Browse entries in the PDBbind-CN Database
HEADER 4NP9_COMPLEX COMPND 4NP9_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 129 THR LEU GLY ALA LEU GLU PHE SER LEU LEU TYR ASP GLN SEQRES 2 A 129 ASP ASN SER ASN LEU GLN CYS THR ILE ILE ARG ALA LYS SEQRES 3 A 129 GLY LEU LYS PRO MET ASP SER ASN GLY LEU ALA ASP PRO SEQRES 4 A 129 TYR VAL LYS LEU HIS LEU LEU PRO GLY ALA SER LYS SER SEQRES 5 A 129 ASN LYS LEU ARG THR LYS THR LEU ARG ASN THR ARG ASN SEQRES 6 A 129 PRO VAL TRP ASN GLU THR LEU GLN TYR HIS GLY ILE THR SEQRES 7 A 129 GLU GLU ASP MET GLN ARG LYS THR LEU ARG ILE SER VAL SEQRES 8 A 129 CYS ASP GLU ASP LYS PHE GLY HIS ASN GLU PHE ILE GLY SEQRES 9 A 129 GLU THR ARG PHE SER LEU LYS LYS LEU LYS ALA ASN GLN SEQRES 10 A 129 ARG LYS ASN PHE ASN ILE CYS LEU GLU ARG VAL ILE HET I A 3P 33 ATOM 1 N THR A 382 -3.764 19.078 37.546 1.00 39.47 N ATOM 2 CA THR A 382 -2.971 19.731 38.580 1.00 44.64 C ATOM 3 C THR A 382 -1.870 18.807 39.095 1.00 31.09 C ATOM 4 O THR A 382 -1.271 19.065 40.139 1.00 31.47 O ATOM 5 CB THR A 382 -3.853 20.182 39.767 1.00 41.80 C ATOM 6 OG1 THR A 382 -3.101 21.048 40.626 1.00 54.21 O ATOM 7 CG2 THR A 382 -4.359 18.980 40.569 1.00 38.69 C ATOM 8 HA THR A 382 -2.517 20.610 38.123 1.00 0.00 H ATOM 9 HB THR A 382 -4.715 20.715 39.366 1.00 0.00 H ATOM 10 HG1 THR A 382 -3.670 21.334 41.384 1.00 0.00 H ATOM 11 HG23 THR A 382 -4.931 18.322 39.914 1.00 0.00 H ATOM 12 HG21 THR A 382 -3.509 18.436 40.980 1.00 0.00 H ATOM 13 HG22 THR A 382 -4.996 19.329 41.381 1.00 0.00 H ATOM 14 HN3 THR A 382 -4.205 18.221 37.938 1.00 0.00 H ATOM 15 HN2 THR A 382 -3.147 18.819 36.750 1.00 0.00 H ATOM 16 HN1 THR A 382 -4.504 19.730 37.215 1.00 0.00 H ATOM 17 N LEU A 383 -1.610 17.727 38.366 1.00 30.81 N ATOM 18 CA LEU A 383 -0.552 16.799 38.745 1.00 22.98 C ATOM 19 C LEU A 383 0.811 17.401 38.454 1.00 25.97 C ATOM 20 O LEU A 383 1.796 17.080 39.122 1.00 22.10 O ATOM 21 CB LEU A 383 -0.701 15.474 38.002 1.00 25.13 C ATOM 22 CG LEU A 383 -1.909 14.617 38.373 1.00 26.60 C ATOM 23 CD1 LEU A 383 -2.039 13.473 37.391 1.00 25.42 C ATOM 24 CD2 LEU A 383 -1.794 14.092 39.797 1.00 21.11 C ATOM 25 HA LEU A 383 -0.637 16.611 39.815 1.00 0.00 H ATOM 26 HB2 LEU A 383 -0.767 15.697 36.937 1.00 0.00 H ATOM 27 HB3 LEU A 383 0.195 14.884 38.193 1.00 0.00 H ATOM 28 HG LEU A 383 -2.805 15.236 38.323 1.00 0.00 H ATOM 29 HD21 LEU A 383 -0.894 13.484 39.887 1.00 0.00 H ATOM 30 HD22 LEU A 383 -1.737 14.932 40.489 1.00 0.00 H ATOM 31 HD23 LEU A 383 -2.669 13.486 40.031 1.00 0.00 H ATOM 32 HD11 LEU A 383 -2.172 13.872 36.386 1.00 0.00 H ATOM 33 HD12 LEU A 383 -1.137 12.863 37.425 1.00 0.00 H ATOM 34 HD13 LEU A 383 -2.902 12.863 37.658 1.00 0.00 H ATOM 35 H LEU A 383 -2.171 17.541 37.510 1.00 0.00 H ATOM 36 N GLY A 384 0.856 18.277 37.454 1.00 19.19 N ATOM 37 CA GLY A 384 2.093 18.906 37.034 1.00 21.83 C ATOM 38 C GLY A 384 2.310 18.756 35.542 1.00 14.59 C ATOM 39 O GLY A 384 1.673 17.927 34.895 1.00 15.13 O ATOM 40 HA3 GLY A 384 2.925 18.441 37.562 1.00 0.00 H ATOM 41 HA2 GLY A 384 2.054 19.967 37.282 1.00 0.00 H ATOM 42 H GLY A 384 -0.025 18.519 36.957 1.00 0.00 H ATOM 43 N ALA A 385 3.218 19.564 35.009 1.00 19.64 N ATOM 44 CA ALA A 385 3.586 19.500 33.599 1.00 17.83 C ATOM 45 C ALA A 385 5.020 19.009 33.475 1.00 20.30 C ATOM 46 O ALA A 385 5.845 19.292 34.342 1.00 17.50 O ATOM 47 CB ALA A 385 3.424 20.861 32.947 1.00 19.72 C ATOM 48 HA ALA A 385 2.926 18.802 33.084 1.00 0.00 H ATOM 49 HB1 ALA A 385 2.385 21.180 33.029 1.00 0.00 H ATOM 50 HB2 ALA A 385 4.068 21.582 33.450 1.00 0.00 H ATOM 51 HB3 ALA A 385 3.703 20.794 31.895 1.00 0.00 H ATOM 52 H ALA A 385 3.683 20.267 35.618 1.00 0.00 H ATOM 53 N LEU A 386 5.310 18.268 32.406 1.00 14.72 N ATOM 54 CA LEU A 386 6.655 17.750 32.173 1.00 14.02 C ATOM 55 C LEU A 386 7.187 18.203 30.819 1.00 14.65 C ATOM 56 O LEU A 386 6.478 18.173 29.816 1.00 17.49 O ATOM 57 CB LEU A 386 6.672 16.221 32.251 1.00 16.54 C ATOM 58 CG LEU A 386 8.048 15.566 32.080 1.00 16.23 C ATOM 59 CD1 LEU A 386 8.916 15.774 33.318 1.00 21.23 C ATOM 60 CD2 LEU A 386 7.907 14.084 31.757 1.00 15.15 C ATOM 61 HA LEU A 386 7.301 18.149 32.954 1.00 0.00 H ATOM 62 HB2 LEU A 386 6.280 15.930 33.226 1.00 0.00 H ATOM 63 HB3 LEU A 386 6.018 15.837 31.468 1.00 0.00 H ATOM 64 HG LEU A 386 8.546 16.050 31.240 1.00 0.00 H ATOM 65 HD21 LEU A 386 7.379 13.585 32.569 1.00 0.00 H ATOM 66 HD22 LEU A 386 7.345 13.967 30.831 1.00 0.00 H ATOM 67 HD23 LEU A 386 8.897 13.643 31.641 1.00 0.00 H ATOM 68 HD11 LEU A 386 9.057 16.842 33.486 1.00 0.00 H ATOM 69 HD12 LEU A 386 8.424 15.330 34.184 1.00 0.00 H ATOM 70 HD13 LEU A 386 9.885 15.298 33.165 1.00 0.00 H ATOM 71 H LEU A 386 4.559 18.053 31.720 1.00 0.00 H ATOM 72 N GLU A 387 8.447 18.616 30.815 1.00 13.73 N ATOM 73 CA GLU A 387 9.118 19.076 29.610 1.00 19.74 C ATOM 74 C GLU A 387 10.161 18.039 29.203 1.00 12.84 C ATOM 75 O GLU A 387 10.969 17.627 30.026 1.00 11.29 O ATOM 76 CB GLU A 387 9.762 20.436 29.880 1.00 21.39 C ATOM 77 CG GLU A 387 9.887 21.365 28.697 1.00 30.56 C ATOM 78 CD GLU A 387 10.273 22.767 29.133 1.00 27.44 C ATOM 79 OE1 GLU A 387 11.481 23.074 29.140 1.00 27.31 O ATOM 80 OE2 GLU A 387 9.370 23.554 29.486 1.00 35.93 O ATOM 81 HA GLU A 387 8.406 19.194 28.793 1.00 0.00 H ATOM 82 HB2 GLU A 387 9.164 20.942 30.638 1.00 0.00 H ATOM 83 HB3 GLU A 387 10.764 20.257 30.269 1.00 0.00 H ATOM 84 HG2 GLU A 387 10.652 20.980 28.022 1.00 0.00 H ATOM 85 HG3 GLU A 387 8.931 21.406 28.175 1.00 0.00 H ATOM 86 H GLU A 387 8.977 18.611 31.710 1.00 0.00 H ATOM 87 N PHE A 388 10.145 17.597 27.948 1.00 12.91 N ATOM 88 CA PHE A 388 11.191 16.697 27.480 1.00 10.75 C ATOM 89 C PHE A 388 11.368 16.759 25.968 1.00 13.07 C ATOM 90 O PHE A 388 10.551 17.346 25.252 1.00 12.82 O ATOM 91 CB PHE A 388 10.912 15.254 27.929 1.00 8.21 C ATOM 92 CG PHE A 388 9.628 14.675 27.408 1.00 11.61 C ATOM 93 CD1 PHE A 388 8.420 14.944 28.034 1.00 16.48 C ATOM 94 CD2 PHE A 388 9.630 13.838 26.302 1.00 14.95 C ATOM 95 CE1 PHE A 388 7.241 14.403 27.558 1.00 21.22 C ATOM 96 CE2 PHE A 388 8.455 13.293 25.825 1.00 17.27 C ATOM 97 CZ PHE A 388 7.259 13.576 26.454 1.00 18.47 C ATOM 98 HA PHE A 388 12.125 17.032 27.932 1.00 0.00 H ATOM 99 HB2 PHE A 388 11.733 14.626 27.585 1.00 0.00 H ATOM 100 HB3 PHE A 388 10.876 15.237 29.018 1.00 0.00 H ATOM 101 HD2 PHE A 388 10.571 13.608 25.803 1.00 0.00 H ATOM 102 HE2 PHE A 388 8.471 12.640 24.953 1.00 0.00 H ATOM 103 HZ PHE A 388 6.330 13.147 26.079 1.00 0.00 H ATOM 104 HE1 PHE A 388 6.297 14.630 28.054 1.00 0.00 H ATOM 105 HD1 PHE A 388 8.400 15.590 28.912 1.00 0.00 H ATOM 106 H PHE A 388 9.386 17.894 27.302 1.00 0.00 H ATOM 107 N SER A 389 12.460 16.162 25.503 1.00 15.56 N ATOM 108 CA SER A 389 12.816 16.174 24.085 1.00 13.28 C ATOM 109 C SER A 389 13.299 14.796 23.650 1.00 18.14 C ATOM 110 O SER A 389 14.089 14.157 24.349 1.00 14.96 O ATOM 111 CB SER A 389 13.897 17.223 23.812 1.00 17.10 C ATOM 112 OG SER A 389 14.085 17.416 22.417 1.00 20.49 O ATOM 113 HA SER A 389 11.928 16.433 23.509 1.00 0.00 H ATOM 114 HB2 SER A 389 14.836 16.890 24.255 1.00 0.00 H ATOM 115 HB3 SER A 389 13.598 18.168 24.265 1.00 0.00 H ATOM 116 HG SER A 389 13.236 17.723 22.010 1.00 0.00 H ATOM 117 H SER A 389 13.084 15.668 26.172 1.00 0.00 H ATOM 118 N LEU A 390 12.825 14.342 22.491 1.00 14.44 N ATOM 119 CA LEU A 390 13.211 13.040 21.962 1.00 10.06 C ATOM 120 C LEU A 390 13.916 13.198 20.620 1.00 16.79 C ATOM 121 O LEU A 390 13.570 14.074 19.828 1.00 11.58 O ATOM 122 CB LEU A 390 11.991 12.132 21.800 1.00 10.99 C ATOM 123 CG LEU A 390 11.126 11.857 23.031 1.00 18.82 C ATOM 124 CD1 LEU A 390 9.940 10.994 22.636 1.00 15.24 C ATOM 125 CD2 LEU A 390 11.934 11.192 24.134 1.00 16.27 C ATOM 126 HA LEU A 390 13.896 12.579 22.674 1.00 0.00 H ATOM 127 HB2 LEU A 390 11.347 12.587 21.047 1.00 0.00 H ATOM 128 HB3 LEU A 390 12.350 11.170 21.436 1.00 0.00 H ATOM 129 HG LEU A 390 10.762 12.807 23.422 1.00 0.00 H ATOM 130 HD21 LEU A 390 12.333 10.245 23.770 1.00 0.00 H ATOM 131 HD22 LEU A 390 12.756 11.846 24.425 1.00 0.00 H ATOM 132 HD23 LEU A 390 11.290 11.010 24.995 1.00 0.00 H ATOM 133 HD11 LEU A 390 9.347 11.515 21.884 1.00 0.00 H ATOM 134 HD12 LEU A 390 10.300 10.050 22.226 1.00 0.00 H ATOM 135 HD13 LEU A 390 9.325 10.799 23.515 1.00 0.00 H ATOM 136 H LEU A 390 12.162 14.932 21.949 1.00 0.00 H ATOM 137 N LEU A 391 14.909 12.349 20.385 1.00 15.37 N ATOM 138 CA LEU A 391 15.629 12.311 19.116 1.00 15.57 C ATOM 139 C LEU A 391 16.051 10.883 18.811 1.00 15.98 C ATOM 140 O LEU A 391 16.758 10.260 19.603 1.00 14.94 O ATOM 141 CB LEU A 391 16.858 13.218 19.154 1.00 15.47 C ATOM 142 CG LEU A 391 17.788 13.130 17.938 1.00 21.30 C ATOM 143 CD1 LEU A 391 17.079 13.614 16.685 1.00 22.01 C ATOM 144 CD2 LEU A 391 19.064 13.917 18.173 1.00 24.42 C ATOM 145 HA LEU A 391 14.964 12.673 18.332 1.00 0.00 H ATOM 146 HB2 LEU A 391 16.512 14.248 19.237 1.00 0.00 H ATOM 147 HB3 LEU A 391 17.439 12.959 20.039 1.00 0.00 H ATOM 148 HG LEU A 391 18.060 12.084 17.794 1.00 0.00 H ATOM 149 HD21 LEU A 391 18.816 14.964 18.350 1.00 0.00 H ATOM 150 HD22 LEU A 391 19.584 13.513 19.042 1.00 0.00 H ATOM 151 HD23 LEU A 391 19.705 13.838 17.295 1.00 0.00 H ATOM 152 HD11 LEU A 391 16.201 12.994 16.504 1.00 0.00 H ATOM 153 HD12 LEU A 391 16.772 14.651 16.820 1.00 0.00 H ATOM 154 HD13 LEU A 391 17.757 13.543 15.835 1.00 0.00 H ATOM 155 H LEU A 391 15.185 11.684 21.135 1.00 0.00 H ATOM 156 N TYR A 392 15.624 10.366 17.663 1.00 16.72 N ATOM 157 CA TYR A 392 16.056 9.045 17.234 1.00 19.50 C ATOM 158 C TYR A 392 17.188 9.165 16.231 1.00 20.21 C ATOM 159 O TYR A 392 16.958 9.443 15.056 1.00 17.15 O ATOM 160 CB TYR A 392 14.904 8.249 16.623 1.00 15.79 C ATOM 161 CG TYR A 392 15.301 6.841 16.234 1.00 21.25 C ATOM 162 CD1 TYR A 392 16.120 6.078 17.058 1.00 16.34 C ATOM 163 CD2 TYR A 392 14.858 6.273 15.049 1.00 17.90 C ATOM 164 CE1 TYR A 392 16.486 4.796 16.715 1.00 15.08 C ATOM 165 CE2 TYR A 392 15.219 4.988 14.696 1.00 22.45 C ATOM 166 CZ TYR A 392 16.032 4.252 15.534 1.00 20.11 C ATOM 167 OH TYR A 392 16.397 2.970 15.189 1.00 17.67 O ATOM 168 HA TYR A 392 16.407 8.508 18.116 1.00 0.00 H ATOM 169 HB3 TYR A 392 14.555 8.771 15.732 1.00 0.00 H ATOM 170 HB2 TYR A 392 14.095 8.194 17.351 1.00 0.00 H ATOM 171 HD2 TYR A 392 14.214 6.850 14.385 1.00 0.00 H ATOM 172 HE2 TYR A 392 14.864 4.557 13.760 1.00 0.00 H ATOM 173 HE1 TYR A 392 17.131 4.215 17.374 1.00 0.00 H ATOM 174 HD1 TYR A 392 16.480 6.503 17.995 1.00 0.00 H ATOM 175 HH TYR A 392 16.976 2.591 15.897 1.00 0.00 H ATOM 176 H TYR A 392 14.973 10.913 17.064 1.00 0.00 H ATOM 177 N ASP A 393 18.409 8.963 16.712 1.00 21.40 N ATOM 178 CA ASP A 393 19.583 8.932 15.855 1.00 20.61 C ATOM 179 C ASP A 393 19.635 7.562 15.186 1.00 19.34 C ATOM 180 O ASP A 393 20.368 6.668 15.608 1.00 14.94 O ATOM 181 CB ASP A 393 20.849 9.218 16.668 1.00 17.41 C ATOM 182 CG ASP A 393 22.101 9.257 15.816 1.00 19.99 C ATOM 183 OD1 ASP A 393 21.992 9.434 14.585 1.00 27.39 O ATOM 184 OD2 ASP A 393 23.200 9.119 16.387 1.00 20.98 O ATOM 185 HA ASP A 393 19.523 9.706 15.090 1.00 0.00 H ATOM 186 HB2 ASP A 393 20.734 10.183 17.163 1.00 0.00 H ATOM 187 HB3 ASP A 393 20.964 8.437 17.420 1.00 0.00 H ATOM 188 H ASP A 393 18.530 8.822 17.735 1.00 0.00 H ATOM 189 N GLN A 394 18.836 7.423 14.133 1.00 22.85 N ATOM 190 CA GLN A 394 18.568 6.141 13.498 1.00 17.00 C ATOM 191 C GLN A 394 19.820 5.383 13.075 1.00 21.31 C ATOM 192 O GLN A 394 19.929 4.180 13.318 1.00 18.66 O ATOM 193 CB GLN A 394 17.670 6.363 12.281 1.00 17.30 C ATOM 194 CG GLN A 394 17.194 5.098 11.599 1.00 21.07 C ATOM 195 CD GLN A 394 16.336 5.402 10.393 1.00 24.02 C ATOM 196 OE1 GLN A 394 16.682 6.255 9.578 1.00 23.29 O ATOM 197 NE2 GLN A 394 15.202 4.720 10.280 1.00 29.88 N ATOM 198 HA GLN A 394 18.076 5.520 14.247 1.00 0.00 H ATOM 199 HB2 GLN A 394 16.793 6.924 12.605 1.00 0.00 H ATOM 200 HB3 GLN A 394 18.227 6.952 11.552 1.00 0.00 H ATOM 201 HG2 GLN A 394 18.062 4.521 11.279 1.00 0.00 H ATOM 202 HG3 GLN A 394 16.611 4.512 12.309 1.00 0.00 H ATOM 203 HE22 GLN A 394 14.950 4.007 10.994 1.00 0.00 H ATOM 204 HE21 GLN A 394 14.566 4.899 9.477 1.00 0.00 H ATOM 205 H GLN A 394 18.380 8.272 13.743 1.00 0.00 H ATOM 206 N ASP A 395 20.758 6.081 12.441 1.00 19.56 N ATOM 207 CA ASP A 395 21.947 5.440 11.888 1.00 19.21 C ATOM 208 C ASP A 395 22.826 4.844 12.982 1.00 19.45 C ATOM 209 O ASP A 395 23.649 3.977 12.710 1.00 18.51 O ATOM 210 CB ASP A 395 22.764 6.436 11.053 1.00 19.69 C ATOM 211 CG ASP A 395 22.116 6.755 9.713 1.00 23.03 C ATOM 212 OD1 ASP A 395 21.148 6.067 9.326 1.00 27.99 O ATOM 213 OD2 ASP A 395 22.584 7.696 9.037 1.00 27.98 O ATOM 214 HA ASP A 395 21.605 4.629 11.245 1.00 0.00 H ATOM 215 HB2 ASP A 395 22.868 7.362 11.619 1.00 0.00 H ATOM 216 HB3 ASP A 395 23.751 6.010 10.870 1.00 0.00 H ATOM 217 H ASP A 395 20.641 7.109 12.337 1.00 0.00 H ATOM 218 N ASN A 396 22.642 5.305 14.215 1.00 20.81 N ATOM 219 CA ASN A 396 23.404 4.793 15.348 1.00 13.44 C ATOM 220 C ASN A 396 22.532 4.010 16.333 1.00 13.90 C ATOM 221 O ASN A 396 22.967 3.702 17.448 1.00 11.81 O ATOM 222 CB ASN A 396 24.108 5.946 16.068 1.00 18.32 C ATOM 223 CG ASN A 396 25.204 6.573 15.228 1.00 22.00 C ATOM 224 OD1 ASN A 396 26.099 5.881 14.741 1.00 22.97 O ATOM 225 ND2 ASN A 396 25.133 7.884 15.041 1.00 28.41 N ATOM 226 HA ASN A 396 24.145 4.098 14.953 1.00 0.00 H ATOM 227 HB2 ASN A 396 23.370 6.711 16.308 1.00 0.00 H ATOM 228 HB3 ASN A 396 24.548 5.566 16.990 1.00 0.00 H ATOM 229 HD22 ASN A 396 24.359 8.430 15.471 1.00 0.00 H ATOM 230 HD21 ASN A 396 25.851 8.367 14.464 1.00 0.00 H ATOM 231 H ASN A 396 21.936 6.051 14.376 1.00 0.00 H ATOM 232 N SER A 397 21.316 3.681 15.903 1.00 13.20 N ATOM 233 CA SER A 397 20.389 2.866 16.687 1.00 15.69 C ATOM 234 C SER A 397 20.231 3.411 18.097 1.00 14.17 C ATOM 235 O SER A 397 20.216 2.651 19.062 1.00 16.04 O ATOM 236 CB SER A 397 20.869 1.414 16.742 1.00 17.04 C ATOM 237 OG SER A 397 20.915 0.838 15.448 1.00 19.88 O ATOM 238 HA SER A 397 19.417 2.904 16.195 1.00 0.00 H ATOM 239 HB2 SER A 397 20.185 0.837 17.364 1.00 0.00 H ATOM 240 HB3 SER A 397 21.867 1.386 17.179 1.00 0.00 H ATOM 241 HG SER A 397 21.228 -0.099 15.516 1.00 0.00 H ATOM 242 H SER A 397 21.012 4.019 14.968 1.00 0.00 H ATOM 243 N ASN A 398 20.105 4.730 18.201 1.00 18.60 N ATOM 244 CA ASN A 398 20.158 5.409 19.489 1.00 16.85 C ATOM 245 C ASN A 398 18.966 6.339 19.707 1.00 15.65 C ATOM 246 O ASN A 398 18.746 7.279 18.941 1.00 13.30 O ATOM 247 CB ASN A 398 21.476 6.181 19.592 1.00 16.09 C ATOM 248 CG ASN A 398 21.627 6.935 20.900 1.00 21.96 C ATOM 249 OD1 ASN A 398 22.231 8.005 20.936 1.00 27.38 O ATOM 250 ND2 ASN A 398 21.087 6.381 21.980 1.00 22.48 N ATOM 251 HA ASN A 398 20.107 4.655 20.274 1.00 0.00 H ATOM 252 HB2 ASN A 398 22.300 5.473 19.503 1.00 0.00 H ATOM 253 HB3 ASN A 398 21.523 6.897 18.772 1.00 0.00 H ATOM 254 HD22 ASN A 398 20.584 5.474 21.903 1.00 0.00 H ATOM 255 HD21 ASN A 398 21.167 6.855 22.902 1.00 0.00 H ATOM 256 H ASN A 398 19.965 5.294 17.338 1.00 0.00 H ATOM 257 N LEU A 399 18.192 6.059 20.753 1.00 15.08 N ATOM 258 CA LEU A 399 17.062 6.904 21.126 1.00 12.44 C ATOM 259 C LEU A 399 17.434 7.754 22.334 1.00 18.02 C ATOM 260 O LEU A 399 17.647 7.232 23.429 1.00 16.11 O ATOM 261 CB LEU A 399 15.823 6.058 21.426 1.00 12.85 C ATOM 262 CG LEU A 399 14.575 6.823 21.882 1.00 16.36 C ATOM 263 CD1 LEU A 399 14.074 7.763 20.792 1.00 20.35 C ATOM 264 CD2 LEU A 399 13.480 5.860 22.304 1.00 18.52 C ATOM 265 HA LEU A 399 16.824 7.559 20.288 1.00 0.00 H ATOM 266 HB2 LEU A 399 15.565 5.512 20.519 1.00 0.00 H ATOM 267 HB3 LEU A 399 16.086 5.350 22.213 1.00 0.00 H ATOM 268 HG LEU A 399 14.852 7.429 22.744 1.00 0.00 H ATOM 269 HD21 LEU A 399 13.215 5.222 21.461 1.00 0.00 H ATOM 270 HD22 LEU A 399 13.838 5.244 23.129 1.00 0.00 H ATOM 271 HD23 LEU A 399 12.604 6.425 22.624 1.00 0.00 H ATOM 272 HD11 LEU A 399 14.854 8.484 20.549 1.00 0.00 H ATOM 273 HD12 LEU A 399 13.822 7.185 19.903 1.00 0.00 H ATOM 274 HD13 LEU A 399 13.188 8.290 21.147 1.00 0.00 H ATOM 275 H LEU A 399 18.399 5.213 21.321 1.00 0.00 H ATOM 276 N GLN A 400 17.512 9.063 22.119 1.00 17.54 N ATOM 277 CA GLN A 400 17.946 10.000 23.149 1.00 21.31 C ATOM 278 C GLN A 400 16.749 10.724 23.753 1.00 18.66 C ATOM 279 O GLN A 400 16.014 11.423 23.056 1.00 14.63 O ATOM 280 CB GLN A 400 18.945 11.004 22.565 1.00 20.02 C ATOM 281 CG GLN A 400 20.138 10.338 21.885 1.00 25.14 C ATOM 282 CD GLN A 400 21.145 11.331 21.335 1.00 30.33 C ATOM 283 OE1 GLN A 400 20.846 12.513 21.169 1.00 30.95 O ATOM 284 NE2 GLN A 400 22.350 10.851 21.050 1.00 36.32 N ATOM 285 HA GLN A 400 18.441 9.440 23.942 1.00 0.00 H ATOM 286 HB2 GLN A 400 18.427 11.621 21.831 1.00 0.00 H ATOM 287 HB3 GLN A 400 19.314 11.636 23.373 1.00 0.00 H ATOM 288 HG2 GLN A 400 20.641 9.702 22.613 1.00 0.00 H ATOM 289 HG3 GLN A 400 19.770 9.726 21.062 1.00 0.00 H ATOM 290 HE22 GLN A 400 22.559 9.844 21.206 1.00 0.00 H ATOM 291 HE21 GLN A 400 23.085 11.482 20.671 1.00 0.00 H ATOM 292 H GLN A 400 17.254 9.433 21.182 1.00 0.00 H ATOM 293 N CYS A 401 16.566 10.544 25.056 1.00 14.35 N ATOM 294 CA CYS A 401 15.428 11.102 25.772 1.00 13.67 C ATOM 295 C CYS A 401 15.903 12.121 26.797 1.00 15.54 C ATOM 296 O CYS A 401 16.416 11.751 27.855 1.00 14.67 O ATOM 297 CB CYS A 401 14.640 9.992 26.466 1.00 14.53 C ATOM 298 SG CYS A 401 14.291 8.567 25.414 1.00 22.35 S ATOM 299 HA CYS A 401 14.775 11.599 25.054 1.00 0.00 H ATOM 300 HB2 CYS A 401 13.691 10.407 26.807 1.00 0.00 H ATOM 301 HB3 CYS A 401 15.215 9.650 27.326 1.00 0.00 H ATOM 302 HG CYS A 401 13.580 7.629 26.134 1.00 0.00 H ATOM 303 H CYS A 401 17.263 9.982 25.586 1.00 0.00 H ATOM 304 N THR A 402 15.746 13.402 26.475 1.00 17.14 N ATOM 305 CA THR A 402 16.175 14.466 27.371 1.00 11.82 C ATOM 306 C THR A 402 15.036 14.842 28.305 1.00 14.02 C ATOM 307 O THR A 402 14.016 15.383 27.882 1.00 14.24 O ATOM 308 CB THR A 402 16.652 15.711 26.601 1.00 16.88 C ATOM 309 OG1 THR A 402 17.740 15.352 25.739 1.00 14.05 O ATOM 310 CG2 THR A 402 17.120 16.796 27.567 1.00 18.49 C ATOM 311 HA THR A 402 17.020 14.092 27.948 1.00 0.00 H ATOM 312 HB THR A 402 15.818 16.095 26.014 1.00 0.00 H ATOM 313 HG1 THR A 402 17.437 14.662 25.097 1.00 0.00 H ATOM 314 HG23 THR A 402 16.297 17.074 28.226 1.00 0.00 H ATOM 315 HG21 THR A 402 17.951 16.417 28.162 1.00 0.00 H ATOM 316 HG22 THR A 402 17.445 17.669 27.001 1.00 0.00 H ATOM 317 H THR A 402 15.308 13.648 25.565 1.00 0.00 H ATOM 318 N ILE A 403 15.221 14.529 29.580 1.00 11.38 N ATOM 319 CA ILE A 403 14.265 14.885 30.613 1.00 12.41 C ATOM 320 C ILE A 403 14.672 16.253 31.148 1.00 10.24 C ATOM 321 O ILE A 403 15.694 16.387 31.812 1.00 10.03 O ATOM 322 CB ILE A 403 14.243 13.823 31.736 1.00 11.81 C ATOM 323 CG1 ILE A 403 13.965 12.435 31.149 1.00 13.26 C ATOM 324 CG2 ILE A 403 13.222 14.170 32.799 1.00 15.66 C ATOM 325 CD1 ILE A 403 12.660 12.329 30.369 1.00 13.04 C ATOM 326 HA ILE A 403 13.254 14.924 30.207 1.00 0.00 H ATOM 327 HB ILE A 403 15.224 13.811 32.211 1.00 0.00 H ATOM 328 HG12 ILE A 403 14.785 12.178 30.478 1.00 0.00 H ATOM 329 HG13 ILE A 403 13.931 11.718 31.970 1.00 0.00 H ATOM 330 HD11 ILE A 403 11.825 12.569 31.027 1.00 0.00 H ATOM 331 HD12 ILE A 403 12.679 13.029 29.534 1.00 0.00 H ATOM 332 HD13 ILE A 403 12.546 11.313 29.991 1.00 0.00 H ATOM 333 HG21 ILE A 403 13.471 15.136 33.238 1.00 0.00 H ATOM 334 HG22 ILE A 403 12.231 14.219 32.347 1.00 0.00 H ATOM 335 HG23 ILE A 403 13.232 13.404 33.574 1.00 0.00 H ATOM 336 H ILE A 403 16.081 14.010 29.850 1.00 0.00 H ATOM 337 N ILE A 404 13.877 17.271 30.841 1.00 12.78 N ATOM 338 CA ILE A 404 14.290 18.652 31.072 1.00 11.19 C ATOM 339 C ILE A 404 13.846 19.161 32.447 1.00 11.31 C ATOM 340 O ILE A 404 14.673 19.366 33.336 1.00 11.56 O ATOM 341 CB ILE A 404 13.740 19.575 29.960 1.00 12.52 C ATOM 342 CG1 ILE A 404 14.225 19.073 28.592 1.00 15.48 C ATOM 343 CG2 ILE A 404 14.184 21.014 30.183 1.00 19.11 C ATOM 344 CD1 ILE A 404 13.607 19.768 27.401 1.00 16.20 C ATOM 345 HA ILE A 404 15.380 18.672 31.048 1.00 0.00 H ATOM 346 HB ILE A 404 12.651 19.551 29.988 1.00 0.00 H ATOM 347 HG12 ILE A 404 15.305 19.214 28.543 1.00 0.00 H ATOM 348 HG13 ILE A 404 13.995 18.010 28.521 1.00 0.00 H ATOM 349 HD11 ILE A 404 12.526 19.628 27.421 1.00 0.00 H ATOM 350 HD12 ILE A 404 13.837 20.833 27.443 1.00 0.00 H ATOM 351 HD13 ILE A 404 14.013 19.343 26.483 1.00 0.00 H ATOM 352 HG21 ILE A 404 13.811 21.363 31.146 1.00 0.00 H ATOM 353 HG22 ILE A 404 15.273 21.062 30.174 1.00 0.00 H ATOM 354 HG23 ILE A 404 13.784 21.644 29.388 1.00 0.00 H ATOM 355 H ILE A 404 12.942 17.081 30.428 1.00 0.00 H ATOM 356 N ARG A 405 12.545 19.361 32.615 1.00 15.06 N ATOM 357 CA ARG A 405 12.014 19.905 33.858 1.00 14.82 C ATOM 358 C ARG A 405 10.570 19.484 34.076 1.00 16.64 C ATOM 359 O ARG A 405 9.898 19.032 33.154 1.00 12.44 O ATOM 360 CB ARG A 405 12.097 21.432 33.846 1.00 13.99 C ATOM 361 CG ARG A 405 11.073 22.081 32.926 1.00 18.97 C ATOM 362 CD ARG A 405 11.343 23.559 32.723 1.00 19.35 C ATOM 363 NE ARG A 405 11.475 24.278 33.987 1.00 15.56 N ATOM 364 CZ ARG A 405 11.745 25.577 34.081 1.00 28.63 C ATOM 365 NH1 ARG A 405 11.914 26.306 32.985 1.00 24.71 N ATOM 366 NH2 ARG A 405 11.849 26.149 35.272 1.00 22.21 N ATOM 367 HA ARG A 405 12.618 19.509 34.674 1.00 0.00 H ATOM 368 HB2 ARG A 405 11.932 21.796 34.860 1.00 0.00 H ATOM 369 HB3 ARG A 405 13.094 21.722 33.515 1.00 0.00 H ATOM 370 HG2 ARG A 405 11.104 21.582 31.958 1.00 0.00 H ATOM 371 HG3 ARG A 405 10.082 21.961 33.363 1.00 0.00 H ATOM 372 HD2 ARG A 405 10.518 23.992 32.158 1.00 0.00 H ATOM 373 HD3 ARG A 405 12.268 23.672 32.157 1.00 0.00 H ATOM 374 HE ARG A 405 11.350 23.741 34.869 1.00 0.00 H ATOM 375 HH12 ARG A 405 12.125 27.321 33.063 1.00 0.00 H ATOM 376 HH11 ARG A 405 11.835 25.862 32.048 1.00 0.00 H ATOM 377 HH22 ARG A 405 12.060 27.165 35.344 1.00 0.00 H ATOM 378 HH21 ARG A 405 11.719 25.582 36.134 1.00 0.00 H ATOM 379 H ARG A 405 11.890 19.124 31.843 1.00 0.00 H ATOM 380 N ALA A 406 10.095 19.649 35.306 1.00 11.67 N ATOM 381 CA ALA A 406 8.673 19.546 35.589 1.00 15.73 C ATOM 382 C ALA A 406 8.250 20.745 36.426 1.00 14.47 C ATOM 383 O ALA A 406 9.060 21.309 37.167 1.00 16.38 O ATOM 384 CB ALA A 406 8.350 18.241 36.299 1.00 16.36 C ATOM 385 HA ALA A 406 8.117 19.546 34.652 1.00 0.00 H ATOM 386 HB1 ALA A 406 8.642 17.403 35.666 1.00 0.00 H ATOM 387 HB2 ALA A 406 8.898 18.196 37.240 1.00 0.00 H ATOM 388 HB3 ALA A 406 7.279 18.192 36.498 1.00 0.00 H ATOM 389 H ALA A 406 10.755 19.856 36.083 1.00 0.00 H ATOM 390 N LYS A 407 6.988 21.139 36.290 1.00 15.85 N ATOM 391 CA LYS A 407 6.464 22.304 36.996 1.00 21.95 C ATOM 392 C LYS A 407 5.183 21.975 37.749 1.00 17.03 C ATOM 393 O LYS A 407 4.284 21.323 37.215 1.00 19.51 O ATOM 394 CB LYS A 407 6.201 23.452 36.018 1.00 18.90 C ATOM 395 CG LYS A 407 7.453 24.109 35.469 1.00 19.67 C ATOM 396 CD LYS A 407 7.098 25.276 34.554 1.00 27.40 C ATOM 397 CE LYS A 407 8.334 25.853 33.882 1.00 34.53 C ATOM 398 NZ LYS A 407 8.048 27.141 33.193 1.00 33.88 N ATOM 399 HA LYS A 407 7.219 22.609 37.720 1.00 0.00 H ATOM 400 HB2 LYS A 407 5.626 23.060 35.179 1.00 0.00 H ATOM 401 HB3 LYS A 407 5.615 24.213 36.535 1.00 0.00 H ATOM 402 HG2 LYS A 407 8.057 24.476 36.299 1.00 0.00 H ATOM 403 HG3 LYS A 407 8.024 23.373 34.904 1.00 0.00 H ATOM 404 HD2 LYS A 407 6.407 24.927 33.786 1.00 0.00 H ATOM 405 HD3 LYS A 407 6.619 26.057 35.145 1.00 0.00 H ATOM 406 HE2 LYS A 407 8.702 25.136 33.148 1.00 0.00 H ATOM 407 HE3 LYS A 407 9.100 26.022 34.639 1.00 0.00 H ATOM 408 HZ1 LYS A 407 7.323 26.989 32.463 1.00 0.00 H ATOM 409 HZ2 LYS A 407 7.703 27.835 33.887 1.00 0.00 H ATOM 410 HZ3 LYS A 407 8.919 27.497 32.750 1.00 0.00 H ATOM 411 H LYS A 407 6.356 20.602 35.663 1.00 0.00 H ATOM 412 N GLY A 408 5.110 22.436 38.992 1.00 21.23 N ATOM 413 CA GLY A 408 3.912 22.297 39.797 1.00 18.67 C ATOM 414 C GLY A 408 3.524 20.861 40.095 1.00 20.30 C ATOM 415 O GLY A 408 2.357 20.492 39.950 1.00 16.35 O ATOM 416 HA3 GLY A 408 3.086 22.771 39.266 1.00 0.00 H ATOM 417 HA2 GLY A 408 4.075 22.811 40.744 1.00 0.00 H ATOM 418 H GLY A 408 5.939 22.912 39.402 1.00 0.00 H ATOM 419 N LEU A 409 4.491 20.048 40.512 1.00 17.37 N ATOM 420 CA LEU A 409 4.205 18.672 40.902 1.00 18.23 C ATOM 421 C LEU A 409 3.305 18.671 42.136 1.00 20.16 C ATOM 422 O LEU A 409 3.543 19.413 43.084 1.00 20.58 O ATOM 423 CB LEU A 409 5.496 17.898 41.179 1.00 14.33 C ATOM 424 CG LEU A 409 6.449 17.703 39.993 1.00 16.24 C ATOM 425 CD1 LEU A 409 7.676 16.913 40.422 1.00 23.31 C ATOM 426 CD2 LEU A 409 5.751 17.011 38.831 1.00 14.10 C ATOM 427 HA LEU A 409 3.692 18.174 40.080 1.00 0.00 H ATOM 428 HB2 LEU A 409 6.041 18.432 41.957 1.00 0.00 H ATOM 429 HB3 LEU A 409 5.217 16.910 41.545 1.00 0.00 H ATOM 430 HG LEU A 409 6.767 18.689 39.653 1.00 0.00 H ATOM 431 HD21 LEU A 409 5.393 16.033 39.154 1.00 0.00 H ATOM 432 HD22 LEU A 409 4.907 17.618 38.503 1.00 0.00 H ATOM 433 HD23 LEU A 409 6.454 16.888 38.007 1.00 0.00 H ATOM 434 HD11 LEU A 409 8.197 17.454 41.211 1.00 0.00 H ATOM 435 HD12 LEU A 409 7.366 15.936 40.793 1.00 0.00 H ATOM 436 HD13 LEU A 409 8.341 16.784 39.568 1.00 0.00 H ATOM 437 H LEU A 409 5.468 20.400 40.561 1.00 0.00 H ATOM 438 N LYS A 410 2.274 17.833 42.115 1.00 23.96 N ATOM 439 CA LYS A 410 1.268 17.826 43.174 1.00 23.79 C ATOM 440 C LYS A 410 1.783 17.208 44.472 1.00 22.95 C ATOM 441 O LYS A 410 2.290 16.090 44.461 1.00 19.99 O ATOM 442 CB LYS A 410 0.026 17.062 42.712 1.00 21.62 C ATOM 443 CG LYS A 410 -1.116 17.101 43.711 1.00 25.57 C ATOM 444 CD LYS A 410 -2.251 16.183 43.304 1.00 27.53 C ATOM 445 CE LYS A 410 -3.422 16.316 44.259 1.00 30.06 C ATOM 446 NZ LYS A 410 -3.969 17.699 44.251 1.00 30.24 N ATOM 447 HA LYS A 410 1.020 18.867 43.379 1.00 0.00 H ATOM 448 HB2 LYS A 410 -0.320 17.499 41.775 1.00 0.00 H ATOM 449 HB3 LYS A 410 0.303 16.021 42.545 1.00 0.00 H ATOM 450 HG2 LYS A 410 -0.743 16.790 44.687 1.00 0.00 H ATOM 451 HG3 LYS A 410 -1.493 18.122 43.776 1.00 0.00 H ATOM 452 HD2 LYS A 410 -2.579 16.444 42.298 1.00 0.00 H ATOM 453 HD3 LYS A 410 -1.898 15.152 43.313 1.00 0.00 H ATOM 454 HE2 LYS A 410 -3.088 16.071 45.267 1.00 0.00 H ATOM 455 HE3 LYS A 410 -4.207 15.621 43.959 1.00 0.00 H ATOM 456 HZ1 LYS A 410 -3.226 18.366 44.542 1.00 0.00 H ATOM 457 HZ2 LYS A 410 -4.294 17.936 43.292 1.00 0.00 H ATOM 458 HZ3 LYS A 410 -4.768 17.758 44.914 1.00 0.00 H ATOM 459 H LYS A 410 2.181 17.165 41.324 1.00 0.00 H ATOM 460 N PRO A 411 1.640 17.926 45.601 1.00 31.40 N ATOM 461 CA PRO A 411 1.945 17.279 46.881 1.00 29.13 C ATOM 462 C PRO A 411 0.957 16.153 47.166 1.00 26.94 C ATOM 463 O PRO A 411 -0.244 16.336 46.967 1.00 24.77 O ATOM 464 CB PRO A 411 1.799 18.412 47.907 1.00 34.82 C ATOM 465 CG PRO A 411 1.786 19.676 47.116 1.00 38.57 C ATOM 466 CD PRO A 411 1.230 19.329 45.780 1.00 30.99 C ATOM 467 HA PRO A 411 2.934 16.821 46.900 1.00 0.00 H ATOM 468 HD3 PRO A 411 0.144 19.424 45.771 1.00 0.00 H ATOM 469 HD2 PRO A 411 1.655 19.963 45.002 1.00 0.00 H ATOM 470 HG3 PRO A 411 2.798 20.068 47.014 1.00 0.00 H ATOM 471 HG2 PRO A 411 1.157 20.421 47.605 1.00 0.00 H ATOM 472 HB2 PRO A 411 0.869 18.303 48.464 1.00 0.00 H ATOM 473 HB3 PRO A 411 2.639 18.407 48.601 1.00 0.00 H ATOM 474 N MET A 412 1.462 15.010 47.618 1.00 20.19 N ATOM 475 CA MET A 412 0.627 13.844 47.874 1.00 23.29 C ATOM 476 C MET A 412 0.732 13.448 49.351 1.00 19.44 C ATOM 477 O MET A 412 0.289 14.186 50.233 1.00 24.61 O ATOM 478 CB MET A 412 1.046 12.683 46.960 1.00 30.17 C ATOM 479 CG MET A 412 1.038 12.996 45.463 1.00 32.88 C ATOM 480 SD MET A 412 -0.530 12.684 44.625 1.00 38.22 S ATOM 481 CE MET A 412 -0.657 10.905 44.764 1.00 34.74 C ATOM 482 HA MET A 412 -0.413 14.087 47.655 1.00 0.00 H ATOM 483 HB2 MET A 412 2.057 12.384 47.237 1.00 0.00 H ATOM 484 HB3 MET A 412 0.362 11.852 47.135 1.00 0.00 H ATOM 485 HG2 MET A 412 1.804 12.385 44.986 1.00 0.00 H ATOM 486 HG3 MET A 412 1.285 14.050 45.337 1.00 0.00 H ATOM 487 HE1 MET A 412 0.197 10.441 44.270 1.00 0.00 H ATOM 488 HE2 MET A 412 -0.666 10.624 45.817 1.00 0.00 H ATOM 489 HE3 MET A 412 -1.579 10.570 44.289 1.00 0.00 H ATOM 490 H MET A 412 2.485 14.946 47.794 1.00 0.00 H ATOM 491 N ASP A 413 1.330 12.289 49.610 1.00 17.67 N ATOM 492 CA ASP A 413 1.529 11.776 50.962 1.00 18.60 C ATOM 493 C ASP A 413 2.192 12.802 51.887 1.00 15.27 C ATOM 494 O ASP A 413 3.259 13.330 51.580 1.00 14.51 O ATOM 495 CB ASP A 413 2.377 10.505 50.889 1.00 15.09 C ATOM 496 CG ASP A 413 2.417 9.747 52.189 1.00 19.21 C ATOM 497 OD1 ASP A 413 1.991 10.299 53.222 1.00 15.64 O ATOM 498 OD2 ASP A 413 2.890 8.593 52.171 1.00 23.17 O ATOM 499 HA ASP A 413 0.550 11.557 51.388 1.00 0.00 H ATOM 500 HB2 ASP A 413 1.961 9.854 50.120 1.00 0.00 H ATOM 501 HB3 ASP A 413 3.396 10.782 50.617 1.00 0.00 H ATOM 502 H ASP A 413 1.673 11.720 48.810 1.00 0.00 H ATOM 503 N SER A 414 1.555 13.070 53.025 1.00 17.88 N ATOM 504 CA SER A 414 2.105 13.995 54.013 1.00 18.38 C ATOM 505 C SER A 414 3.409 13.464 54.610 1.00 18.02 C ATOM 506 O SER A 414 4.246 14.241 55.063 1.00 21.15 O ATOM 507 CB SER A 414 1.096 14.255 55.136 1.00 15.62 C ATOM 508 OG SER A 414 -0.055 14.925 54.653 1.00 16.83 O ATOM 509 HA SER A 414 2.316 14.931 53.496 1.00 0.00 H ATOM 510 HB2 SER A 414 1.569 14.869 55.902 1.00 0.00 H ATOM 511 HB3 SER A 414 0.795 13.302 55.571 1.00 0.00 H ATOM 512 HG SER A 414 0.211 15.795 54.262 1.00 0.00 H ATOM 513 H SER A 414 0.642 12.609 53.215 1.00 0.00 H ATOM 514 N ASN A 415 3.567 12.143 54.622 1.00 14.83 N ATOM 515 CA ASN A 415 4.781 11.518 55.143 1.00 15.81 C ATOM 516 C ASN A 415 5.831 11.322 54.055 1.00 16.42 C ATOM 517 O ASN A 415 6.887 10.738 54.297 1.00 19.01 O ATOM 518 CB ASN A 415 4.456 10.173 55.789 1.00 14.10 C ATOM 519 CG ASN A 415 3.678 10.320 57.080 1.00 13.66 C ATOM 520 OD1 ASN A 415 3.595 11.410 57.647 1.00 19.17 O ATOM 521 ND2 ASN A 415 3.108 9.220 57.553 1.00 20.82 N ATOM 522 HA ASN A 415 5.193 12.193 55.894 1.00 0.00 H ATOM 523 HB2 ASN A 415 3.864 9.583 55.089 1.00 0.00 H ATOM 524 HB3 ASN A 415 5.390 9.652 56.001 1.00 0.00 H ATOM 525 HD22 ASN A 415 3.206 8.321 57.039 1.00 0.00 H ATOM 526 HD21 ASN A 415 2.563 9.256 58.438 1.00 0.00 H ATOM 527 H ASN A 415 2.806 11.539 54.251 1.00 0.00 H ATOM 528 N GLY A 416 5.531 11.809 52.858 1.00 18.74 N ATOM 529 CA GLY A 416 6.444 11.689 51.736 1.00 16.44 C ATOM 530 C GLY A 416 7.401 12.861 51.661 1.00 21.10 C ATOM 531 O GLY A 416 7.334 13.791 52.470 1.00 16.11 O ATOM 532 HA3 GLY A 416 5.866 11.646 50.813 1.00 0.00 H ATOM 533 HA2 GLY A 416 7.019 10.770 51.846 1.00 0.00 H ATOM 534 H GLY A 416 4.619 12.289 52.720 1.00 0.00 H ATOM 535 N LEU A 417 8.298 12.804 50.683 1.00 15.54 N ATOM 536 CA LEU A 417 9.239 13.881 50.422 1.00 15.98 C ATOM 537 C LEU A 417 9.028 14.395 49.011 1.00 17.81 C ATOM 538 O LEU A 417 8.623 13.639 48.132 1.00 12.34 O ATOM 539 CB LEU A 417 10.679 13.397 50.593 1.00 18.49 C ATOM 540 CG LEU A 417 11.074 12.909 51.985 1.00 21.36 C ATOM 541 CD1 LEU A 417 12.479 12.321 51.954 1.00 26.53 C ATOM 542 CD2 LEU A 417 10.985 14.043 52.989 1.00 20.18 C ATOM 543 HA LEU A 417 9.065 14.685 51.137 1.00 0.00 H ATOM 544 HB2 LEU A 417 10.837 12.574 49.896 1.00 0.00 H ATOM 545 HB3 LEU A 417 11.340 14.224 50.332 1.00 0.00 H ATOM 546 HG LEU A 417 10.380 12.128 52.295 1.00 0.00 H ATOM 547 HD21 LEU A 417 11.659 14.846 52.689 1.00 0.00 H ATOM 548 HD22 LEU A 417 9.962 14.419 53.021 1.00 0.00 H ATOM 549 HD23 LEU A 417 11.270 13.677 53.975 1.00 0.00 H ATOM 550 HD11 LEU A 417 12.505 11.482 51.259 1.00 0.00 H ATOM 551 HD12 LEU A 417 13.184 13.086 51.629 1.00 0.00 H ATOM 552 HD13 LEU A 417 12.749 11.977 52.952 1.00 0.00 H ATOM 553 H LEU A 417 8.328 11.957 50.081 1.00 0.00 H ATOM 554 N ALA A 418 9.292 15.680 48.804 1.00 14.35 N ATOM 555 CA ALA A 418 9.271 16.258 47.471 1.00 20.45 C ATOM 556 C ALA A 418 10.625 16.012 46.819 1.00 16.91 C ATOM 557 O ALA A 418 11.370 16.950 46.540 1.00 18.99 O ATOM 558 CB ALA A 418 8.956 17.742 47.532 1.00 24.15 C ATOM 559 HA ALA A 418 8.488 15.788 46.876 1.00 0.00 H ATOM 560 HB1 ALA A 418 7.979 17.886 47.994 1.00 0.00 H ATOM 561 HB2 ALA A 418 9.718 18.250 48.124 1.00 0.00 H ATOM 562 HB3 ALA A 418 8.946 18.152 46.522 1.00 0.00 H ATOM 563 H ALA A 418 9.520 16.288 49.617 1.00 0.00 H ATOM 564 N ASP A 419 10.935 14.735 46.607 1.00 12.51 N ATOM 565 CA ASP A 419 12.202 14.308 46.016 1.00 12.62 C ATOM 566 C ASP A 419 11.929 13.628 44.680 1.00 12.16 C ATOM 567 O ASP A 419 11.956 12.401 44.594 1.00 14.93 O ATOM 568 CB ASP A 419 12.947 13.344 46.945 1.00 17.04 C ATOM 569 CG ASP A 419 13.640 14.047 48.100 1.00 20.71 C ATOM 570 OD1 ASP A 419 13.259 15.187 48.433 1.00 14.77 O ATOM 571 OD2 ASP A 419 14.568 13.446 48.682 1.00 20.79 O ATOM 572 HA ASP A 419 12.830 15.186 45.866 1.00 0.00 H ATOM 573 HB2 ASP A 419 12.231 12.631 47.352 1.00 0.00 H ATOM 574 HB3 ASP A 419 13.698 12.811 46.362 1.00 0.00 H ATOM 575 H ASP A 419 10.243 14.006 46.875 1.00 0.00 H ATOM 576 N PRO A 420 11.666 14.422 43.633 1.00 17.56 N ATOM 577 CA PRO A 420 11.193 13.846 42.370 1.00 11.14 C ATOM 578 C PRO A 420 12.277 13.247 41.471 1.00 13.68 C ATOM 579 O PRO A 420 13.422 13.702 41.440 1.00 13.66 O ATOM 580 CB PRO A 420 10.530 15.040 41.679 1.00 13.80 C ATOM 581 CG PRO A 420 11.266 16.221 42.188 1.00 12.07 C ATOM 582 CD PRO A 420 11.621 15.896 43.617 1.00 14.38 C ATOM 583 HA PRO A 420 10.541 12.994 42.564 1.00 0.00 H ATOM 584 HD3 PRO A 420 12.590 16.319 43.884 1.00 0.00 H ATOM 585 HD2 PRO A 420 10.861 16.271 44.303 1.00 0.00 H ATOM 586 HG3 PRO A 420 10.636 17.109 42.145 1.00 0.00 H ATOM 587 HG2 PRO A 420 12.169 16.389 41.601 1.00 0.00 H ATOM 588 HB2 PRO A 420 10.628 14.962 40.596 1.00 0.00 H ATOM 589 HB3 PRO A 420 9.474 15.101 41.943 1.00 0.00 H ATOM 590 N TYR A 421 11.890 12.210 40.738 1.00 12.51 N ATOM 591 CA TYR A 421 12.727 11.647 39.691 1.00 8.49 C ATOM 592 C TYR A 421 11.827 11.105 38.593 1.00 10.58 C ATOM 593 O TYR A 421 10.619 10.959 38.780 1.00 11.43 O ATOM 594 CB TYR A 421 13.641 10.549 40.231 1.00 10.17 C ATOM 595 CG TYR A 421 12.920 9.333 40.774 1.00 12.50 C ATOM 596 CD1 TYR A 421 12.266 9.382 41.996 1.00 12.74 C ATOM 597 CD2 TYR A 421 12.909 8.134 40.072 1.00 12.15 C ATOM 598 CE1 TYR A 421 11.611 8.278 42.502 1.00 14.42 C ATOM 599 CE2 TYR A 421 12.256 7.020 40.570 1.00 17.81 C ATOM 600 CZ TYR A 421 11.612 7.098 41.791 1.00 18.92 C ATOM 601 OH TYR A 421 10.958 6.001 42.300 1.00 19.50 O ATOM 602 HA TYR A 421 13.374 12.429 39.292 1.00 0.00 H ATOM 603 HB3 TYR A 421 14.243 10.973 41.034 1.00 0.00 H ATOM 604 HB2 TYR A 421 14.295 10.223 39.422 1.00 0.00 H ATOM 605 HD2 TYR A 421 13.423 8.070 39.113 1.00 0.00 H ATOM 606 HE2 TYR A 421 12.249 6.088 40.004 1.00 0.00 H ATOM 607 HE1 TYR A 421 11.095 8.339 43.460 1.00 0.00 H ATOM 608 HD1 TYR A 421 12.269 10.310 42.567 1.00 0.00 H ATOM 609 HH TYR A 421 11.603 5.259 42.418 1.00 0.00 H ATOM 610 H TYR A 421 10.957 11.786 40.919 1.00 0.00 H ATOM 611 N VAL A 422 12.427 10.822 37.446 1.00 11.36 N ATOM 612 CA VAL A 422 11.687 10.365 36.283 1.00 7.44 C ATOM 613 C VAL A 422 12.179 8.985 35.892 1.00 11.05 C ATOM 614 O VAL A 422 13.386 8.726 35.876 1.00 10.84 O ATOM 615 CB VAL A 422 11.840 11.341 35.103 1.00 9.02 C ATOM 616 CG1 VAL A 422 11.125 10.816 33.868 1.00 12.73 C ATOM 617 CG2 VAL A 422 11.302 12.703 35.487 1.00 14.96 C ATOM 618 HA VAL A 422 10.628 10.321 36.537 1.00 0.00 H ATOM 619 HB VAL A 422 12.900 11.432 34.865 1.00 0.00 H ATOM 620 HG11 VAL A 422 11.551 9.853 33.585 1.00 0.00 H ATOM 621 HG12 VAL A 422 10.064 10.695 34.088 1.00 0.00 H ATOM 622 HG13 VAL A 422 11.249 11.525 33.049 1.00 0.00 H ATOM 623 HG21 VAL A 422 10.247 12.615 35.747 1.00 0.00 H ATOM 624 HG22 VAL A 422 11.858 13.084 36.343 1.00 0.00 H ATOM 625 HG23 VAL A 422 11.414 13.387 34.646 1.00 0.00 H ATOM 626 H VAL A 422 13.459 10.930 37.376 1.00 0.00 H ATOM 627 N LYS A 423 11.230 8.108 35.585 1.00 10.83 N ATOM 628 CA LYS A 423 11.525 6.760 35.131 1.00 12.76 C ATOM 629 C LYS A 423 11.025 6.556 33.711 1.00 18.60 C ATOM 630 O LYS A 423 9.893 6.907 33.387 1.00 12.74 O ATOM 631 CB LYS A 423 10.882 5.729 36.056 1.00 19.62 C ATOM 632 CG LYS A 423 11.527 5.634 37.419 1.00 18.30 C ATOM 633 CD LYS A 423 10.644 4.882 38.384 1.00 28.58 C ATOM 634 CE LYS A 423 9.484 5.732 38.851 1.00 24.87 C ATOM 635 NZ LYS A 423 8.472 4.947 39.604 1.00 24.84 N ATOM 636 HA LYS A 423 12.607 6.626 35.150 1.00 0.00 H ATOM 637 HB2 LYS A 423 9.834 5.997 36.191 1.00 0.00 H ATOM 638 HB3 LYS A 423 10.947 4.752 35.577 1.00 0.00 H ATOM 639 HG2 LYS A 423 12.480 5.113 37.327 1.00 0.00 H ATOM 640 HG3 LYS A 423 11.700 6.639 37.803 1.00 0.00 H ATOM 641 HD2 LYS A 423 10.255 3.992 37.889 1.00 0.00 H ATOM 642 HD3 LYS A 423 11.237 4.585 39.249 1.00 0.00 H ATOM 643 HE2 LYS A 423 9.004 6.178 37.980 1.00 0.00 H ATOM 644 HE3 LYS A 423 9.867 6.522 39.498 1.00 0.00 H ATOM 645 HZ1 LYS A 423 8.094 4.195 38.993 1.00 0.00 H ATOM 646 HZ2 LYS A 423 8.918 4.523 40.443 1.00 0.00 H ATOM 647 HZ3 LYS A 423 7.699 5.575 39.901 1.00 0.00 H ATOM 648 H LYS A 423 10.235 8.398 35.673 1.00 0.00 H ATOM 649 N LEU A 424 11.883 5.986 32.875 1.00 12.25 N ATOM 650 CA LEU A 424 11.524 5.629 31.508 1.00 14.72 C ATOM 651 C LEU A 424 11.327 4.123 31.402 1.00 17.86 C ATOM 652 O LEU A 424 12.084 3.357 31.989 1.00 16.18 O ATOM 653 CB LEU A 424 12.611 6.093 30.540 1.00 11.17 C ATOM 654 CG LEU A 424 12.489 7.501 29.958 1.00 18.62 C ATOM 655 CD1 LEU A 424 12.015 8.512 30.988 1.00 19.66 C ATOM 656 CD2 LEU A 424 13.825 7.923 29.364 1.00 15.26 C ATOM 657 HA LEU A 424 10.590 6.126 31.244 1.00 0.00 H ATOM 658 HB2 LEU A 424 13.563 6.040 31.069 1.00 0.00 H ATOM 659 HB3 LEU A 424 12.622 5.394 29.703 1.00 0.00 H ATOM 660 HG LEU A 424 11.732 7.476 29.174 1.00 0.00 H ATOM 661 HD21 LEU A 424 14.586 7.917 30.144 1.00 0.00 H ATOM 662 HD22 LEU A 424 14.106 7.226 28.574 1.00 0.00 H ATOM 663 HD23 LEU A 424 13.736 8.927 28.950 1.00 0.00 H ATOM 664 HD11 LEU A 424 11.035 8.215 31.363 1.00 0.00 H ATOM 665 HD12 LEU A 424 12.726 8.548 31.814 1.00 0.00 H ATOM 666 HD13 LEU A 424 11.945 9.496 30.524 1.00 0.00 H ATOM 667 H LEU A 424 12.848 5.786 33.207 1.00 0.00 H ATOM 668 N HIS A 425 10.299 3.708 30.669 1.00 14.86 N ATOM 669 CA HIS A 425 10.082 2.297 30.361 1.00 17.23 C ATOM 670 C HIS A 425 9.713 2.145 28.889 1.00 19.20 C ATOM 671 O HIS A 425 8.849 2.862 28.387 1.00 23.12 O ATOM 672 CB HIS A 425 8.968 1.697 31.226 1.00 26.99 C ATOM 673 CG HIS A 425 9.299 1.603 32.681 1.00 25.90 C ATOM 674 ND1 HIS A 425 9.790 0.449 33.255 1.00 39.45 N ATOM 675 CD2 HIS A 425 9.187 2.504 33.685 1.00 33.54 C ATOM 676 CE1 HIS A 425 9.977 0.648 34.547 1.00 42.27 C ATOM 677 NE2 HIS A 425 9.619 1.887 34.835 1.00 33.67 N ATOM 678 HA HIS A 425 11.007 1.761 30.575 1.00 0.00 H ATOM 679 HB2 HIS A 425 8.079 2.319 31.118 1.00 0.00 H ATOM 680 HB3 HIS A 425 8.754 0.693 30.859 1.00 0.00 H ATOM 681 HD2 HIS A 425 8.822 3.528 33.598 1.00 0.00 H ATOM 682 HE1 HIS A 425 10.361 -0.085 35.256 1.00 0.00 H ATOM 683 H HIS A 425 9.627 4.412 30.302 1.00 0.00 H ATOM 684 N LEU A 426 10.372 1.213 28.205 1.00 19.29 N ATOM 685 CA LEU A 426 10.037 0.879 26.821 1.00 24.92 C ATOM 686 C LEU A 426 9.115 -0.338 26.788 1.00 26.73 C ATOM 687 O LEU A 426 9.508 -1.429 27.201 1.00 29.69 O ATOM 688 CB LEU A 426 11.309 0.608 26.015 1.00 22.01 C ATOM 689 CG LEU A 426 11.675 1.569 24.878 1.00 28.68 C ATOM 690 CD1 LEU A 426 11.426 3.032 25.222 1.00 30.38 C ATOM 691 CD2 LEU A 426 13.137 1.368 24.520 1.00 33.50 C ATOM 692 HA LEU A 426 9.519 1.725 26.370 1.00 0.00 H ATOM 693 HB2 LEU A 426 12.142 0.609 26.718 1.00 0.00 H ATOM 694 HB3 LEU A 426 11.207 -0.385 25.577 1.00 0.00 H ATOM 695 HG LEU A 426 11.027 1.337 24.033 1.00 0.00 H ATOM 696 HD21 LEU A 426 13.755 1.575 25.393 1.00 0.00 H ATOM 697 HD22 LEU A 426 13.293 0.338 24.199 1.00 0.00 H ATOM 698 HD23 LEU A 426 13.408 2.047 23.712 1.00 0.00 H ATOM 699 HD11 LEU A 426 10.369 3.176 25.447 1.00 0.00 H ATOM 700 HD12 LEU A 426 12.025 3.307 26.090 1.00 0.00 H ATOM 701 HD13 LEU A 426 11.706 3.656 24.374 1.00 0.00 H ATOM 702 H LEU A 426 11.151 0.705 28.670 1.00 0.00 H ATOM 703 N LEU A 427 7.894 -0.143 26.292 1.00 20.95 N ATOM 704 CA LEU A 427 6.858 -1.169 26.359 1.00 28.29 C ATOM 705 C LEU A 427 6.357 -1.610 24.986 1.00 32.91 C ATOM 706 O LEU A 427 6.095 -0.768 24.128 1.00 29.76 O ATOM 707 CB LEU A 427 5.684 -0.653 27.177 1.00 31.69 C ATOM 708 CG LEU A 427 6.066 -0.248 28.599 1.00 27.62 C ATOM 709 CD1 LEU A 427 4.995 0.634 29.150 1.00 39.13 C ATOM 710 CD2 LEU A 427 6.279 -1.461 29.484 1.00 41.14 C ATOM 711 HA LEU A 427 7.310 -2.041 26.831 1.00 0.00 H ATOM 712 HB2 LEU A 427 5.266 0.217 26.671 1.00 0.00 H ATOM 713 HB3 LEU A 427 4.930 -1.438 27.232 1.00 0.00 H ATOM 714 HG LEU A 427 7.011 0.294 28.574 1.00 0.00 H ATOM 715 HD21 LEU A 427 5.359 -2.044 29.526 1.00 0.00 H ATOM 716 HD22 LEU A 427 7.081 -2.074 29.072 1.00 0.00 H ATOM 717 HD23 LEU A 427 6.549 -1.134 30.488 1.00 0.00 H ATOM 718 HD11 LEU A 427 4.900 1.522 28.525 1.00 0.00 H ATOM 719 HD12 LEU A 427 4.049 0.092 29.160 1.00 0.00 H ATOM 720 HD13 LEU A 427 5.257 0.930 30.166 1.00 0.00 H ATOM 721 H LEU A 427 7.672 0.769 25.843 1.00 0.00 H ATOM 722 N PRO A 428 6.216 -2.933 24.776 1.00 32.67 N ATOM 723 CA PRO A 428 6.583 -4.014 25.700 1.00 33.31 C ATOM 724 C PRO A 428 8.093 -4.130 25.878 1.00 38.53 C ATOM 725 O PRO A 428 8.848 -3.671 25.022 1.00 41.74 O ATOM 726 CB PRO A 428 6.010 -5.268 25.030 1.00 36.82 C ATOM 727 CG PRO A 428 5.864 -4.909 23.601 1.00 32.91 C ATOM 728 CD PRO A 428 5.532 -3.452 23.580 1.00 30.25 C ATOM 729 HA PRO A 428 6.195 -3.847 26.705 1.00 0.00 H ATOM 730 HD3 PRO A 428 5.912 -2.977 22.675 1.00 0.00 H ATOM 731 HD2 PRO A 428 4.455 -3.295 23.646 1.00 0.00 H ATOM 732 HG3 PRO A 428 5.062 -5.488 23.144 1.00 0.00 H ATOM 733 HG2 PRO A 428 6.795 -5.094 23.066 1.00 0.00 H ATOM 734 HB2 PRO A 428 6.693 -6.110 25.146 1.00 0.00 H ATOM 735 HB3 PRO A 428 5.042 -5.525 25.461 1.00 0.00 H ATOM 736 N GLY A 429 8.521 -4.721 26.989 1.00 43.38 N ATOM 737 CA GLY A 429 9.935 -4.867 27.281 1.00 43.05 C ATOM 738 C GLY A 429 10.195 -5.990 28.266 1.00 49.77 C ATOM 739 O GLY A 429 9.358 -6.282 29.122 1.00 51.30 O ATOM 740 HA3 GLY A 429 10.306 -3.934 27.704 1.00 0.00 H ATOM 741 HA2 GLY A 429 10.467 -5.081 26.354 1.00 0.00 H ATOM 742 H GLY A 429 7.824 -5.089 27.667 1.00 0.00 H ATOM 743 N ALA A 430 11.369 -6.603 28.162 1.00 54.74 N ATOM 744 CA ALA A 430 11.720 -7.755 28.987 1.00 56.05 C ATOM 745 C ALA A 430 12.104 -7.355 30.409 1.00 55.53 C ATOM 746 O ALA A 430 12.916 -8.027 31.047 1.00 62.17 O ATOM 747 CB ALA A 430 12.857 -8.522 28.342 1.00 52.17 C ATOM 748 HA ALA A 430 10.836 -8.388 29.056 1.00 0.00 H ATOM 749 HB1 ALA A 430 12.548 -8.866 27.355 1.00 0.00 H ATOM 750 HB2 ALA A 430 13.725 -7.870 28.245 1.00 0.00 H ATOM 751 HB3 ALA A 430 13.113 -9.380 28.963 1.00 0.00 H ATOM 752 H ALA A 430 12.061 -6.251 27.470 1.00 0.00 H ATOM 753 N SER A 431 11.516 -6.268 30.902 1.00 59.48 N ATOM 754 CA SER A 431 11.870 -5.713 32.204 1.00 61.01 C ATOM 755 C SER A 431 13.362 -5.379 32.258 1.00 61.08 C ATOM 756 O SER A 431 14.088 -5.537 31.270 1.00 59.80 O ATOM 757 CB SER A 431 11.509 -6.687 33.319 1.00 65.41 C ATOM 758 OG SER A 431 11.716 -6.107 34.594 1.00 73.22 O ATOM 759 HA SER A 431 11.302 -4.794 32.348 1.00 0.00 H ATOM 760 HB2 SER A 431 12.131 -7.578 33.228 1.00 0.00 H ATOM 761 HB3 SER A 431 10.460 -6.966 33.221 1.00 0.00 H ATOM 762 HG SER A 431 11.474 -6.761 35.296 1.00 0.00 H ATOM 763 H SER A 431 10.778 -5.798 30.340 1.00 0.00 H ATOM 764 N LYS A 432 13.806 -4.909 33.418 1.00 62.16 N ATOM 765 CA LYS A 432 15.216 -4.623 33.658 1.00 59.81 C ATOM 766 C LYS A 432 15.810 -3.663 32.624 1.00 52.86 C ATOM 767 O LYS A 432 15.868 -2.453 32.852 1.00 50.09 O ATOM 768 CB LYS A 432 16.006 -5.932 33.688 1.00 57.00 C ATOM 769 CG LYS A 432 15.635 -6.819 34.867 1.00 59.71 C ATOM 770 CD LYS A 432 16.522 -8.049 34.960 1.00 56.89 C ATOM 771 CE LYS A 432 16.516 -8.631 36.367 1.00 58.26 C ATOM 772 NZ LYS A 432 17.268 -7.773 37.328 1.00 61.71 N ATOM 773 HA LYS A 432 15.289 -4.123 34.624 1.00 0.00 H ATOM 774 HB2 LYS A 432 15.810 -6.479 32.766 1.00 0.00 H ATOM 775 HB3 LYS A 432 17.068 -5.696 33.750 1.00 0.00 H ATOM 776 HG2 LYS A 432 15.736 -6.242 35.786 1.00 0.00 H ATOM 777 HG3 LYS A 432 14.600 -7.140 34.753 1.00 0.00 H ATOM 778 HD2 LYS A 432 16.158 -8.803 34.262 1.00 0.00 H ATOM 779 HD3 LYS A 432 17.542 -7.772 34.694 1.00 0.00 H ATOM 780 HE2 LYS A 432 16.976 -9.619 36.342 1.00 0.00 H ATOM 781 HE3 LYS A 432 15.484 -8.721 36.707 1.00 0.00 H ATOM 782 HZ1 LYS A 432 18.256 -7.688 37.015 1.00 0.00 H ATOM 783 HZ2 LYS A 432 16.832 -6.830 37.364 1.00 0.00 H ATOM 784 HZ3 LYS A 432 17.239 -8.206 38.273 1.00 0.00 H ATOM 785 H LYS A 432 13.123 -4.739 34.184 1.00 0.00 H ATOM 786 N SER A 433 16.237 -4.203 31.486 1.00 47.56 N ATOM 787 CA SER A 433 16.938 -3.411 30.477 1.00 43.86 C ATOM 788 C SER A 433 16.064 -2.338 29.829 1.00 38.30 C ATOM 789 O SER A 433 16.585 -1.411 29.208 1.00 35.27 O ATOM 790 CB SER A 433 17.503 -4.321 29.382 1.00 46.15 C ATOM 791 OG SER A 433 16.566 -5.315 29.001 1.00 53.79 O ATOM 792 HA SER A 433 17.743 -2.900 31.006 1.00 0.00 H ATOM 793 HB2 SER A 433 18.405 -4.807 29.755 1.00 0.00 H ATOM 794 HB3 SER A 433 17.752 -3.715 28.511 1.00 0.00 H ATOM 795 HG SER A 433 16.960 -5.885 28.294 1.00 0.00 H ATOM 796 H SER A 433 16.068 -5.214 31.310 1.00 0.00 H ATOM 797 N ASN A 434 14.745 -2.459 29.960 1.00 33.50 N ATOM 798 CA ASN A 434 13.838 -1.490 29.347 1.00 33.18 C ATOM 799 C ASN A 434 13.715 -0.222 30.186 1.00 20.72 C ATOM 800 O ASN A 434 13.074 0.740 29.773 1.00 19.96 O ATOM 801 CB ASN A 434 12.452 -2.107 29.134 1.00 30.05 C ATOM 802 CG ASN A 434 11.697 -2.314 30.436 1.00 44.69 C ATOM 803 OD1 ASN A 434 12.269 -2.746 31.435 1.00 42.39 O ATOM 804 ND2 ASN A 434 10.405 -2.001 30.429 1.00 41.89 N ATOM 805 HA ASN A 434 14.263 -1.217 28.381 1.00 0.00 H ATOM 806 HB2 ASN A 434 11.869 -1.444 28.494 1.00 0.00 H ATOM 807 HB3 ASN A 434 12.571 -3.072 28.642 1.00 0.00 H ATOM 808 HD22 ASN A 434 9.962 -1.639 29.560 1.00 0.00 H ATOM 809 HD21 ASN A 434 9.837 -2.119 31.292 1.00 0.00 H ATOM 810 H ASN A 434 14.354 -3.253 30.506 1.00 0.00 H ATOM 811 N LYS A 435 14.351 -0.220 31.353 1.00 21.11 N ATOM 812 CA LYS A 435 14.184 0.863 32.315 1.00 20.63 C ATOM 813 C LYS A 435 15.395 1.781 32.388 1.00 19.71 C ATOM 814 O LYS A 435 16.536 1.320 32.445 1.00 16.70 O ATOM 815 CB LYS A 435 13.902 0.290 33.705 1.00 31.36 C ATOM 816 CG LYS A 435 12.956 -0.884 33.694 1.00 41.26 C ATOM 817 CD LYS A 435 12.545 -1.317 35.077 1.00 46.54 C ATOM 818 CE LYS A 435 11.418 -2.350 34.967 1.00 48.12 C ATOM 819 NZ LYS A 435 10.833 -2.739 36.284 1.00 53.96 N ATOM 820 HA LYS A 435 13.340 1.460 31.970 1.00 0.00 H ATOM 821 HB2 LYS A 435 14.847 -0.032 34.143 1.00 0.00 H ATOM 822 HB3 LYS A 435 13.467 1.077 34.321 1.00 0.00 H ATOM 823 HG2 LYS A 435 12.062 -0.606 33.136 1.00 0.00 H ATOM 824 HG3 LYS A 435 13.446 -1.722 33.198 1.00 0.00 H ATOM 825 HD2 LYS A 435 13.399 -1.761 35.589 1.00 0.00 H ATOM 826 HD3 LYS A 435 12.194 -0.453 35.641 1.00 0.00 H ATOM 827 HE2 LYS A 435 11.816 -3.245 34.489 1.00 0.00 H ATOM 828 HE3 LYS A 435 10.625 -1.931 34.348 1.00 0.00 H ATOM 829 HZ1 LYS A 435 11.576 -3.152 36.884 1.00 0.00 H ATOM 830 HZ2 LYS A 435 10.439 -1.897 36.749 1.00 0.00 H ATOM 831 HZ3 LYS A 435 10.078 -3.439 36.134 1.00 0.00 H ATOM 832 H LYS A 435 14.984 -1.011 31.586 1.00 0.00 H ATOM 833 N LEU A 436 15.134 3.084 32.377 1.00 15.80 N ATOM 834 CA LEU A 436 16.150 4.073 32.712 1.00 13.45 C ATOM 835 C LEU A 436 15.557 5.033 33.731 1.00 13.65 C ATOM 836 O LEU A 436 14.345 5.061 33.928 1.00 17.85 O ATOM 837 CB LEU A 436 16.634 4.818 31.471 1.00 13.28 C ATOM 838 CG LEU A 436 17.326 3.928 30.435 1.00 11.52 C ATOM 839 CD1 LEU A 436 17.499 4.684 29.136 1.00 17.02 C ATOM 840 CD2 LEU A 436 18.670 3.425 30.948 1.00 15.02 C ATOM 841 HA LEU A 436 17.022 3.574 33.134 1.00 0.00 H ATOM 842 HB2 LEU A 436 15.773 5.289 30.997 1.00 0.00 H ATOM 843 HB3 LEU A 436 17.339 5.587 31.787 1.00 0.00 H ATOM 844 HG LEU A 436 16.695 3.057 30.256 1.00 0.00 H ATOM 845 HD21 LEU A 436 19.317 4.276 31.163 1.00 0.00 H ATOM 846 HD22 LEU A 436 18.516 2.845 31.858 1.00 0.00 H ATOM 847 HD23 LEU A 436 19.135 2.796 30.189 1.00 0.00 H ATOM 848 HD11 LEU A 436 16.521 4.982 28.758 1.00 0.00 H ATOM 849 HD12 LEU A 436 18.108 5.571 29.312 1.00 0.00 H ATOM 850 HD13 LEU A 436 17.992 4.042 28.406 1.00 0.00 H ATOM 851 H LEU A 436 14.179 3.406 32.122 1.00 0.00 H ATOM 852 N ARG A 437 16.414 5.816 34.372 1.00 12.98 N ATOM 853 CA ARG A 437 15.998 6.620 35.512 1.00 12.81 C ATOM 854 C ARG A 437 16.886 7.848 35.672 1.00 12.51 C ATOM 855 O ARG A 437 18.105 7.754 35.566 1.00 12.71 O ATOM 856 CB ARG A 437 16.037 5.758 36.773 1.00 17.91 C ATOM 857 CG ARG A 437 15.580 6.430 38.048 1.00 24.79 C ATOM 858 CD ARG A 437 16.256 5.758 39.226 1.00 22.57 C ATOM 859 NE ARG A 437 15.557 5.948 40.492 1.00 29.99 N ATOM 860 CZ ARG A 437 15.671 7.029 41.255 1.00 25.56 C ATOM 861 NH1 ARG A 437 16.440 8.041 40.869 1.00 29.40 N ATOM 862 NH2 ARG A 437 15.005 7.106 42.398 1.00 25.63 N ATOM 863 HA ARG A 437 14.981 6.973 35.345 1.00 0.00 H ATOM 864 HB2 ARG A 437 15.398 4.891 36.605 1.00 0.00 H ATOM 865 HB3 ARG A 437 17.065 5.427 36.920 1.00 0.00 H ATOM 866 HG2 ARG A 437 15.851 7.485 38.023 1.00 0.00 H ATOM 867 HG3 ARG A 437 14.498 6.336 38.144 1.00 0.00 H ATOM 868 HD2 ARG A 437 17.262 6.166 39.324 1.00 0.00 H ATOM 869 HD3 ARG A 437 16.317 4.689 39.024 1.00 0.00 H ATOM 870 HE ARG A 437 14.928 5.187 40.819 1.00 0.00 H ATOM 871 HH12 ARG A 437 16.527 8.886 41.469 1.00 0.00 H ATOM 872 HH11 ARG A 437 16.955 7.988 39.967 1.00 0.00 H ATOM 873 HH22 ARG A 437 15.094 7.952 42.996 1.00 0.00 H ATOM 874 HH21 ARG A 437 14.393 6.320 42.697 1.00 0.00 H ATOM 875 H ARG A 437 17.403 5.857 34.054 1.00 0.00 H ATOM 876 N THR A 438 16.268 8.996 35.924 1.00 10.05 N ATOM 877 CA THR A 438 17.012 10.226 36.161 1.00 13.16 C ATOM 878 C THR A 438 17.559 10.254 37.578 1.00 14.13 C ATOM 879 O THR A 438 17.237 9.395 38.394 1.00 12.55 O ATOM 880 CB THR A 438 16.141 11.487 35.972 1.00 12.53 C ATOM 881 OG1 THR A 438 15.108 11.511 36.968 1.00 13.01 O ATOM 882 CG2 THR A 438 15.518 11.524 34.592 1.00 10.75 C ATOM 883 HA THR A 438 17.820 10.236 35.429 1.00 0.00 H ATOM 884 HB THR A 438 16.781 12.363 36.079 1.00 0.00 H ATOM 885 HG1 THR A 438 15.520 11.526 37.868 1.00 0.00 H ATOM 886 HG23 THR A 438 16.306 11.506 33.839 1.00 0.00 H ATOM 887 HG21 THR A 438 14.870 10.657 34.464 1.00 0.00 H ATOM 888 HG22 THR A 438 14.931 12.436 34.484 1.00 0.00 H ATOM 889 H THR A 438 15.229 9.018 35.953 1.00 0.00 H ATOM 890 N LYS A 439 18.379 11.258 37.859 1.00 12.35 N ATOM 891 CA LYS A 439 18.773 11.561 39.227 1.00 13.30 C ATOM 892 C LYS A 439 17.548 11.969 40.026 1.00 17.06 C ATOM 893 O LYS A 439 16.557 12.446 39.467 1.00 9.73 O ATOM 894 CB LYS A 439 19.804 12.683 39.257 1.00 16.83 C ATOM 895 CG LYS A 439 19.271 13.994 38.696 1.00 20.36 C ATOM 896 CD LYS A 439 20.383 15.002 38.494 1.00 27.18 C ATOM 897 CE LYS A 439 20.137 15.863 37.270 1.00 26.40 C ATOM 898 NZ LYS A 439 21.386 16.548 36.839 1.00 40.38 N ATOM 899 HA LYS A 439 19.221 10.670 39.667 1.00 0.00 H ATOM 900 HB2 LYS A 439 20.111 12.846 40.290 1.00 0.00 H ATOM 901 HB3 LYS A 439 20.668 12.378 38.667 1.00 0.00 H ATOM 902 HG2 LYS A 439 18.789 13.800 37.738 1.00 0.00 H ATOM 903 HG3 LYS A 439 18.540 14.407 39.392 1.00 0.00 H ATOM 904 HD2 LYS A 439 20.443 15.644 39.373 1.00 0.00 H ATOM 905 HD3 LYS A 439 21.326 14.469 38.369 1.00 0.00 H ATOM 906 HE2 LYS A 439 19.383 16.613 37.507 1.00 0.00 H ATOM 907 HE3 LYS A 439 19.777 15.232 36.457 1.00 0.00 H ATOM 908 HZ1 LYS A 439 21.731 17.155 37.610 1.00 0.00 H ATOM 909 HZ2 LYS A 439 22.108 15.836 36.607 1.00 0.00 H ATOM 910 HZ3 LYS A 439 21.189 17.130 36.000 1.00 0.00 H ATOM 911 H LYS A 439 18.749 11.843 37.083 1.00 0.00 H ATOM 912 N THR A 440 17.627 11.792 41.339 1.00 17.33 N ATOM 913 CA THR A 440 16.585 12.257 42.237 1.00 14.35 C ATOM 914 C THR A 440 16.982 13.612 42.805 1.00 17.50 C ATOM 915 O THR A 440 18.070 13.766 43.361 1.00 13.54 O ATOM 916 CB THR A 440 16.344 11.264 43.381 1.00 13.04 C ATOM 917 OG1 THR A 440 16.105 9.963 42.839 1.00 15.35 O ATOM 918 CG2 THR A 440 15.148 11.691 44.222 1.00 14.32 C ATOM 919 HA THR A 440 15.657 12.344 41.672 1.00 0.00 H ATOM 920 HB THR A 440 17.228 11.244 44.018 1.00 0.00 H ATOM 921 HG1 THR A 440 15.950 9.322 43.578 1.00 0.00 H ATOM 922 HG23 THR A 440 15.331 12.683 44.635 1.00 0.00 H ATOM 923 HG21 THR A 440 14.256 11.716 43.596 1.00 0.00 H ATOM 924 HG22 THR A 440 15.004 10.979 45.035 1.00 0.00 H ATOM 925 H THR A 440 18.457 11.307 41.735 1.00 0.00 H ATOM 926 N LEU A 441 16.103 14.595 42.651 1.00 9.10 N ATOM 927 CA LEU A 441 16.345 15.919 43.201 1.00 15.68 C ATOM 928 C LEU A 441 15.765 15.964 44.609 1.00 21.03 C ATOM 929 O LEU A 441 15.110 15.016 45.037 1.00 15.65 O ATOM 930 CB LEU A 441 15.736 16.999 42.304 1.00 15.28 C ATOM 931 CG LEU A 441 16.634 17.550 41.183 1.00 23.88 C ATOM 932 CD1 LEU A 441 17.691 16.554 40.715 1.00 22.89 C ATOM 933 CD2 LEU A 441 15.789 17.985 40.003 1.00 15.73 C ATOM 934 HA LEU A 441 17.416 16.118 43.247 1.00 0.00 H ATOM 935 HB2 LEU A 441 14.845 16.578 41.838 1.00 0.00 H ATOM 936 HB3 LEU A 441 15.450 17.836 42.941 1.00 0.00 H ATOM 937 HG LEU A 441 17.164 18.404 41.604 1.00 0.00 H ATOM 938 HD21 LEU A 441 15.228 17.130 39.625 1.00 0.00 H ATOM 939 HD22 LEU A 441 15.096 18.764 40.321 1.00 0.00 H ATOM 940 HD23 LEU A 441 16.437 18.373 39.217 1.00 0.00 H ATOM 941 HD11 LEU A 441 18.335 16.289 41.553 1.00 0.00 H ATOM 942 HD12 LEU A 441 17.201 15.658 40.334 1.00 0.00 H ATOM 943 HD13 LEU A 441 18.289 17.006 39.924 1.00 0.00 H ATOM 944 H LEU A 441 15.223 14.414 42.126 1.00 0.00 H ATOM 945 N ARG A 442 16.020 17.057 45.323 1.00 22.12 N ATOM 946 CA ARG A 442 15.666 17.156 46.735 1.00 18.95 C ATOM 947 C ARG A 442 14.812 18.386 47.024 1.00 18.61 C ATOM 948 O ARG A 442 15.156 19.501 46.629 1.00 18.81 O ATOM 949 CB ARG A 442 16.931 17.198 47.595 1.00 23.67 C ATOM 950 CG ARG A 442 17.824 15.973 47.463 1.00 27.94 C ATOM 951 CD ARG A 442 18.979 16.022 48.458 1.00 21.94 C ATOM 952 NE ARG A 442 18.527 15.853 49.837 1.00 32.43 N ATOM 953 CZ ARG A 442 19.310 15.973 50.905 1.00 35.17 C ATOM 954 NH1 ARG A 442 20.595 16.274 50.762 1.00 24.49 N ATOM 955 NH2 ARG A 442 18.808 15.797 52.120 1.00 30.72 N ATOM 956 HA ARG A 442 15.079 16.272 46.984 1.00 0.00 H ATOM 957 HB2 ARG A 442 17.510 18.075 47.306 1.00 0.00 H ATOM 958 HB3 ARG A 442 16.631 17.290 48.639 1.00 0.00 H ATOM 959 HG2 ARG A 442 17.230 15.078 47.651 1.00 0.00 H ATOM 960 HG3 ARG A 442 18.227 15.934 46.451 1.00 0.00 H ATOM 961 HD2 ARG A 442 19.480 16.986 48.368 1.00 0.00 H ATOM 962 HD3 ARG A 442 19.683 15.225 48.219 1.00 0.00 H ATOM 963 HE ARG A 442 17.525 15.623 49.994 1.00 0.00 H ATOM 964 HH12 ARG A 442 21.204 16.367 51.600 1.00 0.00 H ATOM 965 HH11 ARG A 442 20.993 16.417 49.812 1.00 0.00 H ATOM 966 HH22 ARG A 442 19.421 15.891 52.955 1.00 0.00 H ATOM 967 HH21 ARG A 442 17.801 15.565 52.238 1.00 0.00 H ATOM 968 H ARG A 442 16.485 17.864 44.861 1.00 0.00 H ATOM 969 N ASN A 443 13.696 18.158 47.712 1.00 20.05 N ATOM 970 CA ASN A 443 12.823 19.223 48.199 1.00 20.79 C ATOM 971 C ASN A 443 12.444 20.248 47.135 1.00 25.10 C ATOM 972 O ASN A 443 12.783 21.426 47.249 1.00 18.73 O ATOM 973 CB ASN A 443 13.485 19.938 49.380 1.00 22.93 C ATOM 974 CG ASN A 443 12.531 20.861 50.111 1.00 25.33 C ATOM 975 OD1 ASN A 443 11.314 20.689 50.049 1.00 31.16 O ATOM 976 ND2 ASN A 443 13.080 21.848 50.808 1.00 32.34 N ATOM 977 HA ASN A 443 11.897 18.737 48.507 1.00 0.00 H ATOM 978 HB2 ASN A 443 13.852 19.188 50.081 1.00 0.00 H ATOM 979 HB3 ASN A 443 14.323 20.526 49.007 1.00 0.00 H ATOM 980 HD22 ASN A 443 14.114 21.955 50.832 1.00 0.00 H ATOM 981 HD21 ASN A 443 12.476 22.514 51.330 1.00 0.00 H ATOM 982 H ASN A 443 13.432 17.172 47.913 1.00 0.00 H ATOM 983 N THR A 444 11.737 19.798 46.104 1.00 16.73 N ATOM 984 CA THR A 444 11.291 20.691 45.048 1.00 19.61 C ATOM 985 C THR A 444 10.073 20.124 44.338 1.00 16.43 C ATOM 986 O THR A 444 9.974 18.915 44.119 1.00 15.00 O ATOM 987 CB THR A 444 12.411 20.951 44.016 1.00 22.29 C ATOM 988 OG1 THR A 444 11.941 21.853 43.008 1.00 22.58 O ATOM 989 CG2 THR A 444 12.869 19.648 43.364 1.00 18.59 C ATOM 990 HA THR A 444 11.025 21.637 45.520 1.00 0.00 H ATOM 991 HB THR A 444 13.260 21.392 44.538 1.00 0.00 H ATOM 992 HG1 THR A 444 12.663 22.016 42.350 1.00 0.00 H ATOM 993 HG23 THR A 444 13.226 18.964 44.134 1.00 0.00 H ATOM 994 HG21 THR A 444 12.032 19.195 42.833 1.00 0.00 H ATOM 995 HG22 THR A 444 13.675 19.859 42.661 1.00 0.00 H ATOM 996 H THR A 444 11.498 18.787 46.052 1.00 0.00 H ATOM 997 N ARG A 445 9.145 21.011 43.995 1.00 15.84 N ATOM 998 CA ARG A 445 7.979 20.653 43.205 1.00 19.04 C ATOM 999 C ARG A 445 8.144 21.143 41.766 1.00 12.36 C ATOM 1000 O ARG A 445 7.274 20.918 40.925 1.00 14.81 O ATOM 1001 CB ARG A 445 6.714 21.238 43.836 1.00 26.02 C ATOM 1002 CG ARG A 445 6.634 20.975 45.338 1.00 25.25 C ATOM 1003 CD ARG A 445 5.215 20.737 45.819 1.00 33.58 C ATOM 1004 NE ARG A 445 5.189 19.955 47.057 1.00 36.74 N ATOM 1005 CZ ARG A 445 5.103 20.465 48.284 1.00 41.63 C ATOM 1006 NH1 ARG A 445 5.026 21.777 48.478 1.00 45.24 N ATOM 1007 NH2 ARG A 445 5.088 19.650 49.331 1.00 36.52 N ATOM 1008 HA ARG A 445 7.884 19.567 43.188 1.00 0.00 H ATOM 1009 HB2 ARG A 445 6.705 22.315 43.669 1.00 0.00 H ATOM 1010 HB3 ARG A 445 5.844 20.790 43.356 1.00 0.00 H ATOM 1011 HG2 ARG A 445 7.233 20.094 45.570 1.00 0.00 H ATOM 1012 HG3 ARG A 445 7.040 21.838 45.865 1.00 0.00 H ATOM 1013 HD2 ARG A 445 4.666 20.197 45.048 1.00 0.00 H ATOM 1014 HD3 ARG A 445 4.736 21.700 45.998 1.00 0.00 H ATOM 1015 HE ARG A 445 5.242 18.920 46.971 1.00 0.00 H ATOM 1016 HH12 ARG A 445 4.959 22.157 49.444 1.00 0.00 H ATOM 1017 HH11 ARG A 445 5.032 22.424 47.664 1.00 0.00 H ATOM 1018 HH22 ARG A 445 5.021 20.040 50.293 1.00 0.00 H ATOM 1019 HH21 ARG A 445 5.143 18.621 49.190 1.00 0.00 H ATOM 1020 H ARG A 445 9.257 21.998 44.303 1.00 0.00 H ATOM 1021 N ASN A 446 9.264 21.813 41.498 1.00 18.17 N ATOM 1022 CA ASN A 446 9.597 22.276 40.150 1.00 20.82 C ATOM 1023 C ASN A 446 11.015 21.878 39.762 1.00 21.21 C ATOM 1024 O ASN A 446 11.865 22.739 39.533 1.00 21.12 O ATOM 1025 CB ASN A 446 9.446 23.794 40.046 1.00 21.92 C ATOM 1026 CG ASN A 446 8.069 24.265 40.434 1.00 22.48 C ATOM 1027 OD1 ASN A 446 7.126 24.169 39.651 1.00 18.52 O ATOM 1028 ND2 ASN A 446 7.939 24.775 41.654 1.00 26.82 N ATOM 1029 HA ASN A 446 8.901 21.798 39.461 1.00 0.00 H ATOM 1030 HB2 ASN A 446 10.175 24.264 40.706 1.00 0.00 H ATOM 1031 HB3 ASN A 446 9.642 24.095 39.017 1.00 0.00 H ATOM 1032 HD22 ASN A 446 8.765 24.837 42.283 1.00 0.00 H ATOM 1033 HD21 ASN A 446 7.011 25.113 41.980 1.00 0.00 H ATOM 1034 H ASN A 446 9.926 22.014 42.275 1.00 0.00 H ATOM 1035 N PRO A 447 11.275 20.565 39.681 1.00 14.62 N ATOM 1036 CA PRO A 447 12.630 20.067 39.424 1.00 13.62 C ATOM 1037 C PRO A 447 13.144 20.375 38.022 1.00 15.01 C ATOM 1038 O PRO A 447 12.373 20.417 37.065 1.00 15.03 O ATOM 1039 CB PRO A 447 12.488 18.555 39.616 1.00 15.85 C ATOM 1040 CG PRO A 447 11.060 18.272 39.334 1.00 12.93 C ATOM 1041 CD PRO A 447 10.305 19.467 39.833 1.00 17.73 C ATOM 1042 HA PRO A 447 13.355 20.543 40.084 1.00 0.00 H ATOM 1043 HD3 PRO A 447 9.414 19.646 39.231 1.00 0.00 H ATOM 1044 HD2 PRO A 447 10.018 19.340 40.877 1.00 0.00 H ATOM 1045 HG3 PRO A 447 10.739 17.372 39.859 1.00 0.00 H ATOM 1046 HG2 PRO A 447 10.902 18.142 38.263 1.00 0.00 H ATOM 1047 HB2 PRO A 447 13.132 18.017 38.920 1.00 0.00 H ATOM 1048 HB3 PRO A 447 12.742 18.271 40.637 1.00 0.00 H ATOM 1049 N VAL A 448 14.449 20.588 37.926 1.00 13.26 N ATOM 1050 CA VAL A 448 15.125 20.719 36.646 1.00 19.51 C ATOM 1051 C VAL A 448 16.222 19.664 36.593 1.00 13.44 C ATOM 1052 O VAL A 448 17.275 19.829 37.201 1.00 14.58 O ATOM 1053 CB VAL A 448 15.718 22.125 36.455 1.00 14.32 C ATOM 1054 CG1 VAL A 448 16.438 22.241 35.109 1.00 14.36 C ATOM 1055 CG2 VAL A 448 14.624 23.178 36.568 1.00 17.68 C ATOM 1056 HA VAL A 448 14.408 20.572 35.838 1.00 0.00 H ATOM 1057 HB VAL A 448 16.452 22.295 37.243 1.00 0.00 H ATOM 1058 HG11 VAL A 448 17.247 21.512 35.067 1.00 0.00 H ATOM 1059 HG12 VAL A 448 15.731 22.048 34.302 1.00 0.00 H ATOM 1060 HG13 VAL A 448 16.847 23.246 35.002 1.00 0.00 H ATOM 1061 HG21 VAL A 448 13.870 23.001 35.801 1.00 0.00 H ATOM 1062 HG22 VAL A 448 14.162 23.116 37.553 1.00 0.00 H ATOM 1063 HG23 VAL A 448 15.059 24.168 36.431 1.00 0.00 H ATOM 1064 H VAL A 448 15.010 20.664 38.799 1.00 0.00 H ATOM 1065 N TRP A 449 15.962 18.572 35.880 1.00 13.12 N ATOM 1066 CA TRP A 449 16.939 17.496 35.761 1.00 17.47 C ATOM 1067 C TRP A 449 17.956 17.816 34.673 1.00 11.35 C ATOM 1068 O TRP A 449 19.149 17.584 34.852 1.00 15.68 O ATOM 1069 CB TRP A 449 16.254 16.161 35.458 1.00 18.10 C ATOM 1070 CG TRP A 449 15.326 15.691 36.535 1.00 13.96 C ATOM 1071 CD1 TRP A 449 15.666 15.059 37.700 1.00 14.45 C ATOM 1072 CD2 TRP A 449 13.899 15.808 36.544 1.00 16.51 C ATOM 1073 NE1 TRP A 449 14.536 14.780 38.431 1.00 13.94 N ATOM 1074 CE2 TRP A 449 13.440 15.230 37.744 1.00 12.99 C ATOM 1075 CE3 TRP A 449 12.965 16.345 35.653 1.00 14.52 C ATOM 1076 CZ2 TRP A 449 12.088 15.174 38.075 1.00 13.42 C ATOM 1077 CZ3 TRP A 449 11.624 16.289 35.985 1.00 12.90 C ATOM 1078 CH2 TRP A 449 11.199 15.708 37.183 1.00 16.75 C ATOM 1079 HA TRP A 449 17.456 17.409 36.716 1.00 0.00 H ATOM 1080 HB2 TRP A 449 15.682 16.271 34.537 1.00 0.00 H ATOM 1081 HB3 TRP A 449 17.026 15.404 35.317 1.00 0.00 H ATOM 1082 HE1 TRP A 449 14.516 14.304 39.356 1.00 0.00 H ATOM 1083 HD1 TRP A 449 16.684 14.813 38.004 1.00 0.00 H ATOM 1084 HZ2 TRP A 449 11.752 14.722 39.008 1.00 0.00 H ATOM 1085 HH2 TRP A 449 10.134 15.680 37.412 1.00 0.00 H ATOM 1086 HZ3 TRP A 449 10.885 16.705 35.300 1.00 0.00 H ATOM 1087 HE3 TRP A 449 13.287 16.799 34.716 1.00 0.00 H ATOM 1088 H TRP A 449 15.045 18.484 35.398 1.00 0.00 H ATOM 1089 N ASN A 450 17.478 18.346 33.549 1.00 10.34 N ATOM 1090 CA ASN A 450 18.357 18.725 32.452 1.00 13.51 C ATOM 1091 C ASN A 450 19.307 17.576 32.142 1.00 12.58 C ATOM 1092 O ASN A 450 20.522 17.731 32.183 1.00 15.73 O ATOM 1093 CB ASN A 450 19.132 19.999 32.806 1.00 15.89 C ATOM 1094 CG ASN A 450 19.896 20.572 31.625 1.00 22.69 C ATOM 1095 OD1 ASN A 450 19.507 20.399 30.472 1.00 16.26 O ATOM 1096 ND2 ASN A 450 20.989 21.267 31.913 1.00 15.35 N ATOM 1097 HA ASN A 450 17.759 18.934 31.565 1.00 0.00 H ATOM 1098 HB2 ASN A 450 18.425 20.749 33.161 1.00 0.00 H ATOM 1099 HB3 ASN A 450 19.842 19.766 33.600 1.00 0.00 H ATOM 1100 HD22 ASN A 450 21.282 21.389 32.903 1.00 0.00 H ATOM 1101 HD21 ASN A 450 21.553 21.690 31.148 1.00 0.00 H ATOM 1102 H ASN A 450 16.453 18.493 33.452 1.00 0.00 H ATOM 1103 N GLU A 451 18.732 16.416 31.855 1.00 14.19 N ATOM 1104 CA GLU A 451 19.498 15.186 31.731 1.00 18.67 C ATOM 1105 C GLU A 451 19.010 14.346 30.557 1.00 15.13 C ATOM 1106 O GLU A 451 17.807 14.174 30.372 1.00 18.97 O ATOM 1107 CB GLU A 451 19.401 14.385 33.030 1.00 20.01 C ATOM 1108 CG GLU A 451 19.941 12.984 32.917 1.00 22.05 C ATOM 1109 CD GLU A 451 19.922 12.239 34.227 1.00 21.73 C ATOM 1110 OE1 GLU A 451 19.323 12.731 35.212 1.00 14.10 O ATOM 1111 OE2 GLU A 451 20.515 11.146 34.260 1.00 22.99 O ATOM 1112 HA GLU A 451 20.539 15.448 31.543 1.00 0.00 H ATOM 1113 HB2 GLU A 451 19.964 14.910 33.802 1.00 0.00 H ATOM 1114 HB3 GLU A 451 18.352 14.328 33.322 1.00 0.00 H ATOM 1115 HG2 GLU A 451 19.336 12.435 32.196 1.00 0.00 H ATOM 1116 HG3 GLU A 451 20.970 13.036 32.561 1.00 0.00 H ATOM 1117 H GLU A 451 17.702 16.385 31.714 1.00 0.00 H ATOM 1118 N THR A 452 19.951 13.822 29.773 1.00 14.49 N ATOM 1119 CA THR A 452 19.616 12.963 28.644 1.00 13.76 C ATOM 1120 C THR A 452 19.888 11.499 28.963 1.00 11.54 C ATOM 1121 O THR A 452 21.024 11.103 29.250 1.00 12.47 O ATOM 1122 CB THR A 452 20.401 13.351 27.373 1.00 17.29 C ATOM 1123 OG1 THR A 452 20.113 14.711 27.028 1.00 19.06 O ATOM 1124 CG2 THR A 452 20.018 12.454 26.205 1.00 16.38 C ATOM 1125 HA THR A 452 18.551 13.103 28.458 1.00 0.00 H ATOM 1126 HB THR A 452 21.465 13.231 27.578 1.00 0.00 H ATOM 1127 HG1 THR A 452 19.142 14.809 26.859 1.00 0.00 H ATOM 1128 HG23 THR A 452 20.234 11.416 26.459 1.00 0.00 H ATOM 1129 HG21 THR A 452 18.954 12.564 25.997 1.00 0.00 H ATOM 1130 HG22 THR A 452 20.593 12.741 25.324 1.00 0.00 H ATOM 1131 H THR A 452 20.950 14.031 29.972 1.00 0.00 H ATOM 1132 N LEU A 453 18.825 10.706 28.894 1.00 7.58 N ATOM 1133 CA LEU A 453 18.906 9.260 29.024 1.00 8.82 C ATOM 1134 C LEU A 453 18.925 8.645 27.633 1.00 19.98 C ATOM 1135 O LEU A 453 18.178 9.077 26.756 1.00 18.14 O ATOM 1136 CB LEU A 453 17.723 8.733 29.833 1.00 13.81 C ATOM 1137 CG LEU A 453 17.680 9.243 31.276 1.00 11.38 C ATOM 1138 CD1 LEU A 453 16.323 8.981 31.892 1.00 10.62 C ATOM 1139 CD2 LEU A 453 18.777 8.589 32.089 1.00 13.77 C ATOM 1140 HA LEU A 453 19.819 8.987 29.553 1.00 0.00 H ATOM 1141 HB2 LEU A 453 16.803 9.037 29.334 1.00 0.00 H ATOM 1142 HB3 LEU A 453 17.780 7.645 29.855 1.00 0.00 H ATOM 1143 HG LEU A 453 17.846 10.320 31.274 1.00 0.00 H ATOM 1144 HD21 LEU A 453 18.635 7.508 32.085 1.00 0.00 H ATOM 1145 HD22 LEU A 453 19.745 8.831 31.651 1.00 0.00 H ATOM 1146 HD23 LEU A 453 18.738 8.959 33.114 1.00 0.00 H ATOM 1147 HD11 LEU A 453 15.557 9.495 31.312 1.00 0.00 H ATOM 1148 HD12 LEU A 453 16.125 7.909 31.889 1.00 0.00 H ATOM 1149 HD13 LEU A 453 16.313 9.351 32.917 1.00 0.00 H ATOM 1150 H LEU A 453 17.892 11.139 28.740 1.00 0.00 H ATOM 1151 N GLN A 454 19.779 7.644 27.433 1.00 16.06 N ATOM 1152 CA GLN A 454 19.963 7.060 26.110 1.00 18.43 C ATOM 1153 C GLN A 454 19.653 5.567 26.069 1.00 15.33 C ATOM 1154 O GLN A 454 20.215 4.776 26.827 1.00 14.17 O ATOM 1155 CB GLN A 454 21.393 7.299 25.626 1.00 16.81 C ATOM 1156 CG GLN A 454 21.743 8.765 25.447 1.00 20.40 C ATOM 1157 CD GLN A 454 23.056 8.958 24.723 1.00 30.58 C ATOM 1158 OE1 GLN A 454 23.319 8.308 23.710 1.00 29.29 O ATOM 1159 NE2 GLN A 454 23.891 9.851 25.238 1.00 29.90 N ATOM 1160 HA GLN A 454 19.252 7.555 25.448 1.00 0.00 H ATOM 1161 HB2 GLN A 454 22.079 6.868 26.355 1.00 0.00 H ATOM 1162 HB3 GLN A 454 21.520 6.796 24.668 1.00 0.00 H ATOM 1163 HG2 GLN A 454 20.952 9.247 24.873 1.00 0.00 H ATOM 1164 HG3 GLN A 454 21.813 9.231 26.430 1.00 0.00 H ATOM 1165 HE22 GLN A 454 23.626 10.377 26.095 1.00 0.00 H ATOM 1166 HE21 GLN A 454 24.810 10.025 24.784 1.00 0.00 H ATOM 1167 H GLN A 454 20.325 7.271 28.236 1.00 0.00 H ATOM 1168 N TYR A 455 18.742 5.199 25.174 1.00 14.43 N ATOM 1169 CA TYR A 455 18.515 3.804 24.823 1.00 14.93 C ATOM 1170 C TYR A 455 19.350 3.477 23.599 1.00 16.52 C ATOM 1171 O TYR A 455 19.121 4.046 22.533 1.00 13.97 O ATOM 1172 CB TYR A 455 17.044 3.533 24.511 1.00 18.42 C ATOM 1173 CG TYR A 455 16.111 3.449 25.698 1.00 14.41 C ATOM 1174 CD1 TYR A 455 16.122 2.348 26.539 1.00 17.88 C ATOM 1175 CD2 TYR A 455 15.184 4.452 25.945 1.00 15.64 C ATOM 1176 CE1 TYR A 455 15.255 2.260 27.613 1.00 16.34 C ATOM 1177 CE2 TYR A 455 14.312 4.373 27.012 1.00 14.84 C ATOM 1178 CZ TYR A 455 14.348 3.273 27.840 1.00 14.57 C ATOM 1179 OH TYR A 455 13.480 3.190 28.905 1.00 22.60 O ATOM 1180 HA TYR A 455 18.798 3.181 25.672 1.00 0.00 H ATOM 1181 HB3 TYR A 455 16.987 2.585 23.976 1.00 0.00 H ATOM 1182 HB2 TYR A 455 16.688 4.335 23.865 1.00 0.00 H ATOM 1183 HD2 TYR A 455 15.144 5.318 25.284 1.00 0.00 H ATOM 1184 HE2 TYR A 455 13.599 5.176 27.198 1.00 0.00 H ATOM 1185 HE1 TYR A 455 15.289 1.395 28.276 1.00 0.00 H ATOM 1186 HD1 TYR A 455 16.826 1.537 26.351 1.00 0.00 H ATOM 1187 HH TYR A 455 13.638 2.343 29.393 1.00 0.00 H ATOM 1188 H TYR A 455 18.171 5.933 24.708 1.00 0.00 H ATOM 1189 N HIS A 456 20.316 2.577 23.747 1.00 15.76 N ATOM 1190 CA HIS A 456 21.097 2.110 22.605 1.00 19.53 C ATOM 1191 C HIS A 456 20.532 0.793 22.092 1.00 19.82 C ATOM 1192 O HIS A 456 19.755 0.133 22.778 1.00 18.06 O ATOM 1193 CB HIS A 456 22.569 1.960 22.985 1.00 20.06 C ATOM 1194 CG HIS A 456 23.286 3.266 23.119 1.00 16.95 C ATOM 1195 ND1 HIS A 456 23.494 3.880 24.335 1.00 23.84 N ATOM 1196 CD2 HIS A 456 23.819 4.088 22.186 1.00 19.50 C ATOM 1197 CE1 HIS A 456 24.138 5.018 24.147 1.00 23.98 C ATOM 1198 NE2 HIS A 456 24.346 5.169 22.851 1.00 33.62 N ATOM 1199 HA HIS A 456 21.031 2.850 21.807 1.00 0.00 H ATOM 1200 HB2 HIS A 456 22.628 1.434 23.938 1.00 0.00 H ATOM 1201 HB3 HIS A 456 23.066 1.370 22.215 1.00 0.00 H ATOM 1202 HD2 HIS A 456 23.829 3.924 21.109 1.00 0.00 H ATOM 1203 HE1 HIS A 456 24.445 5.714 24.928 1.00 0.00 H ATOM 1204 H HIS A 456 20.520 2.198 24.694 1.00 0.00 H ATOM 1205 N GLY A 457 20.909 0.422 20.873 1.00 20.81 N ATOM 1206 CA GLY A 457 20.412 -0.799 20.268 1.00 17.13 C ATOM 1207 C GLY A 457 18.945 -0.718 19.877 1.00 20.29 C ATOM 1208 O GLY A 457 18.283 -1.746 19.726 1.00 19.65 O ATOM 1209 HA3 GLY A 457 20.537 -1.615 20.980 1.00 0.00 H ATOM 1210 HA2 GLY A 457 20.999 -1.007 19.373 1.00 0.00 H ATOM 1211 H GLY A 457 21.574 1.019 20.342 1.00 0.00 H ATOM 1212 N ILE A 458 18.436 0.502 19.716 1.00 16.42 N ATOM 1213 CA ILE A 458 17.045 0.718 19.316 1.00 20.22 C ATOM 1214 C ILE A 458 16.927 0.720 17.797 1.00 13.36 C ATOM 1215 O ILE A 458 17.529 1.560 17.131 1.00 17.34 O ATOM 1216 CB ILE A 458 16.492 2.053 19.864 1.00 14.66 C ATOM 1217 CG1 ILE A 458 16.510 2.060 21.395 1.00 17.93 C ATOM 1218 CG2 ILE A 458 15.073 2.311 19.354 1.00 16.25 C ATOM 1219 CD1 ILE A 458 15.596 1.035 22.045 1.00 28.15 C ATOM 1220 HA ILE A 458 16.458 -0.099 19.736 1.00 0.00 H ATOM 1221 HB ILE A 458 17.138 2.853 19.503 1.00 0.00 H ATOM 1222 HG12 ILE A 458 17.530 1.863 21.724 1.00 0.00 H ATOM 1223 HG13 ILE A 458 16.206 3.050 21.734 1.00 0.00 H ATOM 1224 HD11 ILE A 458 14.566 1.223 21.740 1.00 0.00 H ATOM 1225 HD12 ILE A 458 15.892 0.034 21.730 1.00 0.00 H ATOM 1226 HD13 ILE A 458 15.676 1.115 23.129 1.00 0.00 H ATOM 1227 HG21 ILE A 458 15.082 2.357 18.265 1.00 0.00 H ATOM 1228 HG22 ILE A 458 14.419 1.502 19.679 1.00 0.00 H ATOM 1229 HG23 ILE A 458 14.710 3.257 19.756 1.00 0.00 H ATOM 1230 H ILE A 458 19.047 1.328 19.880 1.00 0.00 H ATOM 1231 N THR A 459 16.131 -0.208 17.267 1.00 19.00 N ATOM 1232 CA THR A 459 15.988 -0.403 15.822 1.00 19.21 C ATOM 1233 C THR A 459 14.628 0.071 15.313 1.00 21.64 C ATOM 1234 O THR A 459 13.766 0.447 16.100 1.00 17.75 O ATOM 1235 CB THR A 459 16.157 -1.889 15.445 1.00 19.81 C ATOM 1236 OG1 THR A 459 15.059 -2.646 15.970 1.00 29.84 O ATOM 1237 CG2 THR A 459 17.454 -2.440 15.995 1.00 18.16 C ATOM 1238 HA THR A 459 16.771 0.193 15.354 1.00 0.00 H ATOM 1239 HB THR A 459 16.177 -1.968 14.358 1.00 0.00 H ATOM 1240 HG1 THR A 459 15.170 -3.599 15.726 1.00 0.00 H ATOM 1241 HG23 THR A 459 18.290 -1.865 15.596 1.00 0.00 H ATOM 1242 HG21 THR A 459 17.446 -2.366 17.082 1.00 0.00 H ATOM 1243 HG22 THR A 459 17.557 -3.485 15.701 1.00 0.00 H ATOM 1244 H THR A 459 15.587 -0.821 17.907 1.00 0.00 H ATOM 1245 N GLU A 460 14.423 0.050 13.997 1.00 27.26 N ATOM 1246 CA GLU A 460 13.126 0.447 13.446 1.00 29.81 C ATOM 1247 C GLU A 460 12.024 -0.519 13.865 1.00 27.15 C ATOM 1248 O GLU A 460 10.874 -0.112 14.007 1.00 32.81 O ATOM 1249 CB GLU A 460 13.171 0.534 11.922 1.00 38.52 C ATOM 1250 CG GLU A 460 13.675 1.871 11.397 1.00 34.05 C ATOM 1251 CD GLU A 460 12.735 3.039 11.716 1.00 32.41 C ATOM 1252 OE1 GLU A 460 11.519 2.816 11.941 1.00 43.03 O ATOM 1253 OE2 GLU A 460 13.225 4.193 11.752 1.00 41.51 O ATOM 1254 HA GLU A 460 12.902 1.434 13.850 1.00 0.00 H ATOM 1255 HB2 GLU A 460 13.830 -0.251 11.552 1.00 0.00 H ATOM 1256 HB3 GLU A 460 12.164 0.372 11.538 1.00 0.00 H ATOM 1257 HG2 GLU A 460 14.647 2.076 11.846 1.00 0.00 H ATOM 1258 HG3 GLU A 460 13.784 1.800 10.315 1.00 0.00 H ATOM 1259 H GLU A 460 15.187 -0.250 13.358 1.00 0.00 H ATOM 1260 N GLU A 461 12.363 -1.790 14.070 1.00 30.13 N ATOM 1261 CA GLU A 461 11.378 -2.746 14.573 1.00 33.07 C ATOM 1262 C GLU A 461 10.896 -2.294 15.946 1.00 26.99 C ATOM 1263 O GLU A 461 9.724 -2.442 16.288 1.00 26.85 O ATOM 1264 CB GLU A 461 11.954 -4.162 14.671 1.00 41.59 C ATOM 1265 CG GLU A 461 12.321 -4.796 13.340 1.00 45.55 C ATOM 1266 CD GLU A 461 12.312 -6.313 13.390 1.00 46.56 C ATOM 1267 OE1 GLU A 461 12.326 -6.877 14.507 1.00 53.02 O ATOM 1268 OE2 GLU A 461 12.290 -6.941 12.308 1.00 46.71 O ATOM 1269 HA GLU A 461 10.546 -2.776 13.869 1.00 0.00 H ATOM 1270 HB2 GLU A 461 12.853 -4.121 15.286 1.00 0.00 H ATOM 1271 HB3 GLU A 461 11.212 -4.797 15.156 1.00 0.00 H ATOM 1272 HG2 GLU A 461 11.604 -4.468 12.588 1.00 0.00 H ATOM 1273 HG3 GLU A 461 13.320 -4.462 13.058 1.00 0.00 H ATOM 1274 H GLU A 461 13.334 -2.105 13.871 1.00 0.00 H ATOM 1275 N ASP A 462 11.816 -1.742 16.730 1.00 27.52 N ATOM 1276 CA ASP A 462 11.493 -1.239 18.058 1.00 21.56 C ATOM 1277 C ASP A 462 10.652 0.032 17.968 1.00 24.87 C ATOM 1278 O ASP A 462 9.658 0.175 18.675 1.00 26.30 O ATOM 1279 CB ASP A 462 12.776 -0.982 18.850 1.00 26.67 C ATOM 1280 CG ASP A 462 13.618 -2.235 19.016 1.00 29.85 C ATOM 1281 OD1 ASP A 462 13.039 -3.318 19.243 1.00 27.86 O ATOM 1282 OD2 ASP A 462 14.858 -2.139 18.911 1.00 25.52 O ATOM 1283 HA ASP A 462 10.905 -1.994 18.580 1.00 0.00 H ATOM 1284 HB2 ASP A 462 13.366 -0.231 18.325 1.00 0.00 H ATOM 1285 HB3 ASP A 462 12.508 -0.607 19.838 1.00 0.00 H ATOM 1286 H ASP A 462 12.794 -1.667 16.385 1.00 0.00 H ATOM 1287 N MET A 463 11.046 0.947 17.087 1.00 22.79 N ATOM 1288 CA MET A 463 10.315 2.199 16.904 1.00 23.61 C ATOM 1289 C MET A 463 8.876 1.957 16.448 1.00 30.83 C ATOM 1290 O MET A 463 7.967 2.695 16.830 1.00 27.02 O ATOM 1291 CB MET A 463 11.037 3.092 15.892 1.00 26.88 C ATOM 1292 CG MET A 463 12.422 3.526 16.335 1.00 21.35 C ATOM 1293 SD MET A 463 12.402 4.476 17.867 1.00 24.94 S ATOM 1294 CE MET A 463 11.805 6.053 17.264 1.00 24.16 C ATOM 1295 HA MET A 463 10.279 2.700 17.872 1.00 0.00 H ATOM 1296 HB2 MET A 463 11.132 2.543 14.955 1.00 0.00 H ATOM 1297 HB3 MET A 463 10.433 3.984 15.729 1.00 0.00 H ATOM 1298 HG2 MET A 463 12.862 4.141 15.550 1.00 0.00 H ATOM 1299 HG3 MET A 463 13.034 2.637 16.485 1.00 0.00 H ATOM 1300 HE1 MET A 463 12.497 6.440 16.516 1.00 0.00 H ATOM 1301 HE2 MET A 463 10.820 5.920 16.816 1.00 0.00 H ATOM 1302 HE3 MET A 463 11.736 6.756 18.094 1.00 0.00 H ATOM 1303 H MET A 463 11.895 0.767 16.514 1.00 0.00 H ATOM 1304 N GLN A 464 8.670 0.922 15.638 1.00 27.65 N ATOM 1305 CA GLN A 464 7.335 0.603 15.133 1.00 28.88 C ATOM 1306 C GLN A 464 6.470 -0.108 16.174 1.00 28.72 C ATOM 1307 O GLN A 464 5.252 0.061 16.192 1.00 36.92 O ATOM 1308 CB GLN A 464 7.434 -0.266 13.874 1.00 34.13 C ATOM 1309 CG GLN A 464 7.983 0.455 12.655 1.00 35.57 C ATOM 1310 CD GLN A 464 7.210 1.715 12.327 1.00 40.32 C ATOM 1311 OE1 GLN A 464 5.982 1.734 12.383 1.00 50.08 O ATOM 1312 NE2 GLN A 464 7.929 2.780 11.993 1.00 48.82 N ATOM 1313 HA GLN A 464 6.855 1.552 14.894 1.00 0.00 H ATOM 1314 HB2 GLN A 464 8.087 -1.111 14.093 1.00 0.00 H ATOM 1315 HB3 GLN A 464 6.436 -0.632 13.633 1.00 0.00 H ATOM 1316 HG2 GLN A 464 9.022 0.722 12.846 1.00 0.00 H ATOM 1317 HG3 GLN A 464 7.934 -0.218 11.799 1.00 0.00 H ATOM 1318 HE22 GLN A 464 8.967 2.717 11.959 1.00 0.00 H ATOM 1319 HE21 GLN A 464 7.455 3.677 11.766 1.00 0.00 H ATOM 1320 H GLN A 464 9.476 0.327 15.358 1.00 0.00 H ATOM 1321 N ARG A 465 7.101 -0.894 17.042 1.00 21.47 N ATOM 1322 CA ARG A 465 6.372 -1.758 17.969 1.00 19.28 C ATOM 1323 C ARG A 465 6.147 -1.152 19.353 1.00 31.93 C ATOM 1324 O ARG A 465 5.151 -1.463 20.009 1.00 21.92 O ATOM 1325 CB ARG A 465 7.110 -3.089 18.141 1.00 27.87 C ATOM 1326 CG ARG A 465 6.958 -4.067 16.987 1.00 32.27 C ATOM 1327 CD ARG A 465 7.658 -5.383 17.308 1.00 38.82 C ATOM 1328 NE ARG A 465 7.855 -6.219 16.124 1.00 44.02 N ATOM 1329 CZ ARG A 465 7.007 -7.155 15.701 1.00 45.92 C ATOM 1330 NH1 ARG A 465 5.879 -7.398 16.356 1.00 40.46 N ATOM 1331 NH2 ARG A 465 7.290 -7.854 14.610 1.00 50.54 N ATOM 1332 HA ARG A 465 5.390 -1.898 17.516 1.00 0.00 H ATOM 1333 HB2 ARG A 465 8.171 -2.873 18.263 1.00 0.00 H ATOM 1334 HB3 ARG A 465 6.732 -3.570 19.043 1.00 0.00 H ATOM 1335 HG2 ARG A 465 5.899 -4.257 16.814 1.00 0.00 H ATOM 1336 HG3 ARG A 465 7.400 -3.635 16.089 1.00 0.00 H ATOM 1337 HD2 ARG A 465 7.053 -5.934 18.028 1.00 0.00 H ATOM 1338 HD3 ARG A 465 8.631 -5.163 17.746 1.00 0.00 H ATOM 1339 HE ARG A 465 8.723 -6.071 15.570 1.00 0.00 H ATOM 1340 HH12 ARG A 465 5.227 -8.132 16.014 1.00 0.00 H ATOM 1341 HH11 ARG A 465 5.647 -6.854 17.212 1.00 0.00 H ATOM 1342 HH22 ARG A 465 6.631 -8.586 14.276 1.00 0.00 H ATOM 1343 HH21 ARG A 465 8.171 -7.670 14.089 1.00 0.00 H ATOM 1344 H ARG A 465 8.141 -0.894 17.062 1.00 0.00 H ATOM 1345 N LYS A 466 7.065 -0.298 19.802 1.00 21.42 N ATOM 1346 CA LYS A 466 7.121 0.062 21.219 1.00 20.24 C ATOM 1347 C LYS A 466 6.586 1.441 21.577 1.00 18.00 C ATOM 1348 O LYS A 466 6.500 2.344 20.743 1.00 16.28 O ATOM 1349 CB LYS A 466 8.561 -0.045 21.719 1.00 17.32 C ATOM 1350 CG LYS A 466 9.067 -1.471 21.800 1.00 26.23 C ATOM 1351 CD LYS A 466 10.520 -1.522 22.225 1.00 32.42 C ATOM 1352 CE LYS A 466 11.142 -2.872 21.907 1.00 41.81 C ATOM 1353 NZ LYS A 466 10.502 -3.986 22.659 1.00 46.54 N ATOM 1354 HA LYS A 466 6.455 -0.649 21.708 1.00 0.00 H ATOM 1355 HB2 LYS A 466 9.205 0.512 21.039 1.00 0.00 H ATOM 1356 HB3 LYS A 466 8.615 0.398 22.713 1.00 0.00 H ATOM 1357 HG2 LYS A 466 8.466 -2.020 22.525 1.00 0.00 H ATOM 1358 HG3 LYS A 466 8.968 -1.938 20.820 1.00 0.00 H ATOM 1359 HD2 LYS A 466 11.072 -0.744 21.698 1.00 0.00 H ATOM 1360 HD3 LYS A 466 10.582 -1.346 23.299 1.00 0.00 H ATOM 1361 HE2 LYS A 466 12.201 -2.839 22.165 1.00 0.00 H ATOM 1362 HE3 LYS A 466 11.035 -3.064 20.839 1.00 0.00 H ATOM 1363 HZ1 LYS A 466 10.605 -3.818 23.680 1.00 0.00 H ATOM 1364 HZ2 LYS A 466 9.492 -4.033 22.415 1.00 0.00 H ATOM 1365 HZ3 LYS A 466 10.963 -4.883 22.406 1.00 0.00 H ATOM 1366 H LYS A 466 7.749 0.117 19.138 1.00 0.00 H ATOM 1367 N THR A 467 6.235 1.570 22.853 1.00 15.83 N ATOM 1368 CA THR A 467 5.768 2.814 23.441 1.00 21.66 C ATOM 1369 C THR A 467 6.698 3.201 24.582 1.00 15.40 C ATOM 1370 O THR A 467 7.078 2.357 25.393 1.00 23.46 O ATOM 1371 CB THR A 467 4.322 2.678 23.964 1.00 21.98 C ATOM 1372 OG1 THR A 467 3.415 2.637 22.855 1.00 27.22 O ATOM 1373 CG2 THR A 467 3.943 3.842 24.887 1.00 23.72 C ATOM 1374 HA THR A 467 5.773 3.588 22.674 1.00 0.00 H ATOM 1375 HB THR A 467 4.258 1.755 24.540 1.00 0.00 H ATOM 1376 HG1 THR A 467 2.488 2.550 23.191 1.00 0.00 H ATOM 1377 HG23 THR A 467 4.632 3.874 25.731 1.00 0.00 H ATOM 1378 HG21 THR A 467 4.002 4.778 24.332 1.00 0.00 H ATOM 1379 HG22 THR A 467 2.926 3.698 25.252 1.00 0.00 H ATOM 1380 H THR A 467 6.298 0.732 23.466 1.00 0.00 H ATOM 1381 N LEU A 468 7.064 4.475 24.637 1.00 18.48 N ATOM 1382 CA LEU A 468 7.851 5.000 25.744 1.00 17.34 C ATOM 1383 C LEU A 468 6.923 5.529 26.825 1.00 16.38 C ATOM 1384 O LEU A 468 6.162 6.459 26.577 1.00 18.31 O ATOM 1385 CB LEU A 468 8.778 6.117 25.266 1.00 16.65 C ATOM 1386 CG LEU A 468 9.636 6.792 26.336 1.00 18.35 C ATOM 1387 CD1 LEU A 468 10.646 5.810 26.897 1.00 19.53 C ATOM 1388 CD2 LEU A 468 10.329 8.018 25.766 1.00 20.25 C ATOM 1389 HA LEU A 468 8.462 4.194 26.150 1.00 0.00 H ATOM 1390 HB2 LEU A 468 9.450 5.694 24.520 1.00 0.00 H ATOM 1391 HB3 LEU A 468 8.160 6.886 24.802 1.00 0.00 H ATOM 1392 HG LEU A 468 8.988 7.118 27.150 1.00 0.00 H ATOM 1393 HD21 LEU A 468 10.968 7.719 24.935 1.00 0.00 H ATOM 1394 HD22 LEU A 468 9.579 8.726 25.413 1.00 0.00 H ATOM 1395 HD23 LEU A 468 10.935 8.485 26.542 1.00 0.00 H ATOM 1396 HD11 LEU A 468 10.121 4.965 27.342 1.00 0.00 H ATOM 1397 HD12 LEU A 468 11.292 5.456 26.093 1.00 0.00 H ATOM 1398 HD13 LEU A 468 11.249 6.306 27.658 1.00 0.00 H ATOM 1399 H LEU A 468 6.781 5.116 23.869 1.00 0.00 H ATOM 1400 N ARG A 469 6.984 4.939 28.016 1.00 15.27 N ATOM 1401 CA ARG A 469 6.229 5.453 29.151 1.00 13.39 C ATOM 1402 C ARG A 469 7.156 6.237 30.070 1.00 17.70 C ATOM 1403 O ARG A 469 8.186 5.727 30.516 1.00 19.07 O ATOM 1404 CB ARG A 469 5.545 4.326 29.927 1.00 19.90 C ATOM 1405 CG ARG A 469 4.766 4.829 31.139 1.00 26.18 C ATOM 1406 CD ARG A 469 3.744 3.820 31.637 1.00 35.59 C ATOM 1407 NE ARG A 469 4.358 2.572 32.081 1.00 38.86 N ATOM 1408 CZ ARG A 469 4.818 2.347 33.309 1.00 45.86 C ATOM 1409 NH1 ARG A 469 4.747 3.288 34.244 1.00 40.04 N ATOM 1410 NH2 ARG A 469 5.357 1.172 33.603 1.00 43.56 N ATOM 1411 HA ARG A 469 5.449 6.112 28.770 1.00 0.00 H ATOM 1412 HB2 ARG A 469 4.855 3.812 29.258 1.00 0.00 H ATOM 1413 HB3 ARG A 469 6.307 3.626 30.269 1.00 0.00 H ATOM 1414 HG2 ARG A 469 5.470 5.040 31.944 1.00 0.00 H ATOM 1415 HG3 ARG A 469 4.246 5.746 30.864 1.00 0.00 H ATOM 1416 HD2 ARG A 469 3.048 3.599 30.828 1.00 0.00 H ATOM 1417 HD3 ARG A 469 3.199 4.258 32.473 1.00 0.00 H ATOM 1418 HE ARG A 469 4.442 1.802 31.386 1.00 0.00 H ATOM 1419 HH12 ARG A 469 5.110 3.099 35.200 1.00 0.00 H ATOM 1420 HH11 ARG A 469 4.328 4.213 34.020 1.00 0.00 H ATOM 1421 HH22 ARG A 469 5.718 0.991 34.561 1.00 0.00 H ATOM 1422 HH21 ARG A 469 5.419 0.432 32.875 1.00 0.00 H ATOM 1423 H ARG A 469 7.581 4.096 28.139 1.00 0.00 H ATOM 1424 N ILE A 470 6.776 7.482 30.337 1.00 11.99 N ATOM 1425 CA ILE A 470 7.530 8.368 31.214 1.00 13.38 C ATOM 1426 C ILE A 470 6.702 8.629 32.464 1.00 17.44 C ATOM 1427 O ILE A 470 5.613 9.186 32.375 1.00 12.98 O ATOM 1428 CB ILE A 470 7.857 9.712 30.533 1.00 14.70 C ATOM 1429 CG1 ILE A 470 8.512 9.486 29.168 1.00 17.78 C ATOM 1430 CG2 ILE A 470 8.764 10.555 31.420 1.00 18.00 C ATOM 1431 CD1 ILE A 470 8.421 10.689 28.254 1.00 20.15 C ATOM 1432 HA ILE A 470 8.475 7.884 31.461 1.00 0.00 H ATOM 1433 HB ILE A 470 6.921 10.249 30.380 1.00 0.00 H ATOM 1434 HG12 ILE A 470 9.564 9.248 29.324 1.00 0.00 H ATOM 1435 HG13 ILE A 470 8.019 8.644 28.682 1.00 0.00 H ATOM 1436 HD11 ILE A 470 7.373 10.933 28.080 1.00 0.00 H ATOM 1437 HD12 ILE A 470 8.920 11.538 28.722 1.00 0.00 H ATOM 1438 HD13 ILE A 470 8.905 10.460 27.305 1.00 0.00 H ATOM 1439 HG21 ILE A 470 8.263 10.751 32.368 1.00 0.00 H ATOM 1440 HG22 ILE A 470 9.693 10.016 31.604 1.00 0.00 H ATOM 1441 HG23 ILE A 470 8.983 11.499 30.921 1.00 0.00 H ATOM 1442 H ILE A 470 5.902 7.840 29.901 1.00 0.00 H ATOM 1443 N SER A 471 7.218 8.228 33.622 1.00 14.85 N ATOM 1444 CA SER A 471 6.505 8.421 34.883 1.00 10.94 C ATOM 1445 C SER A 471 7.320 9.266 35.854 1.00 16.30 C ATOM 1446 O SER A 471 8.548 9.193 35.885 1.00 12.20 O ATOM 1447 CB SER A 471 6.162 7.072 35.521 1.00 16.89 C ATOM 1448 OG SER A 471 7.292 6.223 35.569 1.00 30.40 O ATOM 1449 HA SER A 471 5.579 8.952 34.661 1.00 0.00 H ATOM 1450 HB2 SER A 471 5.380 6.590 34.934 1.00 0.00 H ATOM 1451 HB3 SER A 471 5.801 7.240 36.536 1.00 0.00 H ATOM 1452 HG SER A 471 7.622 6.062 34.649 1.00 0.00 H ATOM 1453 H SER A 471 8.150 7.767 33.631 1.00 0.00 H ATOM 1454 N VAL A 472 6.611 10.072 36.637 1.00 15.97 N ATOM 1455 CA VAL A 472 7.223 10.963 37.609 1.00 9.49 C ATOM 1456 C VAL A 472 6.843 10.490 39.005 1.00 13.21 C ATOM 1457 O VAL A 472 5.662 10.321 39.308 1.00 12.86 O ATOM 1458 CB VAL A 472 6.770 12.417 37.403 1.00 12.60 C ATOM 1459 CG1 VAL A 472 7.423 13.337 38.427 1.00 15.97 C ATOM 1460 CG2 VAL A 472 7.090 12.872 35.981 1.00 11.07 C ATOM 1461 HA VAL A 472 8.305 10.938 37.481 1.00 0.00 H ATOM 1462 HB VAL A 472 5.691 12.468 37.548 1.00 0.00 H ATOM 1463 HG11 VAL A 472 7.141 13.019 39.431 1.00 0.00 H ATOM 1464 HG12 VAL A 472 8.507 13.287 38.319 1.00 0.00 H ATOM 1465 HG13 VAL A 472 7.087 14.360 38.261 1.00 0.00 H ATOM 1466 HG21 VAL A 472 8.165 12.805 35.813 1.00 0.00 H ATOM 1467 HG22 VAL A 472 6.569 12.231 35.270 1.00 0.00 H ATOM 1468 HG23 VAL A 472 6.764 13.904 35.849 1.00 0.00 H ATOM 1469 H VAL A 472 5.575 10.065 36.551 1.00 0.00 H ATOM 1470 N CYS A 473 7.851 10.270 39.840 1.00 11.49 N ATOM 1471 CA CYS A 473 7.636 9.772 41.194 1.00 12.96 C ATOM 1472 C CYS A 473 8.435 10.573 42.205 1.00 14.43 C ATOM 1473 O CYS A 473 9.455 11.165 41.866 1.00 13.28 O ATOM 1474 CB CYS A 473 8.028 8.300 41.290 1.00 15.34 C ATOM 1475 SG CYS A 473 7.132 7.233 40.164 1.00 18.31 S ATOM 1476 HA CYS A 473 6.575 9.880 41.421 1.00 0.00 H ATOM 1477 HB2 CYS A 473 7.839 7.960 42.308 1.00 0.00 H ATOM 1478 HB3 CYS A 473 9.092 8.213 41.071 1.00 0.00 H ATOM 1479 HG CYS A 473 7.558 5.931 40.329 1.00 0.00 H ATOM 1480 H CYS A 473 8.822 10.458 39.520 1.00 0.00 H ATOM 1481 N ASP A 474 7.955 10.581 43.445 1.00 15.81 N ATOM 1482 CA ASP A 474 8.699 11.136 44.570 1.00 14.44 C ATOM 1483 C ASP A 474 9.310 10.004 45.386 1.00 18.46 C ATOM 1484 O ASP A 474 8.604 9.087 45.795 1.00 21.50 O ATOM 1485 CB ASP A 474 7.789 11.980 45.468 1.00 19.00 C ATOM 1486 CG ASP A 474 7.579 13.389 44.945 1.00 21.85 C ATOM 1487 OD1 ASP A 474 8.487 13.933 44.283 1.00 14.81 O ATOM 1488 OD2 ASP A 474 6.500 13.960 45.217 1.00 22.18 O ATOM 1489 HA ASP A 474 9.487 11.778 44.177 1.00 0.00 H ATOM 1490 HB2 ASP A 474 6.819 11.488 45.540 1.00 0.00 H ATOM 1491 HB3 ASP A 474 8.239 12.041 46.459 1.00 0.00 H ATOM 1492 H ASP A 474 7.013 10.176 43.619 1.00 0.00 H ATOM 1493 N GLU A 475 10.616 10.069 45.626 1.00 14.41 N ATOM 1494 CA GLU A 475 11.274 9.106 46.503 1.00 13.75 C ATOM 1495 C GLU A 475 10.979 9.473 47.955 1.00 17.83 C ATOM 1496 O GLU A 475 11.040 10.645 48.323 1.00 20.29 O ATOM 1497 CB GLU A 475 12.783 9.080 46.246 1.00 13.65 C ATOM 1498 CG GLU A 475 13.490 7.886 46.866 1.00 19.90 C ATOM 1499 CD GLU A 475 14.928 7.732 46.399 1.00 21.52 C ATOM 1500 OE1 GLU A 475 15.327 8.406 45.426 1.00 24.22 O ATOM 1501 OE2 GLU A 475 15.660 6.927 47.010 1.00 24.07 O ATOM 1502 HA GLU A 475 10.888 8.108 46.297 1.00 0.00 H ATOM 1503 HB2 GLU A 475 12.948 9.056 45.169 1.00 0.00 H ATOM 1504 HB3 GLU A 475 13.218 9.990 46.659 1.00 0.00 H ATOM 1505 HG2 GLU A 475 13.488 8.006 47.949 1.00 0.00 H ATOM 1506 HG3 GLU A 475 12.941 6.982 46.601 1.00 0.00 H ATOM 1507 H GLU A 475 11.180 10.821 45.180 1.00 0.00 H ATOM 1508 N ASP A 476 10.650 8.480 48.776 1.00 19.97 N ATOM 1509 CA ASP A 476 10.304 8.751 50.164 1.00 21.80 C ATOM 1510 C ASP A 476 11.504 8.550 51.097 1.00 21.61 C ATOM 1511 O ASP A 476 12.637 8.381 50.646 1.00 16.78 O ATOM 1512 CB ASP A 476 9.115 7.882 50.598 1.00 25.28 C ATOM 1513 CG ASP A 476 9.397 6.389 50.525 1.00 35.54 C ATOM 1514 OD1 ASP A 476 10.572 5.975 50.412 1.00 40.31 O ATOM 1515 OD2 ASP A 476 8.418 5.619 50.613 1.00 40.01 O ATOM 1516 HA ASP A 476 10.012 9.799 50.238 1.00 0.00 H ATOM 1517 HB2 ASP A 476 8.859 8.135 51.627 1.00 0.00 H ATOM 1518 HB3 ASP A 476 8.268 8.106 49.949 1.00 0.00 H ATOM 1519 H ASP A 476 10.640 7.502 48.424 1.00 0.00 H ATOM 1520 N LYS A 477 11.243 8.567 52.398 1.00 19.11 N ATOM 1521 CA LYS A 477 12.303 8.565 53.402 1.00 24.44 C ATOM 1522 C LYS A 477 13.133 7.279 53.438 1.00 19.94 C ATOM 1523 O LYS A 477 14.271 7.292 53.908 1.00 21.01 O ATOM 1524 CB LYS A 477 11.688 8.818 54.778 1.00 21.45 C ATOM 1525 CG LYS A 477 11.147 10.227 54.937 1.00 21.26 C ATOM 1526 CD LYS A 477 10.157 10.342 56.083 1.00 32.14 C ATOM 1527 CE LYS A 477 9.736 11.790 56.280 1.00 30.99 C ATOM 1528 NZ LYS A 477 8.542 11.926 57.153 1.00 32.28 N ATOM 1529 HA LYS A 477 12.995 9.360 53.123 1.00 0.00 H ATOM 1530 HB2 LYS A 477 10.870 8.113 54.928 1.00 0.00 H ATOM 1531 HB3 LYS A 477 12.453 8.652 55.536 1.00 0.00 H ATOM 1532 HG2 LYS A 477 11.981 10.903 55.125 1.00 0.00 H ATOM 1533 HG3 LYS A 477 10.648 10.517 54.012 1.00 0.00 H ATOM 1534 HD2 LYS A 477 9.277 9.740 55.859 1.00 0.00 H ATOM 1535 HD3 LYS A 477 10.623 9.976 56.998 1.00 0.00 H ATOM 1536 HE2 LYS A 477 9.507 12.223 55.306 1.00 0.00 H ATOM 1537 HE3 LYS A 477 10.564 12.336 56.733 1.00 0.00 H ATOM 1538 HZ1 LYS A 477 7.742 11.416 56.726 1.00 0.00 H ATOM 1539 HZ2 LYS A 477 8.751 11.524 58.089 1.00 0.00 H ATOM 1540 HZ3 LYS A 477 8.300 12.932 57.253 1.00 0.00 H ATOM 1541 H LYS A 477 10.252 8.582 52.712 1.00 0.00 H ATOM 1542 N PHE A 478 12.570 6.181 52.940 1.00 16.46 N ATOM 1543 CA PHE A 478 13.228 4.876 52.993 1.00 22.76 C ATOM 1544 C PHE A 478 13.651 4.355 51.619 1.00 23.78 C ATOM 1545 O PHE A 478 14.080 3.207 51.488 1.00 31.81 O ATOM 1546 CB PHE A 478 12.303 3.859 53.658 1.00 29.60 C ATOM 1547 CG PHE A 478 11.928 4.217 55.067 1.00 34.12 C ATOM 1548 CD1 PHE A 478 12.876 4.715 55.945 1.00 39.22 C ATOM 1549 CD2 PHE A 478 10.628 4.065 55.511 1.00 43.84 C ATOM 1550 CE1 PHE A 478 12.534 5.049 57.240 1.00 39.78 C ATOM 1551 CE2 PHE A 478 10.280 4.399 56.805 1.00 48.17 C ATOM 1552 CZ PHE A 478 11.234 4.891 57.670 1.00 40.97 C ATOM 1553 HA PHE A 478 14.139 5.010 53.577 1.00 0.00 H ATOM 1554 HB2 PHE A 478 11.390 3.785 53.067 1.00 0.00 H ATOM 1555 HB3 PHE A 478 12.806 2.892 53.670 1.00 0.00 H ATOM 1556 HD2 PHE A 478 9.869 3.677 54.832 1.00 0.00 H ATOM 1557 HE2 PHE A 478 9.251 4.274 57.142 1.00 0.00 H ATOM 1558 HZ PHE A 478 10.961 5.155 58.692 1.00 0.00 H ATOM 1559 HE1 PHE A 478 13.291 5.437 57.922 1.00 0.00 H ATOM 1560 HD1 PHE A 478 13.905 4.845 55.609 1.00 0.00 H ATOM 1561 H PHE A 478 11.631 6.253 52.499 1.00 0.00 H ATOM 1562 N GLY A 479 13.530 5.195 50.599 1.00 19.80 N ATOM 1563 CA GLY A 479 13.981 4.833 49.267 1.00 21.37 C ATOM 1564 C GLY A 479 12.884 4.225 48.412 1.00 21.34 C ATOM 1565 O GLY A 479 13.093 3.948 47.233 1.00 26.17 O ATOM 1566 HA3 GLY A 479 14.791 4.109 49.359 1.00 0.00 H ATOM 1567 HA2 GLY A 479 14.352 5.730 48.770 1.00 0.00 H ATOM 1568 H GLY A 479 13.104 6.131 50.757 1.00 0.00 H ATOM 1569 N HIS A 480 11.717 4.007 49.008 1.00 24.27 N ATOM 1570 CA HIS A 480 10.534 3.642 48.242 1.00 25.17 C ATOM 1571 C HIS A 480 10.003 4.915 47.595 1.00 29.17 C ATOM 1572 O HIS A 480 10.697 5.931 47.580 1.00 27.80 O ATOM 1573 CB HIS A 480 9.483 2.979 49.132 1.00 26.33 C ATOM 1574 CG HIS A 480 9.957 1.719 49.786 1.00 32.67 C ATOM 1575 ND1 HIS A 480 9.970 1.550 51.153 1.00 39.17 N ATOM 1576 CD2 HIS A 480 10.435 0.566 49.259 1.00 39.07 C ATOM 1577 CE1 HIS A 480 10.435 0.347 51.442 1.00 40.25 C ATOM 1578 NE2 HIS A 480 10.725 -0.269 50.311 1.00 44.77 N ATOM 1579 HA HIS A 480 10.785 2.910 47.475 1.00 0.00 H ATOM 1580 HB2 HIS A 480 9.197 3.685 49.911 1.00 0.00 H ATOM 1581 HB3 HIS A 480 8.613 2.743 48.520 1.00 0.00 H ATOM 1582 HD2 HIS A 480 10.565 0.343 48.200 1.00 0.00 H ATOM 1583 HE1 HIS A 480 10.558 -0.066 52.443 1.00 0.00 H ATOM 1584 H HIS A 480 11.647 4.099 50.042 1.00 0.00 H ATOM 1585 N ASN A 481 8.791 4.881 47.055 1.00 25.99 N ATOM 1586 CA ASN A 481 8.307 6.038 46.317 1.00 19.62 C ATOM 1587 C ASN A 481 6.799 6.126 46.177 1.00 26.60 C ATOM 1588 O ASN A 481 6.073 5.170 46.454 1.00 24.97 O ATOM 1589 CB ASN A 481 8.931 6.051 44.923 1.00 26.33 C ATOM 1590 CG ASN A 481 8.388 4.954 44.037 1.00 25.96 C ATOM 1591 OD1 ASN A 481 7.358 5.125 43.383 1.00 27.51 O ATOM 1592 ND2 ASN A 481 9.077 3.819 44.008 1.00 29.58 N ATOM 1593 HA ASN A 481 8.607 6.903 46.908 1.00 0.00 H ATOM 1594 HB2 ASN A 481 8.723 7.014 44.456 1.00 0.00 H ATOM 1595 HB3 ASN A 481 10.009 5.921 45.021 1.00 0.00 H ATOM 1596 HD22 ASN A 481 9.942 3.721 44.578 1.00 0.00 H ATOM 1597 HD21 ASN A 481 8.752 3.028 43.416 1.00 0.00 H ATOM 1598 H ASN A 481 8.193 4.036 47.158 1.00 0.00 H ATOM 1599 N GLU A 482 6.350 7.302 45.749 1.00 17.61 N ATOM 1600 CA GLU A 482 4.958 7.537 45.408 1.00 16.64 C ATOM 1601 C GLU A 482 4.862 7.996 43.962 1.00 15.59 C ATOM 1602 O GLU A 482 5.544 8.928 43.546 1.00 11.35 O ATOM 1603 CB GLU A 482 4.327 8.581 46.329 1.00 26.00 C ATOM 1604 CG GLU A 482 2.884 8.894 45.967 1.00 28.17 C ATOM 1605 CD GLU A 482 2.126 9.555 47.096 1.00 35.87 C ATOM 1606 OE1 GLU A 482 2.766 10.257 47.906 1.00 26.94 O ATOM 1607 OE2 GLU A 482 0.892 9.365 47.175 1.00 28.00 O ATOM 1608 HA GLU A 482 4.411 6.603 45.537 1.00 0.00 H ATOM 1609 HB2 GLU A 482 4.356 8.206 47.352 1.00 0.00 H ATOM 1610 HB3 GLU A 482 4.909 9.500 46.264 1.00 0.00 H ATOM 1611 HG2 GLU A 482 2.878 9.562 45.105 1.00 0.00 H ATOM 1612 HG3 GLU A 482 2.380 7.963 45.707 1.00 0.00 H ATOM 1613 H GLU A 482 7.025 8.088 45.654 1.00 0.00 H ATOM 1614 N PHE A 483 4.005 7.329 43.205 1.00 15.26 N ATOM 1615 CA PHE A 483 3.749 7.695 41.820 1.00 15.34 C ATOM 1616 C PHE A 483 2.909 8.972 41.737 1.00 21.35 C ATOM 1617 O PHE A 483 1.870 9.080 42.389 1.00 17.12 O ATOM 1618 CB PHE A 483 3.049 6.535 41.114 1.00 18.99 C ATOM 1619 CG PHE A 483 2.527 6.871 39.751 1.00 18.67 C ATOM 1620 CD1 PHE A 483 3.365 6.850 38.651 1.00 17.11 C ATOM 1621 CD2 PHE A 483 1.193 7.187 39.567 1.00 14.20 C ATOM 1622 CE1 PHE A 483 2.883 7.150 37.393 1.00 16.00 C ATOM 1623 CE2 PHE A 483 0.705 7.487 38.312 1.00 16.88 C ATOM 1624 CZ PHE A 483 1.551 7.465 37.224 1.00 18.59 C ATOM 1625 HA PHE A 483 4.698 7.897 41.323 1.00 0.00 H ATOM 1626 HB2 PHE A 483 3.760 5.715 41.015 1.00 0.00 H ATOM 1627 HB3 PHE A 483 2.210 6.214 41.732 1.00 0.00 H ATOM 1628 HD2 PHE A 483 0.519 7.199 40.424 1.00 0.00 H ATOM 1629 HE2 PHE A 483 -0.347 7.741 38.181 1.00 0.00 H ATOM 1630 HZ PHE A 483 1.167 7.696 36.230 1.00 0.00 H ATOM 1631 HE1 PHE A 483 3.554 7.138 36.534 1.00 0.00 H ATOM 1632 HD1 PHE A 483 4.417 6.594 38.779 1.00 0.00 H ATOM 1633 H PHE A 483 3.498 6.518 43.613 1.00 0.00 H ATOM 1634 N ILE A 484 3.362 9.939 40.941 1.00 14.26 N ATOM 1635 CA ILE A 484 2.623 11.186 40.760 1.00 18.18 C ATOM 1636 C ILE A 484 1.783 11.125 39.491 1.00 18.02 C ATOM 1637 O ILE A 484 0.569 11.300 39.534 1.00 18.20 O ATOM 1638 CB ILE A 484 3.560 12.409 40.695 1.00 14.29 C ATOM 1639 CG1 ILE A 484 4.406 12.496 41.968 1.00 24.38 C ATOM 1640 CG2 ILE A 484 2.751 13.692 40.515 1.00 20.99 C ATOM 1641 CD1 ILE A 484 5.430 13.614 41.964 1.00 28.47 C ATOM 1642 HA ILE A 484 1.974 11.302 41.628 1.00 0.00 H ATOM 1643 HB ILE A 484 4.223 12.291 39.838 1.00 0.00 H ATOM 1644 HG12 ILE A 484 3.736 12.650 42.813 1.00 0.00 H ATOM 1645 HG13 ILE A 484 4.934 11.550 42.092 1.00 0.00 H ATOM 1646 HD11 ILE A 484 6.120 13.470 41.132 1.00 0.00 H ATOM 1647 HD12 ILE A 484 4.920 14.571 41.854 1.00 0.00 H ATOM 1648 HD13 ILE A 484 5.983 13.601 42.903 1.00 0.00 H ATOM 1649 HG21 ILE A 484 2.180 13.633 39.589 1.00 0.00 H ATOM 1650 HG22 ILE A 484 2.069 13.811 41.357 1.00 0.00 H ATOM 1651 HG23 ILE A 484 3.429 14.544 40.471 1.00 0.00 H ATOM 1652 H ILE A 484 4.262 9.803 40.437 1.00 0.00 H ATOM 1653 N GLY A 485 2.431 10.876 38.358 1.00 17.87 N ATOM 1654 CA GLY A 485 1.729 10.839 37.088 1.00 15.64 C ATOM 1655 C GLY A 485 2.641 10.453 35.944 1.00 11.45 C ATOM 1656 O GLY A 485 3.849 10.299 36.129 1.00 10.83 O ATOM 1657 HA3 GLY A 485 1.312 11.826 36.888 1.00 0.00 H ATOM 1658 HA2 GLY A 485 0.920 10.111 37.154 1.00 0.00 H ATOM 1659 H GLY A 485 3.457 10.705 38.381 1.00 0.00 H ATOM 1660 N GLU A 486 2.064 10.308 34.755 1.00 17.40 N ATOM 1661 CA GLU A 486 2.820 9.828 33.608 1.00 14.23 C ATOM 1662 C GLU A 486 2.354 10.430 32.291 1.00 17.71 C ATOM 1663 O GLU A 486 1.345 11.132 32.218 1.00 15.70 O ATOM 1664 CB GLU A 486 2.729 8.300 33.517 1.00 17.04 C ATOM 1665 CG GLU A 486 1.325 7.765 33.245 1.00 17.72 C ATOM 1666 CD GLU A 486 1.284 6.248 33.142 1.00 26.56 C ATOM 1667 OE1 GLU A 486 1.256 5.728 32.006 1.00 31.57 O ATOM 1668 OE2 GLU A 486 1.273 5.573 34.194 1.00 24.79 O ATOM 1669 HA GLU A 486 3.851 10.144 33.767 1.00 0.00 H ATOM 1670 HB2 GLU A 486 3.383 7.967 32.711 1.00 0.00 H ATOM 1671 HB3 GLU A 486 3.076 7.881 34.461 1.00 0.00 H ATOM 1672 HG2 GLU A 486 0.669 8.077 34.058 1.00 0.00 H ATOM 1673 HG3 GLU A 486 0.966 8.188 32.307 1.00 0.00 H ATOM 1674 H GLU A 486 1.057 10.541 34.643 1.00 0.00 H ATOM 1675 N THR A 487 3.119 10.133 31.253 1.00 18.38 N ATOM 1676 CA THR A 487 2.730 10.420 29.886 1.00 14.45 C ATOM 1677 C THR A 487 3.288 9.287 29.040 1.00 15.06 C ATOM 1678 O THR A 487 4.243 8.621 29.445 1.00 16.35 O ATOM 1679 CB THR A 487 3.250 11.794 29.409 1.00 19.50 C ATOM 1680 OG1 THR A 487 2.632 12.146 28.164 1.00 24.42 O ATOM 1681 CG2 THR A 487 4.772 11.797 29.249 1.00 14.39 C ATOM 1682 HA THR A 487 1.645 10.480 29.800 1.00 0.00 H ATOM 1683 HB THR A 487 2.990 12.530 30.170 1.00 0.00 H ATOM 1684 HG1 THR A 487 2.849 11.460 27.484 1.00 0.00 H ATOM 1685 HG23 THR A 487 5.236 11.529 30.198 1.00 0.00 H ATOM 1686 HG21 THR A 487 5.057 11.073 28.486 1.00 0.00 H ATOM 1687 HG22 THR A 487 5.103 12.792 28.949 1.00 0.00 H ATOM 1688 H THR A 487 4.037 9.675 31.425 1.00 0.00 H ATOM 1689 N ARG A 488 2.683 9.054 27.883 1.00 20.62 N ATOM 1690 CA ARG A 488 3.131 8.003 26.984 1.00 20.53 C ATOM 1691 C ARG A 488 3.286 8.574 25.589 1.00 21.82 C ATOM 1692 O ARG A 488 2.641 9.561 25.235 1.00 21.35 O ATOM 1693 CB ARG A 488 2.147 6.829 26.970 1.00 25.09 C ATOM 1694 CG ARG A 488 2.155 5.985 28.236 1.00 30.86 C ATOM 1695 CD ARG A 488 1.106 4.882 28.175 1.00 39.16 C ATOM 1696 NE ARG A 488 0.722 4.422 29.512 1.00 49.32 N ATOM 1697 CZ ARG A 488 0.589 3.149 29.882 1.00 46.75 C ATOM 1698 NH1 ARG A 488 0.811 2.155 29.023 1.00 42.95 N ATOM 1699 NH2 ARG A 488 0.232 2.861 31.124 1.00 40.89 N ATOM 1700 HA ARG A 488 4.091 7.626 27.336 1.00 0.00 H ATOM 1701 HB2 ARG A 488 1.142 7.228 26.833 1.00 0.00 H ATOM 1702 HB3 ARG A 488 2.398 6.184 26.128 1.00 0.00 H ATOM 1703 HG2 ARG A 488 3.139 5.532 28.355 1.00 0.00 H ATOM 1704 HG3 ARG A 488 1.946 6.627 29.092 1.00 0.00 H ATOM 1705 HD2 ARG A 488 1.511 4.040 27.615 1.00 0.00 H ATOM 1706 HD3 ARG A 488 0.221 5.264 27.665 1.00 0.00 H ATOM 1707 HE ARG A 488 0.538 5.150 30.232 1.00 0.00 H ATOM 1708 HH12 ARG A 488 0.702 1.168 29.331 1.00 0.00 H ATOM 1709 HH11 ARG A 488 1.093 2.367 28.045 1.00 0.00 H ATOM 1710 HH22 ARG A 488 0.127 1.869 31.418 1.00 0.00 H ATOM 1711 HH21 ARG A 488 0.057 3.627 31.806 1.00 0.00 H ATOM 1712 H ARG A 488 1.867 9.638 27.612 1.00 0.00 H ATOM 1713 N PHE A 489 4.154 7.955 24.801 1.00 20.32 N ATOM 1714 CA PHE A 489 4.356 8.388 23.430 1.00 22.21 C ATOM 1715 C PHE A 489 4.634 7.194 22.532 1.00 19.77 C ATOM 1716 O PHE A 489 5.495 6.370 22.829 1.00 21.07 O ATOM 1717 CB PHE A 489 5.499 9.396 23.351 1.00 19.53 C ATOM 1718 CG PHE A 489 5.666 10.001 21.996 1.00 23.10 C ATOM 1719 CD1 PHE A 489 4.763 10.941 21.530 1.00 27.56 C ATOM 1720 CD2 PHE A 489 6.715 9.625 21.182 1.00 26.98 C ATOM 1721 CE1 PHE A 489 4.909 11.498 20.278 1.00 27.99 C ATOM 1722 CE2 PHE A 489 6.865 10.179 19.930 1.00 19.17 C ATOM 1723 CZ PHE A 489 5.963 11.117 19.478 1.00 29.79 C ATOM 1724 HA PHE A 489 3.444 8.875 23.083 1.00 0.00 H ATOM 1725 HB2 PHE A 489 5.304 10.196 24.065 1.00 0.00 H ATOM 1726 HB3 PHE A 489 6.426 8.889 23.620 1.00 0.00 H ATOM 1727 HD2 PHE A 489 7.432 8.883 21.533 1.00 0.00 H ATOM 1728 HE2 PHE A 489 7.698 9.875 19.296 1.00 0.00 H ATOM 1729 HZ PHE A 489 6.084 11.557 18.488 1.00 0.00 H ATOM 1730 HE1 PHE A 489 4.192 12.238 19.922 1.00 0.00 H ATOM 1731 HD1 PHE A 489 3.927 11.244 22.160 1.00 0.00 H ATOM 1732 H PHE A 489 4.697 7.149 25.170 1.00 0.00 H ATOM 1733 N SER A 490 3.884 7.100 21.441 1.00 15.42 N ATOM 1734 CA SER A 490 4.068 6.026 20.476 1.00 16.25 C ATOM 1735 C SER A 490 5.273 6.338 19.596 1.00 17.68 C ATOM 1736 O SER A 490 5.279 7.326 18.861 1.00 19.41 O ATOM 1737 CB SER A 490 2.807 5.848 19.631 1.00 25.16 C ATOM 1738 OG SER A 490 2.940 4.753 18.748 1.00 29.38 O ATOM 1739 HA SER A 490 4.250 5.091 21.005 1.00 0.00 H ATOM 1740 HB2 SER A 490 2.635 6.755 19.051 1.00 0.00 H ATOM 1741 HB3 SER A 490 1.957 5.673 20.291 1.00 0.00 H ATOM 1742 HG SER A 490 2.112 4.659 18.213 1.00 0.00 H ATOM 1743 H SER A 490 3.146 7.812 21.271 1.00 0.00 H ATOM 1744 N LEU A 491 6.296 5.496 19.678 1.00 19.17 N ATOM 1745 CA LEU A 491 7.564 5.779 19.017 1.00 20.39 C ATOM 1746 C LEU A 491 7.457 5.822 17.492 1.00 19.64 C ATOM 1747 O LEU A 491 8.330 6.380 16.827 1.00 21.69 O ATOM 1748 CB LEU A 491 8.612 4.744 19.423 1.00 19.37 C ATOM 1749 CG LEU A 491 9.113 4.801 20.871 1.00 16.81 C ATOM 1750 CD1 LEU A 491 10.134 3.700 21.112 1.00 22.08 C ATOM 1751 CD2 LEU A 491 9.717 6.159 21.206 1.00 18.22 C ATOM 1752 HA LEU A 491 7.864 6.774 19.345 1.00 0.00 H ATOM 1753 HB2 LEU A 491 8.181 3.756 19.261 1.00 0.00 H ATOM 1754 HB3 LEU A 491 9.475 4.874 18.770 1.00 0.00 H ATOM 1755 HG LEU A 491 8.255 4.650 21.526 1.00 0.00 H ATOM 1756 HD21 LEU A 491 10.560 6.354 20.543 1.00 0.00 H ATOM 1757 HD22 LEU A 491 8.962 6.934 21.073 1.00 0.00 H ATOM 1758 HD23 LEU A 491 10.060 6.158 22.241 1.00 0.00 H ATOM 1759 HD11 LEU A 491 9.671 2.730 20.930 1.00 0.00 H ATOM 1760 HD12 LEU A 491 10.977 3.834 20.435 1.00 0.00 H ATOM 1761 HD13 LEU A 491 10.483 3.750 22.143 1.00 0.00 H ATOM 1762 H LEU A 491 6.191 4.617 20.224 1.00 0.00 H ATOM 1763 N LYS A 492 6.404 5.240 16.930 1.00 24.86 N ATOM 1764 CA LYS A 492 6.235 5.271 15.476 1.00 31.14 C ATOM 1765 C LYS A 492 5.869 6.673 14.982 1.00 27.53 C ATOM 1766 O LYS A 492 5.917 6.943 13.781 1.00 27.11 O ATOM 1767 CB LYS A 492 5.180 4.254 15.025 1.00 27.90 C ATOM 1768 CG LYS A 492 3.841 4.358 15.730 1.00 34.67 C ATOM 1769 CD LYS A 492 2.899 3.244 15.292 1.00 39.16 C ATOM 1770 CE LYS A 492 1.944 2.854 16.410 1.00 54.95 C ATOM 1771 NZ LYS A 492 1.050 1.727 16.020 1.00 61.27 N ATOM 1772 HA LYS A 492 7.192 4.998 15.032 1.00 0.00 H ATOM 1773 HB2 LYS A 492 5.011 4.394 13.957 1.00 0.00 H ATOM 1774 HB3 LYS A 492 5.578 3.254 15.201 1.00 0.00 H ATOM 1775 HG2 LYS A 492 3.999 4.288 16.806 1.00 0.00 H ATOM 1776 HG3 LYS A 492 3.388 5.321 15.493 1.00 0.00 H ATOM 1777 HD2 LYS A 492 2.320 3.585 14.434 1.00 0.00 H ATOM 1778 HD3 LYS A 492 3.488 2.372 15.008 1.00 0.00 H ATOM 1779 HE2 LYS A 492 1.330 3.718 16.664 1.00 0.00 H ATOM 1780 HE3 LYS A 492 2.527 2.555 17.281 1.00 0.00 H ATOM 1781 HZ1 LYS A 492 0.484 2.005 15.193 1.00 0.00 H ATOM 1782 HZ2 LYS A 492 1.627 0.895 15.782 1.00 0.00 H ATOM 1783 HZ3 LYS A 492 0.418 1.497 16.813 1.00 0.00 H ATOM 1784 H LYS A 492 5.698 4.761 17.524 1.00 0.00 H ATOM 1785 N LYS A 493 5.519 7.564 15.908 1.00 27.99 N ATOM 1786 CA LYS A 493 5.190 8.946 15.561 1.00 25.81 C ATOM 1787 C LYS A 493 6.444 9.800 15.415 1.00 29.84 C ATOM 1788 O LYS A 493 6.372 10.947 14.974 1.00 25.11 O ATOM 1789 CB LYS A 493 4.273 9.568 16.616 1.00 29.48 C ATOM 1790 CG LYS A 493 2.974 8.815 16.844 1.00 26.80 C ATOM 1791 CD LYS A 493 2.194 9.417 18.004 1.00 39.17 C ATOM 1792 CE LYS A 493 0.937 10.126 17.534 1.00 38.06 C ATOM 1793 NZ LYS A 493 -0.126 9.158 17.146 1.00 42.85 N ATOM 1794 HA LYS A 493 4.673 8.921 14.602 1.00 0.00 H ATOM 1795 HB2 LYS A 493 4.816 9.605 17.560 1.00 0.00 H ATOM 1796 HB3 LYS A 493 4.028 10.582 16.300 1.00 0.00 H ATOM 1797 HG2 LYS A 493 2.367 8.868 15.940 1.00 0.00 H ATOM 1798 HG3 LYS A 493 3.200 7.773 17.068 1.00 0.00 H ATOM 1799 HD2 LYS A 493 1.913 8.619 18.692 1.00 0.00 H ATOM 1800 HD3 LYS A 493 2.830 10.134 18.522 1.00 0.00 H ATOM 1801 HE2 LYS A 493 1.182 10.747 16.672 1.00 0.00 H ATOM 1802 HE3 LYS A 493 0.564 10.757 18.341 1.00 0.00 H ATOM 1803 HZ1 LYS A 493 0.221 8.556 16.372 1.00 0.00 H ATOM 1804 HZ2 LYS A 493 -0.369 8.566 17.965 1.00 0.00 H ATOM 1805 HZ3 LYS A 493 -0.969 9.679 16.830 1.00 0.00 H ATOM 1806 H LYS A 493 5.479 7.269 16.904 1.00 0.00 H ATOM 1807 N LEU A 494 7.589 9.244 15.802 1.00 21.22 N ATOM 1808 CA LEU A 494 8.860 9.935 15.652 1.00 26.40 C ATOM 1809 C LEU A 494 9.404 9.739 14.247 1.00 32.21 C ATOM 1810 O LEU A 494 9.346 8.640 13.694 1.00 40.36 O ATOM 1811 CB LEU A 494 9.892 9.434 16.668 1.00 31.69 C ATOM 1812 CG LEU A 494 10.041 10.115 18.032 1.00 25.23 C ATOM 1813 CD1 LEU A 494 11.340 9.655 18.681 1.00 24.85 C ATOM 1814 CD2 LEU A 494 10.005 11.640 17.953 1.00 27.53 C ATOM 1815 HA LEU A 494 8.681 10.995 15.833 1.00 0.00 H ATOM 1816 HB2 LEU A 494 9.653 8.389 16.866 1.00 0.00 H ATOM 1817 HB3 LEU A 494 10.865 9.497 16.181 1.00 0.00 H ATOM 1818 HG LEU A 494 9.183 9.820 18.637 1.00 0.00 H ATOM 1819 HD21 LEU A 494 10.821 11.989 17.320 1.00 0.00 H ATOM 1820 HD22 LEU A 494 9.053 11.958 17.529 1.00 0.00 H ATOM 1821 HD23 LEU A 494 10.116 12.057 18.954 1.00 0.00 H ATOM 1822 HD11 LEU A 494 11.316 8.573 18.812 1.00 0.00 H ATOM 1823 HD12 LEU A 494 12.180 9.926 18.042 1.00 0.00 H ATOM 1824 HD13 LEU A 494 11.450 10.137 19.652 1.00 0.00 H ATOM 1825 H LEU A 494 7.575 8.293 16.222 1.00 0.00 H ATOM 1826 N LYS A 495 9.930 10.813 13.677 1.00 30.40 N ATOM 1827 CA LYS A 495 10.634 10.742 12.406 1.00 31.69 C ATOM 1828 C LYS A 495 12.122 10.679 12.702 1.00 29.73 C ATOM 1829 O LYS A 495 12.619 11.423 13.549 1.00 25.03 O ATOM 1830 CB LYS A 495 10.297 11.945 11.522 1.00 35.14 C ATOM 1831 CG LYS A 495 8.940 11.856 10.829 1.00 42.17 C ATOM 1832 CD LYS A 495 7.835 11.470 11.796 1.00 49.36 C ATOM 1833 CE LYS A 495 6.464 11.616 11.170 1.00 47.46 C ATOM 1834 NZ LYS A 495 5.401 11.534 12.218 1.00 51.75 N ATOM 1835 HA LYS A 495 10.325 9.853 11.856 1.00 0.00 H ATOM 1836 HB2 LYS A 495 10.304 12.839 12.145 1.00 0.00 H ATOM 1837 HB3 LYS A 495 11.067 12.032 10.755 1.00 0.00 H ATOM 1838 HG2 LYS A 495 8.703 12.826 10.392 1.00 0.00 H ATOM 1839 HG3 LYS A 495 8.996 11.107 10.040 1.00 0.00 H ATOM 1840 HD2 LYS A 495 7.977 10.432 12.098 1.00 0.00 H ATOM 1841 HD3 LYS A 495 7.893 12.114 12.674 1.00 0.00 H ATOM 1842 HE2 LYS A 495 6.314 10.818 10.443 1.00 0.00 H ATOM 1843 HE3 LYS A 495 6.399 12.581 10.667 1.00 0.00 H ATOM 1844 HZ1 LYS A 495 5.459 10.613 12.697 1.00 0.00 H ATOM 1845 HZ2 LYS A 495 5.540 12.296 12.912 1.00 0.00 H ATOM 1846 HZ3 LYS A 495 4.467 11.636 11.772 1.00 0.00 H ATOM 1847 H LYS A 495 9.837 11.734 14.152 1.00 0.00 H ATOM 1848 N ALA A 496 12.826 9.777 12.026 1.00 27.55 N ATOM 1849 CA ALA A 496 14.261 9.624 12.234 1.00 23.05 C ATOM 1850 C ALA A 496 14.976 10.965 12.088 1.00 29.88 C ATOM 1851 O ALA A 496 14.650 11.757 11.205 1.00 27.24 O ATOM 1852 CB ALA A 496 14.833 8.611 11.257 1.00 26.63 C ATOM 1853 HA ALA A 496 14.421 9.260 13.249 1.00 0.00 H ATOM 1854 HB1 ALA A 496 14.347 7.647 11.409 1.00 0.00 H ATOM 1855 HB2 ALA A 496 14.656 8.952 10.237 1.00 0.00 H ATOM 1856 HB3 ALA A 496 15.905 8.510 11.427 1.00 0.00 H ATOM 1857 H ALA A 496 12.344 9.168 11.335 1.00 0.00 H ATOM 1858 N ASN A 497 15.919 11.222 12.990 1.00 19.25 N ATOM 1859 CA ASN A 497 16.795 12.390 12.922 1.00 29.34 C ATOM 1860 C ASN A 497 16.088 13.731 13.151 1.00 24.98 C ATOM 1861 O ASN A 497 16.728 14.780 13.099 1.00 30.93 O ATOM 1862 CB ASN A 497 17.516 12.413 11.571 1.00 34.39 C ATOM 1863 CG ASN A 497 18.287 11.132 11.302 1.00 36.78 C ATOM 1864 OD1 ASN A 497 19.014 10.638 12.166 1.00 34.54 O ATOM 1865 ND2 ASN A 497 18.131 10.587 10.099 1.00 34.24 N ATOM 1866 HA ASN A 497 17.502 12.281 13.745 1.00 0.00 H ATOM 1867 HB2 ASN A 497 16.776 12.549 10.782 1.00 0.00 H ATOM 1868 HB3 ASN A 497 18.214 13.250 11.561 1.00 0.00 H ATOM 1869 HD22 ASN A 497 17.507 11.039 9.400 1.00 0.00 H ATOM 1870 HD21 ASN A 497 18.633 9.709 9.857 1.00 0.00 H ATOM 1871 H ASN A 497 16.039 10.559 13.783 1.00 0.00 H ATOM 1872 N GLN A 498 14.784 13.693 13.420 1.00 21.00 N ATOM 1873 CA GLN A 498 14.013 14.907 13.700 1.00 21.03 C ATOM 1874 C GLN A 498 13.676 15.008 15.185 1.00 15.73 C ATOM 1875 O GLN A 498 12.865 14.236 15.689 1.00 17.05 O ATOM 1876 CB GLN A 498 12.717 14.932 12.885 1.00 24.80 C ATOM 1877 CG GLN A 498 11.954 16.253 12.976 1.00 34.50 C ATOM 1878 CD GLN A 498 10.448 16.069 12.922 1.00 45.33 C ATOM 1879 OE1 GLN A 498 9.817 15.717 13.921 1.00 46.77 O ATOM 1880 NE2 GLN A 498 9.863 16.311 11.756 1.00 47.26 N ATOM 1881 HA GLN A 498 14.631 15.759 13.415 1.00 0.00 H ATOM 1882 HB2 GLN A 498 12.965 14.750 11.839 1.00 0.00 H ATOM 1883 HB3 GLN A 498 12.068 14.135 13.247 1.00 0.00 H ATOM 1884 HG2 GLN A 498 12.212 16.740 13.916 1.00 0.00 H ATOM 1885 HG3 GLN A 498 12.257 16.888 12.144 1.00 0.00 H ATOM 1886 HE22 GLN A 498 10.435 16.606 10.939 1.00 0.00 H ATOM 1887 HE21 GLN A 498 8.833 16.206 11.659 1.00 0.00 H ATOM 1888 H GLN A 498 14.298 12.773 13.432 1.00 0.00 H ATOM 1889 N ARG A 499 14.288 15.962 15.878 1.00 18.58 N ATOM 1890 CA ARG A 499 13.991 16.167 17.294 1.00 19.96 C ATOM 1891 C ARG A 499 12.534 16.565 17.485 1.00 19.65 C ATOM 1892 O ARG A 499 11.969 17.287 16.661 1.00 22.97 O ATOM 1893 CB ARG A 499 14.906 17.234 17.891 1.00 19.73 C ATOM 1894 CG ARG A 499 14.672 17.478 19.382 1.00 15.75 C ATOM 1895 CD ARG A 499 15.756 18.366 19.957 1.00 15.26 C ATOM 1896 NE ARG A 499 17.064 17.723 19.911 1.00 18.33 N ATOM 1897 CZ ARG A 499 17.475 16.790 20.764 1.00 22.49 C ATOM 1898 NH1 ARG A 499 16.677 16.374 21.738 1.00 18.17 N ATOM 1899 NH2 ARG A 499 18.685 16.266 20.638 1.00 22.82 N ATOM 1900 HA ARG A 499 14.169 15.226 17.814 1.00 0.00 H ATOM 1901 HB2 ARG A 499 15.940 16.919 17.751 1.00 0.00 H ATOM 1902 HB3 ARG A 499 14.738 18.170 17.358 1.00 0.00 H ATOM 1903 HG2 ARG A 499 13.704 17.961 19.518 1.00 0.00 H ATOM 1904 HG3 ARG A 499 14.677 16.522 19.906 1.00 0.00 H ATOM 1905 HD2 ARG A 499 15.511 18.595 20.994 1.00 0.00 H ATOM 1906 HD3 ARG A 499 15.797 19.291 19.382 1.00 0.00 H ATOM 1907 HE ARG A 499 17.721 18.014 19.159 1.00 0.00 H ATOM 1908 HH12 ARG A 499 17.004 15.644 22.402 1.00 0.00 H ATOM 1909 HH11 ARG A 499 15.724 16.778 21.838 1.00 0.00 H ATOM 1910 HH22 ARG A 499 19.008 15.536 21.305 1.00 0.00 H ATOM 1911 HH21 ARG A 499 19.312 16.585 19.872 1.00 0.00 H ATOM 1912 H ARG A 499 14.987 16.571 15.407 1.00 0.00 H ATOM 1913 N LYS A 500 11.930 16.087 18.571 1.00 21.48 N ATOM 1914 CA LYS A 500 10.566 16.464 18.927 1.00 22.96 C ATOM 1915 C LYS A 500 10.518 16.933 20.374 1.00 19.92 C ATOM 1916 O LYS A 500 10.905 16.203 21.288 1.00 16.24 O ATOM 1917 CB LYS A 500 9.602 15.295 18.719 1.00 22.47 C ATOM 1918 CG LYS A 500 8.136 15.710 18.629 1.00 30.63 C ATOM 1919 CD LYS A 500 7.251 14.530 18.258 1.00 29.10 C ATOM 1920 CE LYS A 500 5.953 14.976 17.599 1.00 43.87 C ATOM 1921 NZ LYS A 500 5.034 15.664 18.546 1.00 39.81 N ATOM 1922 HA LYS A 500 10.254 17.280 18.275 1.00 0.00 H ATOM 1923 HB2 LYS A 500 9.873 14.787 17.793 1.00 0.00 H ATOM 1924 HB3 LYS A 500 9.713 14.605 19.556 1.00 0.00 H ATOM 1925 HG2 LYS A 500 7.818 16.103 19.594 1.00 0.00 H ATOM 1926 HG3 LYS A 500 8.032 16.485 17.870 1.00 0.00 H ATOM 1927 HD2 LYS A 500 7.794 13.886 17.566 1.00 0.00 H ATOM 1928 HD3 LYS A 500 7.013 13.970 19.162 1.00 0.00 H ATOM 1929 HE2 LYS A 500 5.447 14.099 17.197 1.00 0.00 H ATOM 1930 HE3 LYS A 500 6.192 15.661 16.785 1.00 0.00 H ATOM 1931 HZ1 LYS A 500 4.791 15.017 19.323 1.00 0.00 H ATOM 1932 HZ2 LYS A 500 5.503 16.509 18.930 1.00 0.00 H ATOM 1933 HZ3 LYS A 500 4.168 15.945 18.044 1.00 0.00 H ATOM 1934 H LYS A 500 12.446 15.425 19.184 1.00 0.00 H ATOM 1935 N ASN A 501 10.039 18.156 20.568 1.00 13.48 N ATOM 1936 CA ASN A 501 9.992 18.769 21.887 1.00 20.26 C ATOM 1937 C ASN A 501 8.601 18.671 22.484 1.00 21.31 C ATOM 1938 O ASN A 501 7.603 18.915 21.803 1.00 16.59 O ATOM 1939 CB ASN A 501 10.441 20.226 21.795 1.00 21.19 C ATOM 1940 CG ASN A 501 11.840 20.359 21.230 1.00 29.85 C ATOM 1941 OD1 ASN A 501 12.789 19.789 21.767 1.00 17.21 O ATOM 1942 ND2 ASN A 501 11.973 21.088 20.124 1.00 22.26 N ATOM 1943 HA ASN A 501 10.672 18.230 22.547 1.00 0.00 H ATOM 1944 HB2 ASN A 501 9.749 20.767 21.150 1.00 0.00 H ATOM 1945 HB3 ASN A 501 10.422 20.663 22.793 1.00 0.00 H ATOM 1946 HD22 ASN A 501 11.142 21.552 19.704 1.00 0.00 H ATOM 1947 HD21 ASN A 501 12.907 21.193 19.680 1.00 0.00 H ATOM 1948 H ASN A 501 9.686 18.693 19.751 1.00 0.00 H ATOM 1949 N PHE A 502 8.542 18.298 23.759 1.00 20.47 N ATOM 1950 CA PHE A 502 7.274 18.091 24.440 1.00 16.74 C ATOM 1951 C PHE A 502 7.126 19.019 25.642 1.00 18.03 C ATOM 1952 O PHE A 502 8.097 19.339 26.330 1.00 12.63 O ATOM 1953 CB PHE A 502 7.138 16.637 24.906 1.00 18.08 C ATOM 1954 CG PHE A 502 7.158 15.627 23.793 1.00 18.84 C ATOM 1955 CD1 PHE A 502 8.349 15.272 23.179 1.00 20.25 C ATOM 1956 CD2 PHE A 502 5.986 15.014 23.376 1.00 23.03 C ATOM 1957 CE1 PHE A 502 8.368 14.332 22.160 1.00 25.29 C ATOM 1958 CE2 PHE A 502 5.998 14.073 22.361 1.00 26.98 C ATOM 1959 CZ PHE A 502 7.192 13.731 21.753 1.00 24.78 C ATOM 1960 HA PHE A 502 6.485 18.319 23.723 1.00 0.00 H ATOM 1961 HB2 PHE A 502 7.964 16.416 25.583 1.00 0.00 H ATOM 1962 HB3 PHE A 502 6.194 16.537 25.442 1.00 0.00 H ATOM 1963 HD2 PHE A 502 5.042 15.277 23.854 1.00 0.00 H ATOM 1964 HE2 PHE A 502 5.068 13.602 22.042 1.00 0.00 H ATOM 1965 HZ PHE A 502 7.206 12.989 20.955 1.00 0.00 H ATOM 1966 HE1 PHE A 502 9.310 14.067 21.680 1.00 0.00 H ATOM 1967 HD1 PHE A 502 9.281 15.737 23.501 1.00 0.00 H ATOM 1968 H PHE A 502 9.428 18.150 24.284 1.00 0.00 H ATOM 1969 N ASN A 503 5.895 19.455 25.866 1.00 18.51 N ATOM 1970 CA ASN A 503 5.507 20.115 27.101 1.00 18.53 C ATOM 1971 C ASN A 503 4.081 19.689 27.396 1.00 26.66 C ATOM 1972 O ASN A 503 3.131 20.248 26.850 1.00 25.77 O ATOM 1973 CB ASN A 503 5.624 21.633 26.992 1.00 25.25 C ATOM 1974 CG ASN A 503 5.352 22.332 28.310 1.00 33.06 C ATOM 1975 OD1 ASN A 503 4.370 22.041 28.991 1.00 30.45 O ATOM 1976 ND2 ASN A 503 6.232 23.253 28.682 1.00 45.18 N ATOM 1977 HA ASN A 503 6.173 19.825 27.913 1.00 0.00 H ATOM 1978 HB2 ASN A 503 6.633 21.884 26.665 1.00 0.00 H ATOM 1979 HB3 ASN A 503 4.905 21.987 26.253 1.00 0.00 H ATOM 1980 HD22 ASN A 503 7.049 23.467 28.075 1.00 0.00 H ATOM 1981 HD21 ASN A 503 6.105 23.760 29.581 1.00 0.00 H ATOM 1982 H ASN A 503 5.176 19.319 25.127 1.00 0.00 H ATOM 1983 N ILE A 504 3.950 18.685 28.258 1.00 19.11 N ATOM 1984 CA ILE A 504 2.680 18.006 28.468 1.00 19.15 C ATOM 1985 C ILE A 504 2.309 17.980 29.940 1.00 23.18 C ATOM 1986 O ILE A 504 3.173 18.112 30.806 1.00 21.05 O ATOM 1987 CB ILE A 504 2.731 16.559 27.928 1.00 18.53 C ATOM 1988 CG1 ILE A 504 3.812 15.739 28.641 1.00 20.41 C ATOM 1989 CG2 ILE A 504 2.993 16.565 26.425 1.00 25.18 C ATOM 1990 CD1 ILE A 504 3.334 15.016 29.884 1.00 27.47 C ATOM 1991 HA ILE A 504 1.921 18.565 27.922 1.00 0.00 H ATOM 1992 HB ILE A 504 1.764 16.095 28.123 1.00 0.00 H ATOM 1993 HG12 ILE A 504 4.194 14.996 27.940 1.00 0.00 H ATOM 1994 HG13 ILE A 504 4.618 16.414 28.928 1.00 0.00 H ATOM 1995 HD11 ILE A 504 2.960 15.743 30.605 1.00 0.00 H ATOM 1996 HD12 ILE A 504 2.535 14.324 29.616 1.00 0.00 H ATOM 1997 HD13 ILE A 504 4.164 14.462 30.323 1.00 0.00 H ATOM 1998 HG21 ILE A 504 2.193 17.106 25.920 1.00 0.00 H ATOM 1999 HG22 ILE A 504 3.946 17.054 26.226 1.00 0.00 H ATOM 2000 HG23 ILE A 504 3.026 15.539 26.059 1.00 0.00 H ATOM 2001 H ILE A 504 4.782 18.375 28.800 1.00 0.00 H ATOM 2002 N CYS A 505 1.019 17.804 30.214 1.00 20.83 N ATOM 2003 CA CYS A 505 0.538 17.629 31.580 1.00 26.44 C ATOM 2004 C CYS A 505 0.453 16.147 31.926 1.00 19.97 C ATOM 2005 O CYS A 505 -0.095 15.346 31.167 1.00 21.13 O ATOM 2006 CB CYS A 505 -0.825 18.299 31.766 1.00 26.37 C ATOM 2007 SG CYS A 505 -0.742 20.103 31.813 1.00 34.03 S ATOM 2008 HA CYS A 505 1.248 18.106 32.256 1.00 0.00 H ATOM 2009 HB2 CYS A 505 -1.257 17.949 32.704 1.00 0.00 H ATOM 2010 HB3 CYS A 505 -1.470 18.005 30.938 1.00 0.00 H ATOM 2011 HG CYS A 505 -2.012 20.616 31.983 1.00 0.00 H ATOM 2012 H CYS A 505 0.334 17.791 29.432 1.00 0.00 H ATOM 2013 N LEU A 506 1.012 15.788 33.076 1.00 18.18 N ATOM 2014 CA LEU A 506 0.973 14.414 33.543 1.00 17.85 C ATOM 2015 C LEU A 506 -0.462 13.971 33.760 1.00 18.61 C ATOM 2016 O LEU A 506 -1.347 14.788 34.021 1.00 19.65 O ATOM 2017 CB LEU A 506 1.771 14.263 34.839 1.00 13.86 C ATOM 2018 CG LEU A 506 3.267 14.552 34.724 1.00 17.26 C ATOM 2019 CD1 LEU A 506 3.903 14.613 36.099 1.00 21.28 C ATOM 2020 CD2 LEU A 506 3.952 13.499 33.863 1.00 15.62 C ATOM 2021 HA LEU A 506 1.426 13.780 32.780 1.00 0.00 H ATOM 2022 HB2 LEU A 506 1.351 14.949 35.575 1.00 0.00 H ATOM 2023 HB3 LEU A 506 1.652 13.238 35.190 1.00 0.00 H ATOM 2024 HG LEU A 506 3.394 15.522 34.243 1.00 0.00 H ATOM 2025 HD21 LEU A 506 3.815 12.517 34.315 1.00 0.00 H ATOM 2026 HD22 LEU A 506 3.513 13.505 32.865 1.00 0.00 H ATOM 2027 HD23 LEU A 506 5.016 13.724 33.794 1.00 0.00 H ATOM 2028 HD11 LEU A 506 3.432 15.405 36.681 1.00 0.00 H ATOM 2029 HD12 LEU A 506 3.764 13.658 36.605 1.00 0.00 H ATOM 2030 HD13 LEU A 506 4.968 14.820 35.996 1.00 0.00 H ATOM 2031 H LEU A 506 1.489 16.508 33.656 1.00 0.00 H ATOM 2032 N GLU A 507 -0.682 12.671 33.631 1.00 14.77 N ATOM 2033 CA GLU A 507 -1.974 12.075 33.913 1.00 21.63 C ATOM 2034 C GLU A 507 -1.782 10.774 34.670 1.00 20.91 C ATOM 2035 O GLU A 507 -0.710 10.163 34.624 1.00 19.23 O ATOM 2036 CB GLU A 507 -2.756 11.814 32.621 1.00 26.75 C ATOM 2037 CG GLU A 507 -3.247 13.063 31.915 1.00 29.10 C ATOM 2038 CD GLU A 507 -4.033 12.743 30.655 1.00 44.41 C ATOM 2039 OE1 GLU A 507 -4.403 11.564 30.464 1.00 40.27 O ATOM 2040 OE2 GLU A 507 -4.279 13.670 29.853 1.00 45.23 O ATOM 2041 HA GLU A 507 -2.548 12.773 34.523 1.00 0.00 H ATOM 2042 HB2 GLU A 507 -2.107 11.269 31.935 1.00 0.00 H ATOM 2043 HB3 GLU A 507 -3.622 11.199 32.866 1.00 0.00 H ATOM 2044 HG2 GLU A 507 -3.889 13.622 32.596 1.00 0.00 H ATOM 2045 HG3 GLU A 507 -2.386 13.675 31.645 1.00 0.00 H ATOM 2046 H GLU A 507 0.097 12.058 33.317 1.00 0.00 H ATOM 2047 N ARG A 508 -2.829 10.368 35.378 1.00 24.90 N ATOM 2048 CA ARG A 508 -2.890 9.043 35.962 1.00 20.03 C ATOM 2049 C ARG A 508 -3.768 8.180 35.065 1.00 27.50 C ATOM 2050 O ARG A 508 -4.736 8.666 34.476 1.00 25.63 O ATOM 2051 CB ARG A 508 -3.427 9.104 37.392 1.00 23.42 C ATOM 2052 CG ARG A 508 -2.554 9.945 38.312 1.00 22.74 C ATOM 2053 CD ARG A 508 -3.171 10.117 39.682 1.00 18.31 C ATOM 2054 NE ARG A 508 -3.033 8.912 40.495 1.00 23.15 N ATOM 2055 CZ ARG A 508 -1.980 8.636 41.259 1.00 23.03 C ATOM 2056 NH1 ARG A 508 -0.953 9.476 41.323 1.00 23.34 N ATOM 2057 NH2 ARG A 508 -1.951 7.513 41.961 1.00 15.88 N ATOM 2058 HA ARG A 508 -1.893 8.607 36.026 1.00 0.00 H ATOM 2059 HB2 ARG A 508 -4.428 9.535 37.371 1.00 0.00 H ATOM 2060 HB3 ARG A 508 -3.477 8.090 37.789 1.00 0.00 H ATOM 2061 HG2 ARG A 508 -1.586 9.457 38.421 1.00 0.00 H ATOM 2062 HG3 ARG A 508 -2.415 10.928 37.863 1.00 0.00 H ATOM 2063 HD2 ARG A 508 -4.231 10.345 39.566 1.00 0.00 H ATOM 2064 HD3 ARG A 508 -2.676 10.944 40.191 1.00 0.00 H ATOM 2065 HE ARG A 508 -3.811 8.222 40.475 1.00 0.00 H ATOM 2066 HH12 ARG A 508 -0.134 9.251 41.923 1.00 0.00 H ATOM 2067 HH11 ARG A 508 -0.968 10.358 40.773 1.00 0.00 H ATOM 2068 HH22 ARG A 508 -1.129 7.295 42.559 1.00 0.00 H ATOM 2069 HH21 ARG A 508 -2.750 6.850 41.914 1.00 0.00 H ATOM 2070 H ARG A 508 -3.628 11.019 35.517 1.00 0.00 H ATOM 2071 N VAL A 509 -3.405 6.908 34.949 1.00 28.25 N ATOM 2072 CA VAL A 509 -4.076 5.987 34.041 1.00 29.87 C ATOM 2073 C VAL A 509 -4.660 4.814 34.820 1.00 28.46 C ATOM 2074 O VAL A 509 -5.673 4.239 34.426 1.00 31.72 O ATOM 2075 CB VAL A 509 -3.096 5.488 32.948 1.00 33.28 C ATOM 2076 CG1 VAL A 509 -3.638 4.263 32.218 1.00 43.26 C ATOM 2077 CG2 VAL A 509 -2.804 6.606 31.960 1.00 31.17 C ATOM 2078 HA VAL A 509 -4.892 6.515 33.547 1.00 0.00 H ATOM 2079 HB VAL A 509 -2.170 5.192 33.441 1.00 0.00 H ATOM 2080 HG11 VAL A 509 -3.794 3.455 32.933 1.00 0.00 H ATOM 2081 HG12 VAL A 509 -4.585 4.516 31.740 1.00 0.00 H ATOM 2082 HG13 VAL A 509 -2.921 3.946 31.461 1.00 0.00 H ATOM 2083 HG21 VAL A 509 -3.734 6.925 31.489 1.00 0.00 H ATOM 2084 HG22 VAL A 509 -2.355 7.447 32.488 1.00 0.00 H ATOM 2085 HG23 VAL A 509 -2.115 6.244 31.197 1.00 0.00 H ATOM 2086 H VAL A 509 -2.614 6.557 35.526 1.00 0.00 H ATOM 2087 N ILE A 510 -4.019 4.469 35.932 1.00 25.82 N ATOM 2088 HN3 ILE A 510 -3.700 3.482 35.855 1.00 0.00 H ATOM 2089 HN2 ILE A 510 -4.661 4.565 36.745 1.00 0.00 H ATOM 2090 HN1 ILE A 510 -3.196 5.091 36.063 1.00 0.00 H TER 2091 ILE A 510 HETATM 2092 O HOH 1 24.998 4.446 19.478 1.00 26.41 O HETATM 2093 O HOH 2 1.746 17.598 51.700 1.00 36.98 O HETATM 2094 O HOH 3 6.816 24.559 45.214 1.00 31.63 O HETATM 2095 O HOH 4 13.721 11.710 16.030 1.00 15.43 O HETATM 2096 O HOH 5 23.614 10.249 12.592 1.00 33.02 O HETATM 2097 O HOH 6 23.000 2.106 19.830 1.00 20.31 O HETATM 2098 O HOH 7 19.295 8.098 9.166 1.00 24.75 O HETATM 2099 O HOH 8 17.394 14.073 23.386 1.00 13.62 O HETATM 2100 O HOH 9 12.567 25.512 38.421 1.00 41.03 O HETATM 2101 O HOH 10 10.965 23.495 36.571 1.00 19.15 O HETATM 2102 O HOH 11 3.156 21.734 43.513 1.00 33.85 O HETATM 2103 O HOH 12 4.030 13.877 49.281 1.00 28.52 O HETATM 2104 O HOH 13 3.616 6.403 53.794 1.00 28.93 O HETATM 2105 O HOH 14 4.958 8.529 49.863 1.00 26.35 O HETATM 2106 O HOH 15 7.054 14.191 55.101 1.00 25.42 O HETATM 2107 O HOH 16 0.754 17.428 54.184 1.00 27.51 O HETATM 2108 O HOH 17 2.544 12.735 59.657 1.00 19.04 O HETATM 2109 O HOH 18 8.553 8.588 53.740 1.00 25.89 O HETATM 2110 O HOH 19 4.397 6.854 56.293 1.00 25.54 O HETATM 2111 O HOH 20 7.518 10.247 48.953 1.00 23.26 O HETATM 2112 O HOH 21 10.460 17.333 50.948 1.00 22.26 O HETATM 2113 O HOH 22 13.534 16.455 50.787 1.00 19.56 O HETATM 2114 O HOH 23 17.519 -1.034 24.402 1.00 34.42 O HETATM 2115 O HOH 24 9.661 23.996 44.707 1.00 23.35 O HETATM 2116 O HOH 25 15.692 21.630 40.332 1.00 20.76 O HETATM 2117 O HOH 26 21.284 21.990 34.849 1.00 24.00 O HETATM 2118 O HOH 27 22.727 14.297 30.225 1.00 14.42 O HETATM 2119 O HOH 28 23.515 11.002 28.091 1.00 26.51 O HETATM 2120 O HOH 29 23.822 1.402 26.493 1.00 22.18 O HETATM 2121 O HOH 30 20.934 1.795 26.488 1.00 22.82 O HETATM 2122 O HOH 31 15.858 -1.419 25.829 1.00 33.37 O HETATM 2123 O HOH 32 15.777 -4.402 18.550 1.00 29.34 O HETATM 2124 O HOH 33 5.559 2.501 18.259 1.00 18.64 O HETATM 2125 O HOH 34 7.749 4.868 33.197 1.00 17.91 O HETATM 2126 O HOH 35 8.089 16.812 44.054 1.00 18.62 O HETATM 2127 O HOH 36 5.337 11.855 47.928 1.00 35.26 O HETATM 2128 O HOH 37 2.859 5.001 44.426 1.00 26.48 O HETATM 2129 O HOH 38 3.529 12.002 25.666 1.00 20.36 O HETATM 2130 O HOH 39 -0.061 10.053 27.794 1.00 22.35 O HETATM 2131 O HOH 40 1.556 8.791 21.254 1.00 27.87 O HETATM 2132 O HOH 41 10.156 13.484 14.916 1.00 42.45 O HETATM 2133 O HOH 42 20.099 14.420 22.401 1.00 25.43 O HETATM 2134 O HOH 43 12.784 20.740 24.210 1.00 17.21 O HETATM 2135 O HOH 44 8.827 19.814 18.337 1.00 21.45 O HETATM 2136 O HOH 45 10.458 20.673 25.239 1.00 20.46 O HETATM 2137 O HOH 46 3.998 19.108 23.679 1.00 26.02 O HETATM 2138 O HOH 47 -0.882 17.535 27.738 1.00 32.07 O HETATM 2139 O HOH 48 -3.030 5.150 38.399 1.00 33.18 O HETATM 2140 O HOH 49 21.920 4.629 28.813 1.00 26.67 O HETATM 2141 O HOH 50 0.118 12.756 29.722 1.00 28.49 O HETATM 2142 O HOH 51 7.508 25.832 31.131 1.00 37.99 O HETATM 2143 O HOH 52 16.757 12.020 8.161 1.00 40.35 O HETATM 2144 O HOH 53 24.422 8.660 19.006 1.00 33.13 O HETATM 2145 O HOH 54 9.789 18.189 15.727 1.00 28.16 O HETATM 2146 O HOH 55 -5.467 9.525 31.791 1.00 29.21 O HETATM 2147 O HOH 56 2.488 15.660 19.396 1.00 37.21 O HETATM 2148 O HOH 57 5.903 5.416 49.715 1.00 33.93 O HETATM 2149 O HOH 58 13.221 11.410 8.768 1.00 42.55 O HETATM 2150 O HOH 59 11.076 7.888 10.587 1.00 43.32 O HETATM 2151 O HOH 60 10.790 25.455 43.279 1.00 40.72 O HETATM 2152 O HOH 61 1.323 18.464 19.316 1.00 44.66 O HETATM 2153 O HOH 62 -1.931 17.225 35.434 1.00 37.91 O HETATM 2154 O HOH 63 12.238 2.942 34.662 1.00 28.91 O HETATM 2155 O HOH 64 13.132 5.937 44.621 1.00 29.10 O HETATM 2156 O HOH 65 18.708 4.414 8.136 1.00 30.75 O HETATM 2157 O HOH 66 -3.408 22.718 41.834 1.00 32.41 O HETATM 2158 O HOH 67 17.247 0.662 35.002 1.00 28.08 O HETATM 2159 O HOH 68 16.968 17.342 14.894 1.00 32.88 O HETATM 2160 O HOH 69 2.238 13.569 23.654 1.00 22.83 O HETATM 2161 O HOH 70 11.768 6.450 13.102 1.00 42.62 O HETATM 2162 O HOH 71 -7.212 2.116 34.540 1.00 36.67 O HETATM 2163 O HOH 72 7.342 7.660 11.660 1.00 44.28 O HETATM 2164 O HOH 73 7.911 1.894 9.498 1.00 46.61 O HETATM 2165 O HOH 74 19.464 19.771 38.246 1.00 35.64 O HETATM 2166 O HOH 75 6.118 4.296 10.818 1.00 38.22 O HETATM 2167 O HOH 76 15.918 22.214 50.168 1.00 40.81 O HETATM 2168 O HOH 77 20.677 8.713 11.216 1.00 31.23 O HETATM 2169 O HOH 78 15.287 18.549 13.963 1.00 37.29 O HETATM 2170 O HOH 79 -5.948 21.584 42.867 1.00 44.46 O HETATM 2171 O HOH 80 8.672 21.490 48.569 1.00 34.36 O HETATM 2172 O HOH 81 23.247 16.650 32.054 1.00 29.03 O HETATM 2173 O HOH 82 20.864 11.622 13.972 1.00 36.07 O HETATM 2174 O HOH 83 5.627 15.192 48.039 1.00 30.04 O HETATM 2175 O HOH 84 8.128 27.674 36.286 1.00 47.12 O HETATM 2176 O HOH 85 10.149 7.867 7.230 1.00 43.63 O HETATM 2177 O HOH 86 3.617 11.739 7.207 1.00 38.66 O HETATM 2178 O HOH 87 2.158 23.970 36.363 1.00 47.58 O HETATM 2179 O HOH 88 9.905 1.774 8.754 1.00 41.46 O HETATM 2180 O HOH 89 3.255 -3.668 28.363 1.00 38.16 O HETATM 2181 O HOH 90 14.814 -5.091 16.751 1.00 41.40 O HETATM 2182 O HOH 91 9.802 5.266 11.857 1.00 35.96 O HETATM 2183 O HOH 92 9.411 26.963 38.440 1.00 51.32 O HETATM 2184 O HOH 93 2.729 24.036 33.495 1.00 36.03 O HETATM 2185 O HOH 94 11.940 -8.190 20.982 1.00 46.63 O HETATM 2186 O HOH 95 25.590 8.073 22.373 1.00 36.36 O HETATM 2187 O HOH 96 -0.221 19.068 25.857 1.00 39.02 O HETATM 2188 O HOH 97 6.035 26.588 39.189 1.00 48.08 O HETATM 2189 O HOH 98 14.160 -6.731 18.794 1.00 43.82 O HETATM 2190 O HOH 99 8.899 16.002 55.284 1.00 31.49 O HETATM 2191 O HOH 100 -0.675 7.550 29.939 1.00 47.94 O HETATM 2192 O HOH 101 -0.105 21.948 39.576 1.00 40.74 O HETATM 2193 O HOH 102 2.284 23.039 45.721 1.00 32.87 O HETATM 2194 O HOH 103 14.617 -0.005 42.195 1.00 44.29 O HETATM 2195 O HOH 104 10.376 -6.020 19.546 1.00 40.43 O HETATM 2196 O HOH 105 9.920 6.724 14.212 1.00 32.81 O HETATM 2197 O HOH 106 4.518 9.397 8.363 1.00 48.15 O HETATM 2198 O HOH 107 -2.318 7.440 28.007 1.00 46.82 O HETATM 2199 O HOH 108 -1.440 19.500 19.548 1.00 38.53 O HETATM 2200 O HOH 109 1.087 -1.549 28.910 1.00 51.79 O HETATM 2201 O HOH 110 3.521 4.901 9.622 1.00 51.24 O HETATM 2202 O HOH 111 4.714 4.258 52.571 1.00 38.02 O HETATM 2203 O HOH 112 -0.918 23.608 39.355 1.00 51.80 O HETATM 2204 O HOH 113 9.056 8.362 10.100 1.00 46.48 O HETATM 2205 O HOH 114 8.758 24.741 47.706 1.00 51.47 O HETATM 2206 O HOH 115 3.767 -3.969 19.640 1.00 42.30 O HETATM 2207 O HOH 116 -0.419 20.581 36.082 1.00 38.92 O HETATM 2208 O HOH 117 2.947 2.561 28.445 1.00 61.78 O HETATM 2209 O HOH 118 19.275 12.639 45.503 1.00 25.86 O HETATM 2210 O HOH 119 18.198 18.896 44.569 1.00 29.49 O HETATM 2211 O HOH 120 8.267 -4.491 31.731 1.00 41.94 O HETATM 2212 O HOH 121 19.184 17.600 17.554 1.00 48.91 O HETATM 2213 O HOH 122 3.964 30.481 34.789 1.00 55.12 O HETATM 2214 O HOH 123 -4.480 24.693 39.300 1.00 43.03 O HETATM 2215 O HOH 124 1.008 2.854 33.873 1.00 50.89 O HETATM 2216 O HOH 125 4.977 28.919 35.000 1.00 46.03 O HETATM 2217 O HOH 126 7.825 -2.910 35.355 1.00 52.30 O HETATM 2218 O HOH 127 9.301 -3.662 33.208 1.00 58.64 O HETATM 2219 O HOH 128 2.708 16.050 22.554 1.00 48.89 O HETATM 2220 O HOH 129 5.041 -3.061 43.091 1.00 47.46 O HETATM 2221 O HOH 130 6.359 18.559 17.308 1.00 46.92 O HETATM 2222 O HOH 131 10.542 28.042 39.539 1.00 58.36 O HETATM 2223 O HOH 132 3.497 -2.191 40.947 1.00 54.32 O HETATM 2224 O HOH 133 8.576 17.829 52.465 1.00 51.47 O HETATM 2225 O HOH 134 3.469 4.969 7.510 1.00 42.97 O HETATM 2226 O HOH 135 8.370 -5.938 20.972 1.00 52.65 O HETATM 2227 O HOH 136 -2.705 24.291 40.473 1.00 52.57 O HETATM 2228 O HOH 137 0.087 20.778 42.155 1.00 52.44 O HETATM 2229 O HOH 138 3.057 13.470 9.304 1.00 59.08 O HETATM 2230 O HOH 139 0.473 22.573 35.649 1.00 60.17 O HETATM 2231 C1 I A 3 14.452 1.612 38.969 1.00 0.15 C HETATM 2232 C2 I A 3 13.447 1.001 37.996 1.00 0.12 C HETATM 2233 C3 I A 3 12.128 0.636 38.661 1.00 0.12 C HETATM 2234 C4 I A 3 11.570 1.732 39.580 1.00 0.15 C HETATM 2235 C5 I A 3 12.661 2.276 40.472 1.00 0.15 C HETATM 2236 C6 I A 3 13.818 2.801 39.674 1.00 0.12 C HETATM 2237 O6 I A 3 14.722 3.438 40.571 1.00 -0.39 O HETATM 2238 H9 I A 3 14.278 4.152 41.013 1.00 0.21 H HETATM 2239 H6 I A 3 13.470 3.530 38.927 1.00 0.07 H HETATM 2240 O5 I A 3 12.161 3.315 41.326 1.00 -0.27 O HETATM 2241 P5 I A 3 12.723 3.379 42.810 1.00 0.20 P HETATM 2242 O51 I A 3 13.735 4.504 42.892 1.00 -0.55 O HETATM 2243 O52 I A 3 13.397 2.087 43.190 1.00 -0.55 O HETATM 2244 O53 I A 3 11.585 3.645 43.775 1.00 -0.55 O HETATM 2245 H5 I A 3 13.024 1.452 41.104 1.00 0.07 H HETATM 2246 O4 I A 3 10.553 1.217 40.418 1.00 -0.27 O HETATM 2247 P4 I A 3 9.244 2.120 40.785 1.00 0.20 P HETATM 2248 O41 I A 3 8.572 2.579 39.511 1.00 -0.55 O HETATM 2249 O42 I A 3 9.601 3.334 41.609 1.00 -0.55 O HETATM 2250 O43 I A 3 8.273 1.281 41.585 1.00 -0.55 O HETATM 2251 H4 I A 3 11.160 2.543 38.961 1.00 0.07 H HETATM 2252 O3 I A 3 11.162 0.352 37.666 1.00 -0.39 O HETATM 2253 H8 I A 3 10.985 1.139 37.164 1.00 0.21 H HETATM 2254 H3 I A 3 12.293 -0.267 39.267 1.00 0.07 H HETATM 2255 O2 I A 3 13.187 1.935 36.933 1.00 -0.39 O HETATM 2256 H7 I A 3 12.605 1.536 36.297 1.00 0.21 H HETATM 2257 H2 I A 3 13.888 0.086 37.573 1.00 0.07 H HETATM 2258 O1 I A 3 15.665 2.011 38.327 1.00 -0.27 O HETATM 2259 P1 I A 3 17.027 1.785 39.147 1.00 0.20 P HETATM 2260 O11 I A 3 17.395 0.327 39.144 1.00 -0.55 O HETATM 2261 O12 I A 3 16.812 2.237 40.587 1.00 -0.55 O HETATM 2262 O13 I A 3 18.146 2.599 38.529 1.00 -0.55 O HETATM 2263 H1 I A 3 14.702 0.851 39.723 1.00 0.07 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 2087 2073 2088 2089 2090 CONECT 2088 2087 CONECT 2089 2087 CONECT 2090 2087 CONECT 2231 2232 2236 2258 2263 CONECT 2232 2231 2233 2255 2257 CONECT 2233 2232 2234 2252 2254 CONECT 2234 2233 2235 2246 2251 CONECT 2235 2234 2236 2240 2245 CONECT 2236 2231 2235 2237 2239 CONECT 2237 2236 2238 CONECT 2238 2237 CONECT 2239 2236 CONECT 2240 2235 2241 CONECT 2241 2240 2242 2243 2244 CONECT 2242 2241 CONECT 2243 2241 CONECT 2244 2241 CONECT 2245 2235 CONECT 2246 2234 2247 CONECT 2247 2246 2248 2249 2250 CONECT 2248 2247 CONECT 2249 2247 CONECT 2250 2247 CONECT 2251 2234 CONECT 2252 2233 2253 CONECT 2253 2252 CONECT 2254 2233 CONECT 2255 2232 2256 CONECT 2256 2255 CONECT 2257 2232 CONECT 2258 2231 2259 CONECT 2259 2258 2260 2261 2262 CONECT 2260 2259 CONECT 2261 2259 CONECT 2262 2259 CONECT 2263 2231 MASTER 0 0 0 0 0 0 0 0 2262 1 41 10 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 4np9
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Protein Sequence Similarity
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Ligand Name
1btn
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PDBbind
I3P
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1mai
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PDBbind
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I3P
Entry Information
PDB ID
4np9
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Rabphilin-3A
Ligand Name
I3P
EC.Number
E.C.-.-.-.-
Resolution
1.92(Å)
Affinity (Kd/Ki/IC50)
Kd=9.4uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Proc.Natl.Acad.Sci.USA
Ligand Properties
Formula
C
6
H
1
8
O
1
5
P
3
Molecular Weight
423.119
Exact Mass
422.986
No. of atoms
42
No. of bonds
42
Polar Surface Area
311.22
LOGP Value
-7.48 (
Computed with XLOGP3
)
-4.80 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 1
Canonical SMILES
O[C@@H]1[C@@H](OP(O)(O)O)[C@H](OP(O)(O)O)[C@H]([C@@H]([C@@H]1O)OP(O)(O)O)O
InChI String
InChI=1S/C6H21O15P3/c7-1-2(8)5(20-23(13,14)15)6(21-24(16,17)18)3(9)4(1)19-22(10,11)12/h1-18,22-24H/t1-,2+,3+,4-,5-,6-/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):
P47709
Entrez Gene ID
NCBI Entrez Gene ID:
171039
ASD
Information of known allosteric effects of PDB entries
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