.28 C ATOM 1176 CD1 ILE A 413 11.740 -7.600 -10.483 1.00 20.51 C ATOM 1177 H ILE A 413 13.453 -3.720 -10.437 1.00 0.00 H ATOM 1178 N GLU A 414 15.859 -4.841 -9.201 1.00 15.53 N ATOM 1179 CA GLU A 414 17.118 -5.515 -9.479 1.00 16.20 C ATOM 1180 C GLU A 414 17.731 -6.160 -8.240 1.00 15.78 C ATOM 1181 O GLU A 414 18.397 -7.196 -8.358 1.00 16.00 O ATOM 1182 CB GLU A 414 18.117 -4.551 -10.122 1.00 22.03 C ATOM 1183 CG GLU A 414 17.817 -4.231 -11.585 1.00 52.03 C ATOM 1184 CD GLU A 414 18.113 -5.394 -12.528 1.00 65.91 C ATOM 1185 OE1 GLU A 414 18.461 -6.493 -12.046 1.00 40.89 O ATOM 1186 OE2 GLU A 414 18.001 -5.207 -13.758 1.00 70.48 O ATOM 1187 H GLU A 414 15.766 -3.816 -9.348 1.00 0.00 H ATOM 1188 N ASP A 415 17.513 -5.574 -7.063 1.00 17.06 N ATOM 1189 CA ASP A 415 18.029 -6.189 -5.841 1.00 18.93 C ATOM 1190 C ASP A 415 17.386 -7.557 -5.592 1.00 18.61 C ATOM 1191 O ASP A 415 18.055 -8.504 -5.162 1.00 17.68 O ATOM 1192 CB ASP A 415 17.835 -5.275 -4.619 1.00 20.10 C ATOM 1193 CG ASP A 415 16.397 -4.783 -4.440 1.00 19.83 C ATOM 1194 OD1 ASP A 415 15.640 -4.703 -5.430 1.00 18.45 O ATOM 1195 OD2 ASP A 415 16.038 -4.434 -3.291 1.00 21.53 O ATOM 1196 H ASP A 415 16.978 -4.683 -7.014 1.00 0.00 H ATOM 1197 N ILE A 416 16.097 -7.658 -5.873 1.00 16.09 N ATOM 1198 CA ILE A 416 15.375 -8.910 -5.705 1.00 16.48 C ATOM 1199 C ILE A 416 15.847 -9.945 -6.721 1.00 16.51 C ATOM 1200 O ILE A 416 16.052 -11.116 -6.386 1.00 16.48 O ATOM 1201 CB ILE A 416 13.862 -8.694 -5.847 1.00 17.24 C ATOM 1202 CG1 ILE A 416 13.412 -7.571 -4.913 1.00 19.49 C ATOM 1203 CG2 ILE A 416 13.104 -9.984 -5.560 1.00 18.75 C ATOM 1204 CD1 ILE A 416 12.170 -6.870 -5.374 1.00 22.73 C ATOM 1205 H ILE A 416 15.587 -6.822 -6.223 1.00 0.00 H ATOM 1206 N LEU A 417 16.026 -9.517 -7.965 1.00 13.51 N ATOM 1207 CA LEU A 417 16.537 -10.416 -8.994 1.00 14.58 C ATOM 1208 C LEU A 417 17.922 -10.959 -8.639 1.00 14.10 C ATOM 1209 O LEU A 417 18.196 -12.153 -8.812 1.00 13.89 O ATOM 1210 CB LEU A 417 16.587 -9.708 -10.339 1.00 15.34 C ATOM 1211 CG LEU A 417 15.246 -9.410 -11.007 1.00 15.45 C ATOM 1212 CD1 LEU A 417 15.420 -8.385 -12.114 1.00 16.90 C ATOM 1213 CD2 LEU A 417 14.634 -10.699 -11.552 1.00 16.90 C ATOM 1214 H LEU A 417 15.800 -8.531 -8.208 1.00 0.00 H ATOM 1215 N HIS A 418 18.790 -10.088 -8.142 1.00 14.55 N ATOM 1216 CA HIS A 418 20.138 -10.489 -7.753 1.00 17.89 C ATOM 1217 C HIS A 418 20.131 -11.468 -6.585 1.00 15.01 C ATOM 1218 O HIS A 418 20.897 -12.433 -6.581 1.00 17.05 O ATOM 1219 CB HIS A 418 20.973 -9.254 -7.402 1.00 19.23 C ATOM 1220 CG HIS A 418 22.341 -9.575 -6.878 1.00 43.04 C ATOM 1221 ND1 HIS A 418 22.617 -9.681 -5.535 1.00 76.24 N ATOM 1222 CD2 HIS A 418 23.507 -9.813 -7.525 1.00 53.83 C ATOM 1223 CE1 HIS A 418 23.898 -9.968 -5.371 1.00 58.57 C ATOM 1224 NE2 HIS A 418 24.459 -10.053 -6.562 1.00 61.62 N ATOM 1225 H HIS A 418 18.503 -9.095 -8.027 1.00 0.00 H ATOM 1226 N ARG A 419 19.300 -11.208 -5.579 1.00 16.59 N ATOM 1227 CA ARG A 419 19.192 -12.123 -4.452 1.00 16.27 C ATOM 1228 C ARG A 419 18.734 -13.491 -4.929 1.00 15.19 C ATOM 1229 O ARG A 419 19.250 -14.525 -4.491 1.00 16.04 O ATOM 1230 CB ARG A 419 18.226 -11.587 -3.394 1.00 18.30 C ATOM 1231 CG ARG A 419 18.016 -12.531 -2.223 1.00 24.22 C ATOM 1232 CD ARG A 419 17.029 -11.975 -1.209 1.00 46.42 C ATOM 1233 NE ARG A 419 15.691 -11.806 -1.769 1.00 64.68 N ATOM 1234 CZ ARG A 419 14.721 -11.115 -1.180 1.00 67.20 C ATOM 1235 NH1 ARG A 419 13.532 -11.007 -1.757 1.00 55.70 N ATOM 1236 NH2 ARG A 419 14.940 -10.530 -0.010 1.00 77.43 N ATOM 1237 HE ARG A 419 15.485 -12.254 -2.685 1.00 0.00 H ATOM 1238 HH12 ARG A 419 12.776 -10.465 -1.292 1.00 0.00 H ATOM 1239 HH11 ARG A 419 13.356 -11.464 -2.674 1.00 0.00 H ATOM 1240 HH22 ARG A 419 14.181 -9.989 0.451 1.00 0.00 H ATOM 1241 HH21 ARG A 419 15.871 -10.612 0.446 1.00 0.00 H ATOM 1242 H ARG A 419 18.722 -10.343 -5.598 1.00 0.00 H ATOM 1243 N ASN A 420 17.762 -13.507 -5.824 1.00 14.91 N ATOM 1244 CA ASN A 420 17.272 -14.772 -6.332 1.00 13.84 C ATOM 1245 C ASN A 420 18.316 -15.497 -7.185 1.00 15.00 C ATOM 1246 O ASN A 420 18.369 -16.727 -7.181 1.00 14.69 O ATOM 1247 CB ASN A 420 15.988 -14.550 -7.114 1.00 15.23 C ATOM 1248 CG ASN A 420 14.830 -14.136 -6.232 1.00 15.51 C ATOM 1249 OD1 ASN A 420 14.921 -14.160 -5.008 1.00 19.60 O ATOM 1250 ND2 ASN A 420 13.721 -13.780 -6.855 1.00 16.42 N ATOM 1251 HD22 ASN A 420 13.688 -13.774 -7.894 1.00 0.00 H ATOM 1252 HD21 ASN A 420 12.881 -13.506 -6.306 1.00 0.00 H ATOM 1253 H ASN A 420 17.350 -12.614 -6.163 1.00 0.00 H ATOM 1254 N VAL A 421 19.153 -14.753 -7.899 1.00 14.50 N ATOM 1255 CA VAL A 421 20.268 -15.369 -8.615 1.00 15.14 C ATOM 1256 C VAL A 421 21.221 -16.061 -7.643 1.00 14.44 C ATOM 1257 O VAL A 421 21.623 -17.212 -7.858 1.00 14.86 O ATOM 1258 CB VAL A 421 21.031 -14.328 -9.454 1.00 15.46 C ATOM 1259 CG1 VAL A 421 22.403 -14.847 -9.855 1.00 18.32 C ATOM 1260 CG2 VAL A 421 20.204 -13.933 -10.674 1.00 16.30 C ATOM 1261 H VAL A 421 19.014 -13.724 -7.949 1.00 0.00 H ATOM 1262 N GLU A 422 21.584 -15.368 -6.570 1.00 14.99 N ATOM 1263 CA GLU A 422 22.455 -15.959 -5.563 1.00 16.38 C ATOM 1264 C GLU A 422 21.849 -17.238 -4.995 1.00 17.48 C ATOM 1265 O GLU A 422 22.558 -18.208 -4.724 1.00 18.43 O ATOM 1266 CB GLU A 422 22.731 -14.956 -4.442 1.00 21.35 C ATOM 1267 CG GLU A 422 23.438 -13.696 -4.908 1.00 25.76 C ATOM 1268 CD GLU A 422 24.707 -13.994 -5.684 1.00 58.67 C ATOM 1269 OE1 GLU A 422 25.500 -14.846 -5.228 1.00 57.13 O ATOM 1270 OE2 GLU A 422 24.908 -13.382 -6.755 1.00 74.63 O ATOM 1271 H GLU A 422 21.243 -14.393 -6.447 1.00 0.00 H ATOM 1272 N ASN A 423 20.533 -17.238 -4.830 1.00 15.98 N ATOM 1273 CA ASN A 423 19.842 -18.400 -4.291 1.00 18.23 C ATOM 1274 C ASN A 423 19.918 -19.641 -5.179 1.00 15.77 C ATOM 1275 O ASN A 423 19.754 -20.752 -4.679 1.00 17.53 O ATOM 1276 CB ASN A 423 18.372 -18.070 -4.011 1.00 18.83 C ATOM 1277 CG ASN A 423 18.200 -17.136 -2.819 1.00 33.03 C ATOM 1278 OD1 ASN A 423 19.123 -16.939 -2.025 1.00 26.34 O ATOM 1279 ND2 ASN A 423 17.005 -16.578 -2.678 1.00 28.69 N ATOM 1280 HD22 ASN A 423 16.255 -16.772 -3.372 1.00 0.00 H ATOM 1281 HD21 ASN A 423 16.818 -15.946 -1.873 1.00 0.00 H ATOM 1282 H ASN A 423 19.985 -16.393 -5.090 1.00 0.00 H ATOM 1283 N TYR A 424 20.165 -19.469 -6.478 1.00 14.79 N ATOM 1284 CA TYR A 424 20.339 -20.621 -7.377 1.00 14.84 C ATOM 1285 C TYR A 424 21.490 -21.530 -6.947 1.00 16.81 C ATOM 1286 O TYR A 424 21.507 -22.712 -7.294 1.00 17.19 O ATOM 1287 CB TYR A 424 20.604 -20.172 -8.820 1.00 15.05 C ATOM 1288 CG TYR A 424 19.455 -19.561 -9.586 1.00 12.75 C ATOM 1289 CD1 TYR A 424 18.141 -19.984 -9.414 1.00 14.41 C ATOM 1290 CD2 TYR A 424 19.705 -18.541 -10.504 1.00 12.65 C ATOM 1291 CE1 TYR A 424 17.111 -19.417 -10.144 1.00 14.36 C ATOM 1292 CE2 TYR A 424 18.683 -17.967 -11.230 1.00 12.76 C ATOM 1293 CZ TYR A 424 17.387 -18.404 -11.045 1.00 13.92 C ATOM 1294 OH TYR A 424 16.357 -17.836 -11.760 1.00 13.44 O ATOM 1295 HH TYR A 424 16.313 -16.867 -11.560 1.00 0.00 H ATOM 1296 H TYR A 424 20.236 -18.505 -6.862 1.00 0.00 H ATOM 1297 N LYS A 425 22.471 -20.971 -6.241 1.00 18.24 N ATOM 1298 CA LYS A 425 23.665 -21.730 -5.880 1.00 19.14 C ATOM 1299 C LYS A 425 23.357 -22.951 -5.022 1.00 18.69 C ATOM 1300 O LYS A 425 24.086 -23.938 -5.072 1.00 19.99 O ATOM 1301 CB LYS A 425 24.680 -20.833 -5.155 1.00 19.83 C ATOM 1302 CG LYS A 425 25.433 -19.886 -6.074 1.00 62.77 C ATOM 1303 CD LYS A 425 26.610 -19.230 -5.365 1.00 33.35 C ATOM 1304 CE LYS A 425 26.168 -18.544 -4.085 1.00 54.44 C ATOM 1305 NZ LYS A 425 25.243 -17.408 -4.350 1.00 46.47 N ATOM 1306 HZ1 LYS A 425 25.722 -16.704 -4.947 1.00 0.00 H ATOM 1307 HZ2 LYS A 425 24.395 -17.760 -4.839 1.00 0.00 H ATOM 1308 HZ3 LYS A 425 24.967 -16.969 -3.448 1.00 0.00 H ATOM 1309 H LYS A 425 22.385 -19.979 -5.942 1.00 0.00 H ATOM 1310 N LYS A 426 22.294 -22.894 -4.226 1.00 16.94 N ATOM 1311 CA LYS A 426 22.028 -23.997 -3.308 1.00 21.05 C ATOM 1312 C LYS A 426 21.786 -25.298 -4.071 1.00 17.83 C ATOM 1313 O LYS A 426 22.402 -26.329 -3.783 1.00 19.56 O ATOM 1314 CB LYS A 426 20.834 -23.695 -2.405 1.00 21.08 C ATOM 1315 CG LYS A 426 20.507 -24.833 -1.442 1.00 42.08 C ATOM 1316 CD LYS A 426 19.361 -24.474 -0.513 1.00 50.78 C ATOM 1317 CE LYS A 426 19.057 -25.612 0.448 1.00 43.25 C ATOM 1318 NZ LYS A 426 18.055 -25.213 1.473 1.00 56.76 N ATOM 1319 HZ1 LYS A 426 18.423 -24.410 2.022 1.00 0.00 H ATOM 1320 HZ2 LYS A 426 17.170 -24.936 1.002 1.00 0.00 H ATOM 1321 HZ3 LYS A 426 17.874 -26.015 2.110 1.00 0.00 H ATOM 1322 H LYS A 426 21.658 -22.072 -4.257 1.00 0.00 H ATOM 1323 N VAL A 427 20.902 -25.264 -5.061 1.00 17.24 N ATOM 1324 CA VAL A 427 20.623 -26.494 -5.780 1.00 19.26 C ATOM 1325 C VAL A 427 21.820 -26.888 -6.648 1.00 16.97 C ATOM 1326 O VAL A 427 22.116 -28.069 -6.772 1.00 18.45 O ATOM 1327 CB VAL A 427 19.322 -26.400 -6.622 1.00 19.60 C ATOM 1328 CG1 VAL A 427 19.520 -25.567 -7.861 1.00 22.22 C ATOM 1329 CG2 VAL A 427 18.835 -27.796 -6.999 1.00 31.20 C ATOM 1330 H VAL A 427 20.421 -24.378 -5.315 1.00 0.00 H ATOM 1331 N LEU A 428 22.527 -25.918 -7.224 1.00 15.93 N ATOM 1332 CA LEU A 428 23.691 -26.253 -8.046 1.00 17.81 C ATOM 1333 C LEU A 428 24.742 -27.006 -7.233 1.00 17.91 C ATOM 1334 O LEU A 428 25.266 -28.042 -7.658 1.00 19.65 O ATOM 1335 CB LEU A 428 24.304 -24.995 -8.660 1.00 16.78 C ATOM 1336 CG LEU A 428 23.425 -24.237 -9.656 1.00 16.71 C ATOM 1337 CD1 LEU A 428 24.109 -22.938 -10.062 1.00 16.99 C ATOM 1338 CD2 LEU A 428 23.145 -25.097 -10.864 1.00 19.49 C ATOM 1339 H LEU A 428 22.253 -24.924 -7.090 1.00 0.00 H ATOM 1340 N ASN A 429 25.036 -26.499 -6.045 1.00 17.65 N ATOM 1341 CA ASN A 429 25.995 -27.176 -5.187 1.00 19.28 C ATOM 1342 C ASN A 429 25.489 -28.538 -4.724 1.00 22.04 C ATOM 1343 O ASN A 429 26.257 -29.491 -4.670 1.00 20.46 O ATOM 1344 CB ASN A 429 26.353 -26.306 -3.990 1.00 21.03 C ATOM 1345 CG ASN A 429 27.395 -25.263 -4.338 1.00 23.21 C ATOM 1346 OD1 ASN A 429 28.257 -25.501 -5.186 1.00 25.30 O ATOM 1347 ND2 ASN A 429 27.326 -24.111 -3.688 1.00 25.76 N ATOM 1348 HD22 ASN A 429 26.580 -23.957 -2.980 1.00 0.00 H ATOM 1349 HD21 ASN A 429 28.018 -23.360 -3.885 1.00 0.00 H ATOM 1350 H ASN A 429 24.582 -25.619 -5.727 1.00 0.00 H ATOM 1351 N GLU A 430 24.202 -28.645 -4.407 1.00 19.00 N ATOM 1352 CA GLU A 430 23.638 -29.926 -3.986 1.00 21.85 C ATOM 1353 C GLU A 430 23.805 -30.988 -5.059 1.00 20.87 C ATOM 1354 O GLU A 430 24.003 -32.157 -4.755 1.00 22.34 O ATOM 1355 CB GLU A 430 22.159 -29.777 -3.647 1.00 23.94 C ATOM 1356 CG GLU A 430 21.895 -29.146 -2.311 1.00 24.01 C ATOM 1357 CD GLU A 430 20.431 -28.815 -2.110 1.00 38.70 C ATOM 1358 OE1 GLU A 430 19.692 -28.733 -3.115 1.00 29.25 O ATOM 1359 OE2 GLU A 430 20.016 -28.637 -0.945 1.00 72.65 O ATOM 1360 H GLU A 430 23.589 -27.807 -4.459 1.00 0.00 H ATOM 1361 N LEU A 431 23.715 -30.572 -6.316 1.00 16.90 N ATOM 1362 CA LEU A 431 23.787 -31.488 -7.441 1.00 19.30 C ATOM 1363 C LEU A 431 25.179 -31.592 -8.055 1.00 21.29 C ATOM 1364 O LEU A 431 25.360 -32.258 -9.072 1.00 22.94 O ATOM 1365 CB LEU A 431 22.780 -31.067 -8.507 1.00 17.89 C ATOM 1366 CG LEU A 431 21.334 -31.018 -8.009 1.00 20.24 C ATOM 1367 CD1 LEU A 431 20.389 -30.766 -9.175 1.00 23.69 C ATOM 1368 CD2 LEU A 431 20.921 -32.273 -7.275 1.00 24.72 C ATOM 1369 H LEU A 431 23.589 -29.557 -6.502 1.00 0.00 H ATOM 1370 N GLY A 432 26.157 -30.936 -7.433 1.00 19.73 N ATOM 1371 CA GLY A 432 27.524 -30.979 -7.914 1.00 22.52 C ATOM 1372 C GLY A 432 27.740 -30.270 -9.237 1.00 21.99 C ATOM 1373 O GLY A 432 28.652 -30.611 -9.994 1.00 25.91 O ATOM 1374 H GLY A 432 25.935 -30.380 -6.583 1.00 0.00 H ATOM 1375 N LEU A 433 26.918 -29.259 -9.514 1.00 19.19 N ATOM 1376 CA LEU A 433 26.993 -28.543 -10.787 1.00 18.76 C ATOM 1377 C LEU A 433 27.854 -27.290 -10.676 1.00 20.37 C ATOM 1378 O LEU A 433 28.120 -26.798 -9.578 1.00 23.08 O ATOM 1379 CB LEU A 433 25.594 -28.155 -11.264 1.00 17.51 C ATOM 1380 CG LEU A 433 24.584 -29.285 -11.124 1.00 22.42 C ATOM 1381 CD1 LEU A 433 23.192 -28.833 -11.532 1.00 16.43 C ATOM 1382 CD2 LEU A 433 25.030 -30.500 -11.861 1.00 47.55 C ATOM 1383 H LEU A 433 26.208 -28.973 -8.810 1.00 0.00 H ATOM 1384 N ASP A 434 28.282 -26.775 -11.824 1.00 21.86 N ATOM 1385 CA ASP A 434 29.089 -25.561 -11.860 1.00 23.11 C ATOM 1386 C ASP A 434 28.320 -24.373 -11.296 1.00 21.81 C ATOM 1387 O ASP A 434 27.155 -24.178 -11.628 1.00 24.35 O ATOM 1388 CB ASP A 434 29.533 -25.252 -13.287 1.00 26.74 C ATOM 1389 CG ASP A 434 29.988 -23.816 -13.449 1.00 55.39 C ATOM 1390 OD1 ASP A 434 31.148 -23.537 -13.101 1.00 47.90 O ATOM 1391 OD2 ASP A 434 29.190 -22.967 -13.909 1.00 53.86 O ATOM 1392 H ASP A 434 28.036 -27.248 -12.717 1.00 0.00 H ATOM 1393 N THR A 435 28.961 -23.580 -10.443 1.00 22.62 N ATOM 1394 CA THR A 435 28.311 -22.373 -9.927 1.00 22.53 C ATOM 1395 C THR A 435 28.910 -21.077 -10.464 1.00 27.64 C ATOM 1396 O THR A 435 28.494 -19.987 -10.063 1.00 24.23 O ATOM 1397 CB THR A 435 28.354 -22.307 -8.387 1.00 22.21 C ATOM 1398 OG1 THR A 435 29.712 -22.333 -7.940 1.00 25.80 O ATOM 1399 CG2 THR A 435 27.593 -23.474 -7.775 1.00 23.68 C ATOM 1400 HG1 THR A 435 30.197 -21.556 -8.316 1.00 0.00 H ATOM 1401 H THR A 435 29.927 -23.817 -10.141 1.00 0.00 H ATOM 1402 N THR A 436 29.879 -21.171 -11.369 1.00 24.88 N ATOM 1403 CA THR A 436 30.473 -19.954 -11.914 1.00 25.09 C ATOM 1404 C THR A 436 29.456 -19.175 -12.753 1.00 24.70 C ATOM 1405 O THR A 436 29.643 -17.991 -13.003 1.00 24.50 O ATOM 1406 CB THR A 436 31.715 -20.243 -12.775 1.00 31.10 C ATOM 1407 OG1 THR A 436 31.329 -20.956 -13.957 1.00 30.01 O ATOM 1408 CG2 THR A 436 32.733 -21.055 -11.987 1.00 33.39 C ATOM 1409 HG1 THR A 436 30.901 -21.811 -13.700 1.00 0.00 H ATOM 1410 H THR A 436 30.211 -22.104 -11.686 1.00 0.00 H ATOM 1411 N CYS A 437 28.375 -19.834 -13.166 1.00 20.70 N ATOM 1412 CA CYS A 437 27.306 -19.144 -13.882 1.00 19.73 C ATOM 1413 C CYS A 437 26.604 -18.154 -12.961 1.00 19.11 C ATOM 1414 O CYS A 437 25.943 -17.223 -13.428 1.00 20.66 O ATOM 1415 CB CYS A 437 26.300 -20.143 -14.472 1.00 18.82 C ATOM 1416 SG CYS A 437 25.425 -21.195 -13.282 1.00 20.42 S ATOM 1417 H CYS A 437 28.291 -20.853 -12.976 1.00 0.00 H ATOM 1418 N ILE A 438 26.776 -18.346 -11.653 1.00 20.84 N ATOM 1419 CA ILE A 438 26.228 -17.429 -10.662 1.00 20.25 C ATOM 1420 C ILE A 438 27.256 -16.365 -10.291 1.00 52.50 C ATOM 1421 O ILE A 438 26.957 -15.175 -10.358 1.00 57.44 O ATOM 1422 CB ILE A 438 25.761 -18.172 -9.403 1.00 22.10 C ATOM 1423 CG1 ILE A 438 24.758 -19.261 -9.791 1.00 21.99 C ATOM 1424 CG2 ILE A 438 25.149 -17.196 -8.409 1.00 35.58 C ATOM 1425 CD1 ILE A 438 23.590 -18.745 -10.621 1.00 22.67 C ATOM 1426 H ILE A 438 27.317 -19.174 -11.331 1.00 0.00 H ATOM 1427 N ASP A 439 28.453 -16.801 -9.897 1.00 30.16 N ATOM 1428 CA ASP A 439 29.616 -15.912 -9.756 1.00 41.21 C ATOM 1429 C ASP A 439 30.870 -16.695 -9.382 1.00 51.13 C ATOM 1430 O ASP A 439 30.789 -17.816 -8.881 1.00 41.03 O ATOM 1431 CB ASP A 439 29.369 -14.807 -8.719 1.00 55.08 C ATOM 1432 CG ASP A 439 28.735 -15.324 -7.443 1.00 69.12 C ATOM 1433 OD1 ASP A 439 28.962 -16.499 -7.087 1.00 61.69 O ATOM 1434 OD2 ASP A 439 28.008 -14.545 -6.791 1.00 85.38 O ATOM 1435 H ASP A 439 28.569 -17.812 -9.680 1.00 0.00 H TER 1436 ASP A 439 HETATM 1437 O HOH 1 -7.185 2.025 -19.863 1.00 42.15 O HETATM 1438 O HOH 2 -0.134 -26.589 -16.684 1.00 29.13 O HETATM 1439 O HOH 3 27.076 -18.827 -26.673 1.00 49.13 O HETATM 1440 O HOH 4 21.287 -28.101 -20.376 1.00 24.52 O HETATM 1441 O HOH 5 -1.123 -23.288 -16.083 1.00 36.38 O HETATM 1442 O HOH 6 13.672 -0.580 -24.347 1.00 41.34 O HETATM 1443 O HOH 7 6.220 4.535 -9.132 1.00 35.60 O HETATM 1444 O HOH 8 0.974 -15.813 -10.832 1.00 52.86 O HETATM 1445 O HOH 9 17.914 -2.776 -14.488 1.00 55.48 O HETATM 1446 O HOH 10 10.968 -7.967 -1.035 1.00 38.06 O HETATM 1447 O HOH 11 8.631 3.983 -13.119 1.00 42.09 O HETATM 1448 O HOH 12 12.558 -19.544 -27.274 1.00 21.32 O HETATM 1449 O HOH 13 11.103 -10.158 -1.786 1.00 34.89 O HETATM 1450 O HOH 14 30.931 -20.053 -7.570 1.00 36.15 O HETATM 1451 O HOH 15 -8.554 -8.527 -18.392 1.00 36.07 O HETATM 1452 O HOH 16 25.778 -34.292 -15.312 1.00 56.35 O HETATM 1453 O HOH 17 5.479 -12.624 -30.044 1.00 25.25 O HETATM 1454 O HOH 18 12.707 -15.351 -27.696 1.00 32.18 O HETATM 1455 O HOH 19 6.974 -28.117 -13.973 1.00 31.87 O HETATM 1456 O HOH 20 15.022 1.531 -14.949 1.00 21.77 O HETATM 1457 O HOH 21 16.535 -13.778 -10.454 1.00 14.74 O HETATM 1458 O HOH 22 0.022 -25.547 -12.759 1.00 44.72 O HETATM 1459 O HOH 23 5.459 0.083 -24.432 1.00 47.09 O HETATM 1460 O HOH 24 10.059 -18.165 -10.627 1.00 16.37 O HETATM 1461 O HOH 25 13.958 -19.054 -12.554 1.00 14.51 O HETATM 1462 O HOH 26 18.189 -20.800 -26.335 1.00 15.63 O HETATM 1463 O HOH 27 -0.453 -14.193 -12.917 1.00 43.75 O HETATM 1464 O HOH 28 29.039 -27.661 -7.225 1.00 26.99 O HETATM 1465 O HOH 29 0.822 -23.614 -14.688 1.00 24.14 O HETATM 1466 O HOH 30 13.818 -22.148 -28.608 1.00 42.76 O HETATM 1467 O HOH 31 7.581 -33.318 -22.669 1.00 46.17 O HETATM 1468 O HOH 32 -1.267 -19.887 -28.335 1.00 28.46 O HETATM 1469 O HOH 33 6.751 -23.614 -9.578 1.00 25.71 O HETATM 1470 O HOH 34 20.555 -28.963 -23.442 1.00 44.44 O HETATM 1471 O HOH 35 -1.565 -3.805 -31.133 1.00 33.62 O HETATM 1472 O HOH 36 8.992 -20.994 -7.994 1.00 26.84 O HETATM 1473 O HOH 37 20.417 -14.595 -1.585 1.00 38.66 O HETATM 1474 O HOH 38 23.247 -19.127 -2.263 1.00 46.05 O HETATM 1475 O HOH 39 17.549 -29.450 -0.145 1.00 29.75 O HETATM 1476 O HOH 40 30.529 -11.179 -20.623 1.00 60.87 O HETATM 1477 O HOH 41 8.493 -7.684 -25.467 1.00 17.49 O HETATM 1478 O HOH 42 2.115 -6.105 -5.113 1.00 30.07 O HETATM 1479 O HOH 43 10.695 -32.855 -19.917 1.00 28.06 O HETATM 1480 O HOH 44 28.392 -21.683 -25.037 1.00 36.50 O HETATM 1481 O HOH 45 18.800 -23.233 -5.289 1.00 17.33 O HETATM 1482 O HOH 46 26.390 -19.077 -18.158 1.00 23.12 O HETATM 1483 O HOH 47 -0.808 -13.944 -23.907 1.00 25.38 O HETATM 1484 O HOH 48 17.752 -0.344 -10.784 1.00 26.12 O HETATM 1485 O HOH 49 15.225 -20.727 -7.056 1.00 25.83 O HETATM 1486 O HOH 50 30.700 -24.587 -6.703 1.00 49.90 O HETATM 1487 O HOH 51 -5.876 0.533 -27.889 1.00 41.48 O HETATM 1488 O HOH 52 -1.341 -23.213 -21.863 1.00 23.64 O HETATM 1489 O HOH 53 26.836 -33.547 -11.012 1.00 41.49 O HETATM 1490 O HOH 54 9.963 -14.093 -30.355 1.00 36.66 O HETATM 1491 O HOH 55 8.181 -31.372 -29.343 1.00 22.86 O HETATM 1492 O HOH 56 20.415 -8.018 -3.798 1.00 23.52 O HETATM 1493 O HOH 57 16.012 -18.173 -6.984 1.00 15.79 O HETATM 1494 O HOH 58 3.022 -8.794 -8.726 1.00 19.19 O HETATM 1495 O HOH 59 -1.105 -26.616 -21.051 1.00 24.06 O HETATM 1496 O HOH 60 -0.833 7.050 -6.160 1.00 18.97 O HETATM 1497 O HOH 61 8.679 -0.742 -14.286 1.00 18.20 O HETATM 1498 O HOH 62 24.013 -26.428 -1.515 1.00 25.05 O HETATM 1499 O HOH 63 12.398 -23.372 -6.019 1.00 41.62 O HETATM 1500 O HOH 64 13.674 -10.799 -27.260 1.00 27.03 O HETATM 1501 O HOH 65 11.661 -24.626 -29.578 1.00 34.42 O HETATM 1502 O HOH 66 22.972 -27.384 -24.760 1.00 31.46 O HETATM 1503 O HOH 67 0.966 -17.006 -26.811 1.00 21.42 O HETATM 1504 O HOH 68 29.570 -11.623 -15.804 1.00 40.48 O HETATM 1505 O HOH 69 24.496 -24.823 -26.765 1.00 28.03 O HETATM 1506 O HOH 70 14.494 -27.043 -7.546 1.00 20.20 O HETATM 1507 O HOH 71 7.562 -14.692 -10.279 1.00 14.51 O HETATM 1508 O HOH 72 16.362 -30.417 -8.441 1.00 39.01 O HETATM 1509 O HOH 73 23.872 -14.430 -23.614 1.00 32.10 O HETATM 1510 O HOH 74 9.235 -8.031 -6.273 1.00 18.95 O HETATM 1511 O HOH 75 15.061 -17.559 -4.456 1.00 25.48 O HETATM 1512 O HOH 76 17.119 -24.207 -9.592 1.00 14.68 O HETATM 1513 O HOH 77 1.896 -33.751 -26.478 1.00 28.21 O HETATM 1514 O HOH 78 4.357 -31.397 -29.167 1.00 47.00 O HETATM 1515 O HOH 79 -0.199 -5.125 -12.716 1.00 32.01 O HETATM 1516 O HOH 80 12.661 -19.000 -10.110 1.00 17.37 O HETATM 1517 O HOH 81 26.738 -24.751 -20.818 1.00 43.59 O HETATM 1518 O HOH 82 23.318 -17.179 -17.844 1.00 15.00 O HETATM 1519 O HOH 83 1.105 -21.416 -10.210 1.00 48.94 O HETATM 1520 O HOH 84 18.482 -18.169 -25.686 1.00 17.02 O HETATM 1521 O HOH 85 0.069 -28.108 -28.979 1.00 28.72 O HETATM 1522 O HOH 86 14.955 -29.348 -19.277 1.00 19.29 O HETATM 1523 O HOH 87 4.193 -15.931 -9.268 1.00 18.33 O HETATM 1524 O HOH 88 3.995 -2.992 -4.067 1.00 32.41 O HETATM 1525 O HOH 89 20.559 -30.448 -19.373 1.00 29.49 O HETATM 1526 O HOH 90 8.678 -33.573 -20.683 1.00 50.90 O HETATM 1527 O HOH 91 7.665 -20.259 -29.549 1.00 29.62 O HETATM 1528 O HOH 92 6.812 -26.499 -9.827 1.00 26.03 O HETATM 1529 O HOH 93 18.106 -0.787 -20.740 1.00 23.31 O HETATM 1530 O HOH 94 23.686 -18.745 -29.526 1.00 26.69 O HETATM 1531 O HOH 95 1.266 -16.079 -24.140 1.00 20.12 O HETATM 1532 O HOH 96 11.124 3.332 -9.963 1.00 44.98 O HETATM 1533 O HOH 97 2.028 -7.715 -27.291 1.00 35.79 O HETATM 1534 O HOH 98 8.337 -30.296 -8.334 1.00 15.33 O HETATM 1535 O HOH 99 6.785 1.110 -20.845 1.00 27.49 O HETATM 1536 O HOH 100 13.929 -17.171 -8.540 1.00 18.20 O HETATM 1537 O HOH 101 15.519 -6.254 -1.093 1.00 30.67 O HETATM 1538 O HOH 102 9.417 -31.980 -22.213 1.00 25.34 O HETATM 1539 O HOH 103 25.552 -17.113 -16.315 1.00 19.08 O HETATM 1540 O HOH 104 7.674 0.273 -5.772 1.00 32.85 O HETATM 1541 O HOH 105 16.023 -16.860 -25.895 1.00 31.30 O HETATM 1542 O HOH 106 9.552 -10.822 -5.152 1.00 28.92 O HETATM 1543 O HOH 107 7.160 3.205 -5.618 1.00 41.81 O HETATM 1544 O HOH 108 4.687 -4.984 -27.040 1.00 29.77 O HETATM 1545 O HOH 109 10.689 -6.084 -24.947 1.00 27.30 O HETATM 1546 O HOH 110 16.859 -14.831 -26.752 1.00 29.64 O HETATM 1547 O HOH 111 7.139 -2.525 -2.398 1.00 38.04 O HETATM 1548 O HOH 112 2.263 -10.527 -28.631 1.00 23.30 O HETATM 1549 O HOH 113 10.053 -14.797 -7.070 1.00 24.83 O HETATM 1550 O HOH 114 -1.126 -3.510 -10.066 1.00 40.68 O HETATM 1551 O HOH 115 -1.040 -29.196 -23.146 1.00 22.16 O HETATM 1552 O HOH 116 7.830 -3.985 -26.860 1.00 46.17 O HETATM 1553 O HOH 117 17.560 -5.490 -26.442 1.00 25.44 O HETATM 1554 O HOH 118 11.004 -19.828 -6.616 1.00 42.86 O HETATM 1555 O HOH 119 14.431 -33.276 -21.471 1.00 44.32 O HETATM 1556 O HOH 120 23.038 -32.003 -21.913 1.00 60.74 O HETATM 1557 O HOH 121 12.547 -27.673 -29.626 1.00 19.04 O HETATM 1558 O HOH 122 9.445 -23.257 -30.369 1.00 24.95 O HETATM 1559 O HOH 123 26.384 -33.939 -5.525 1.00 34.60 O HETATM 1560 O HOH 124 1.419 -29.277 -26.968 1.00 15.65 O HETATM 1561 O HOH 125 20.106 -36.311 -12.066 1.00 21.19 O HETATM 1562 O HOH 126 0.924 -7.177 -7.044 1.00 41.13 O HETATM 1563 O HOH 127 14.753 -6.992 -29.831 1.00 54.91 O HETATM 1564 O HOH 128 11.076 -12.984 -5.303 1.00 26.60 O HETATM 1565 O HOH 129 12.665 -16.319 -4.401 1.00 40.86 O HETATM 1566 O HOH 130 11.235 2.103 -15.845 1.00 59.36 O HETATM 1567 O HOH 131 26.625 -21.984 -17.720 1.00 37.71 O HETATM 1568 O HOH 132 3.435 -28.984 -11.414 1.00 48.23 O HETATM 1569 O HOH 133 25.230 -23.661 -1.204 1.00 32.71 O HETATM 1570 O HOH 134 2.905 -18.860 -30.814 1.00 13.87 O HETATM 1571 O HOH 135 17.592 -8.036 -27.068 1.00 34.84 O HETATM 1572 O HOH 136 0.618 -15.250 -28.976 1.00 38.17 O HETATM 1573 O HOH 137 13.431 -7.409 0.041 1.00 37.15 O HETATM 1574 O HOH 138 22.753 -10.171 -10.737 1.00 31.53 O HETATM 1575 O HOH 139 25.656 -28.618 -1.144 1.00 39.91 O HETATM 1576 O HOH 140 20.295 -3.335 -7.407 1.00 31.66 O HETATM 1577 O HOH 141 17.649 1.002 -15.190 1.00 30.42 O HETATM 1578 O HOH 142 8.935 -8.061 1.299 1.00 41.74 O HETATM 1579 O HOH 143 0.257 -30.954 -24.496 1.00 40.90 O HETATM 1580 O HOH 144 16.021 -27.207 -0.924 1.00 39.78 O HETATM 1581 O HOH 145 12.226 -20.405 -29.598 1.00 34.15 O HETATM 1582 O HOH 146 8.884 -16.485 -8.686 1.00 23.14 O HETATM 1583 O HOH 147 11.690 -17.162 -6.761 1.00 30.19 O HETATM 1584 O HOH 148 24.367 -20.980 -1.328 1.00 48.50 O HETATM 1585 O HOH 149 3.579 -10.612 -30.651 1.00 44.57 O HETATM 1586 O HOH 150 26.819 -26.018 -22.808 1.00 48.16 O HETATM 1587 O HOH 151 9.618 1.814 -14.102 1.00 24.75 O HETATM 1588 O HOH 152 21.013 -3.976 -22.628 1.00 27.71 O HETATM 1589 O HOH 153 14.036 3.848 -15.587 1.00 41.02 O HETATM 1590 O HOH 154 15.526 -9.414 -28.720 1.00 36.05 O HETATM 1591 O HOH 155 8.384 -34.676 -26.108 1.00 31.46 O HETATM 1592 O HOH 156 16.731 1.559 -21.884 1.00 35.64 O HETATM 1593 O HOH 157 22.172 -12.044 -2.067 1.00 32.25 O HETATM 1594 O HOH 158 9.451 -33.895 -28.387 1.00 40.68 O HETATM 1595 O HOH 159 22.015 -23.711 2.061 1.00 41.47 O HETATM 1596 O HOH 160 11.835 -9.356 -28.348 1.00 36.15 O HETATM 1597 O HOH 161 14.708 -24.616 -6.274 1.00 26.43 O HETATM 1598 O HOH 162 16.806 -23.007 -7.212 1.00 17.73 O HETATM 1599 O HOH 163 -2.784 -14.349 -22.443 1.00 52.42 O HETATM 1600 O HOH 164 11.770 2.845 -12.541 1.00 34.54 O HETATM 1601 O HOH 165 15.891 -18.887 -29.450 1.00 39.61 O HETATM 1602 O HOH 166 14.124 -6.803 3.145 1.00 66.21 O HETATM 1603 P CMP A 167 19.460 -18.076 -18.142 1.00 0.26 P HETATM 1604 O1P CMP A 167 19.311 -16.786 -18.974 1.00 -0.62 O HETATM 1605 O2P CMP A 167 20.804 -18.529 -17.754 1.00 -0.62 O HETATM 1606 O5' CMP A 167 18.759 -19.301 -18.896 1.00 -0.25 O HETATM 1607 C5' CMP A 167 18.455 -20.512 -18.193 1.00 0.11 C HETATM 1608 C4' CMP A 167 17.686 -20.118 -16.977 1.00 0.12 C HETATM 1609 O4' CMP A 167 17.452 -21.173 -16.038 1.00 -0.34 O HETATM 1610 C1' CMP A 167 16.997 -20.561 -14.853 1.00 0.20 C HETATM 1611 C2' CMP A 167 17.473 -19.089 -14.884 1.00 0.14 C HETATM 1612 C3' CMP A 167 18.367 -19.096 -16.123 1.00 0.15 C HETATM 1613 O3' CMP A 167 18.518 -17.852 -16.797 1.00 -0.25 O HETATM 1614 H4 CMP A 167 19.373 -19.442 -15.844 1.00 0.07 H HETATM 1615 O2' CMP A 167 16.330 -18.273 -15.104 1.00 -0.38 O HETATM 1616 H6 CMP A 167 16.608 -17.384 -15.291 1.00 0.21 H HETATM 1617 H5 CMP A 167 18.012 -18.787 -13.974 1.00 0.07 H HETATM 1618 N9 CMP A 167 17.463 -21.320 -13.682 1.00 -0.19 N HETATM 1619 C8 CMP A 167 16.682 -22.114 -12.903 1.00 0.11 C HETATM 1620 N7 CMP A 167 17.428 -22.663 -11.933 1.00 -0.30 N HETATM 1621 C5 CMP A 167 18.691 -22.198 -12.118 1.00 0.10 C HETATM 1622 C6 CMP A 167 19.822 -22.448 -11.388 1.00 0.13 C HETATM 1623 N6 CMP A 167 20.001 -23.266 -10.245 1.00 -0.32 N HETATM 1624 H9 CMP A 167 20.931 -23.346 -9.810 1.00 0.18 H HETATM 1625 H10 CMP A 167 19.201 -23.780 -9.849 1.00 0.18 H HETATM 1626 N1 CMP A 167 20.988 -21.874 -11.751 1.00 -0.27 N HETATM 1627 C2 CMP A 167 21.004 -21.049 -12.850 1.00 0.05 C HETATM 1628 N3 CMP A 167 19.885 -20.774 -13.589 1.00 -0.27 N HETATM 1629 C4 CMP A 167 18.729 -21.373 -13.195 1.00 0.16 C HETATM 1630 H11 CMP A 167 21.944 -20.596 -13.145 1.00 0.10 H HETATM 1631 H8 CMP A 167 15.615 -22.279 -13.045 1.00 0.13 H HETATM 1632 H7 CMP A 167 15.897 -20.569 -14.842 1.00 0.10 H HETATM 1633 H3 CMP A 167 16.721 -19.721 -17.325 1.00 0.07 H HETATM 1634 H1 CMP A 167 19.383 -21.027 -17.904 1.00 0.06 H HETATM 1635 H2 CMP A 167 17.849 -21.177 -18.826 1.00 0.06 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 1603 1604 1605 1606 1613 CONECT 1604 1603 CONECT 1605 1603 CONECT 1606 1603 1607 CONECT 1607 1606 1608 1634 1635 CONECT 1608 1607 1609 1612 1633 CONECT 1609 1608 1610 CONECT 1610 1609 1611 1618 1632 CONECT 1611 1610 1612 1615 1617 CONECT 1612 1608 1611 1613 1614 CONECT 1613 1603 1612 CONECT 1614 1612 CONECT 1615 1611 1616 CONECT 1616 1615 CONECT 1617 1611 CONECT 1618 1610 1619 1629 CONECT 1619 1618 1620 1631 CONECT 1620 1619 1621 CONECT 1621 1620 1622 1629 CONECT 1622 1621 1623 1626 CONECT 1623 1622 1624 1625 CONECT 1624 1623 CONECT 1625 1623 CONECT 1626 1622 1627 CONECT 1627 1626 1628 1630 CONECT 1628 1627 1629 CONECT 1629 1618 1621 1628 CONECT 1630 1627 CONECT 1631 1619 CONECT 1632 1610 CONECT 1633 1608 CONECT 1634 1607 CONECT 1635 1607 MASTER 0 0 0 0 0 0 0 0 1634 1 37 12 END
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Related entries of code: 5k8s
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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PDBbind
301aa, >5KBF_1|Chains... *
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Complexes with the same small molecule ligand
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Ligand Name
2k0g
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CMP
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PDBbind
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PDBbind
CMP
Entry Information
PDB ID
5k8s
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
CAMP-dependent protein kinase regulatory subunit (PfPKAR 297-441)
Ligand Name
CMP
EC.Number
E.C.2.7.11.11
Resolution
1.15(Å)
Affinity (Kd/Ki/IC50)
Kd=6nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J. Biol. Chem. Vol. 291: pp. 25375-25386
Ligand Properties
Formula
C
1
0
H
1
3
N
5
O
6
P
Molecular Weight
330.214
Exact Mass
330.060
No. of atoms
35
No. of bonds
38
Polar Surface Area
171.59
LOGP Value
-2.64 (
Computed with XLOGP3
)
-0.67 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@@H]2OP(O)(O)OC[C@H]2O[C@H]1n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H14N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16-18,22H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q7KQK0
Entrez Gene ID
NCBI Entrez Gene ID:
811274
ASD
Information of known allosteric effects of PDB entries
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