Browse entries in the PDBbind-CN Database
HEADER 2P0D_COMPLEX COMPND 2P0D_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 44 SER HIS GLU VAL GLU LYS SER GLY LEU LEU ASN MET THR SEQRES 2 A 44 LYS ILE ALA GLN GLY GLY ARG LYS LEU ARG LYS ASN TRP SEQRES 3 A 44 GLY PRO SER TRP VAL VAL LEU THR GLY ASN SER LEU VAL SEQRES 4 A 44 PHE TYR ARG GLU PRO SEQRES 1 A 63 ARG PRO GLU SER SER VAL ASP LEU ARG GLY ALA ALA LEU SEQRES 2 A 63 ALA HIS GLY ARG HIS LEU SER SER ARG ARG ASN VAL LEU SEQRES 3 A 63 HIS ILE ARG THR ILE PRO GLY HIS GLU PHE LEU LEU GLN SEQRES 4 A 63 SER ASP HIS GLU THR GLU LEU ARG ALA TRP HIS ARG ALA SEQRES 5 A 63 LEU ARG THR VAL ILE GLU ARG LEU VAL ARG TRP HET I A 3P 33 ATOM 1 N SER A 320 25.735 -4.232 -1.359 1.00 37.53 N ATOM 2 CA SER A 320 24.435 -4.229 -0.620 1.00 36.92 C ATOM 3 C SER A 320 23.313 -3.467 -1.364 1.00 36.04 C ATOM 4 O SER A 320 22.228 -4.007 -1.517 1.00 35.90 O ATOM 5 CB SER A 320 24.622 -3.736 0.817 1.00 37.19 C ATOM 6 OG SER A 320 23.616 -2.789 1.162 1.00 39.54 O ATOM 7 HA SER A 320 24.096 -5.264 -0.574 1.00 0.00 H ATOM 8 HB2 SER A 320 25.602 -3.267 0.910 1.00 0.00 H ATOM 9 HB3 SER A 320 24.562 -4.586 1.497 1.00 0.00 H ATOM 10 HG SER A 320 23.756 -2.485 2.094 1.00 0.00 H ATOM 11 HN3 SER A 320 26.057 -3.253 -1.496 1.00 0.00 H ATOM 12 HN2 SER A 320 25.605 -4.688 -2.285 1.00 0.00 H ATOM 13 HN1 SER A 320 26.444 -4.758 -0.809 1.00 0.00 H ATOM 14 N HIS A 321 23.588 -2.236 -1.822 1.00 35.13 N ATOM 15 CA HIS A 321 22.684 -1.463 -2.722 1.00 33.49 C ATOM 16 C HIS A 321 22.578 -2.090 -4.147 1.00 32.60 C ATOM 17 O HIS A 321 21.673 -1.767 -4.936 1.00 33.18 O ATOM 18 CB HIS A 321 23.149 0.022 -2.827 1.00 33.63 C ATOM 19 CG HIS A 321 24.209 0.250 -3.866 1.00 31.07 C ATOM 20 ND1 HIS A 321 23.920 0.699 -5.140 1.00 30.72 N ATOM 21 CD2 HIS A 321 25.543 0.013 -3.846 1.00 29.53 C ATOM 22 CE1 HIS A 321 25.032 0.738 -5.854 1.00 26.34 C ATOM 23 NE2 HIS A 321 26.028 0.314 -5.098 1.00 26.79 N ATOM 24 HA HIS A 321 21.691 -1.501 -2.274 1.00 0.00 H ATOM 25 HB2 HIS A 321 22.284 0.637 -3.076 1.00 0.00 H ATOM 26 HB3 HIS A 321 23.544 0.329 -1.859 1.00 0.00 H ATOM 27 HD2 HIS A 321 26.123 -0.348 -2.997 1.00 0.00 H ATOM 28 HE1 HIS A 321 25.113 1.065 -6.891 1.00 0.00 H ATOM 29 H HIS A 321 24.484 -1.795 -1.532 1.00 0.00 H ATOM 30 N GLU A 322 23.506 -2.976 -4.490 1.00 30.47 N ATOM 31 CA GLU A 322 23.513 -3.519 -5.835 1.00 28.08 C ATOM 32 C GLU A 322 22.385 -4.544 -6.037 1.00 25.71 C ATOM 33 O GLU A 322 22.053 -5.279 -5.125 1.00 23.69 O ATOM 34 CB GLU A 322 24.863 -4.147 -6.123 1.00 28.94 C ATOM 35 CG GLU A 322 25.920 -3.111 -6.574 1.00 32.25 C ATOM 36 CD GLU A 322 27.333 -3.685 -6.545 1.00 37.58 C ATOM 37 OE1 GLU A 322 27.494 -4.921 -6.401 1.00 41.06 O ATOM 38 OE2 GLU A 322 28.287 -2.901 -6.665 1.00 38.52 O ATOM 39 HA GLU A 322 23.338 -2.702 -6.535 1.00 0.00 H ATOM 40 HB2 GLU A 322 25.220 -4.638 -5.218 1.00 0.00 H ATOM 41 HB3 GLU A 322 24.742 -4.888 -6.913 1.00 0.00 H ATOM 42 HG2 GLU A 322 25.690 -2.793 -7.591 1.00 0.00 H ATOM 43 HG3 GLU A 322 25.876 -2.250 -5.907 1.00 0.00 H ATOM 44 H GLU A 322 24.222 -3.278 -3.799 1.00 0.00 H ATOM 45 N VAL A 323 21.813 -4.568 -7.234 1.00 24.16 N ATOM 46 CA VAL A 323 20.746 -5.513 -7.564 1.00 22.63 C ATOM 47 C VAL A 323 21.278 -6.911 -7.924 1.00 22.87 C ATOM 48 O VAL A 323 22.054 -7.084 -8.866 1.00 21.82 O ATOM 49 CB VAL A 323 19.835 -4.953 -8.641 1.00 23.02 C ATOM 50 CG1 VAL A 323 18.758 -5.976 -9.007 1.00 23.36 C ATOM 51 CG2 VAL A 323 19.231 -3.609 -8.164 1.00 22.36 C ATOM 52 HA VAL A 323 20.149 -5.646 -6.662 1.00 0.00 H ATOM 53 HB VAL A 323 20.409 -4.755 -9.546 1.00 0.00 H ATOM 54 HG11 VAL A 323 19.233 -6.885 -9.377 1.00 0.00 H ATOM 55 HG12 VAL A 323 18.165 -6.209 -8.123 1.00 0.00 H ATOM 56 HG13 VAL A 323 18.112 -5.561 -9.781 1.00 0.00 H ATOM 57 HG21 VAL A 323 18.656 -3.774 -7.252 1.00 0.00 H ATOM 58 HG22 VAL A 323 20.035 -2.901 -7.965 1.00 0.00 H ATOM 59 HG23 VAL A 323 18.578 -3.210 -8.940 1.00 0.00 H ATOM 60 H VAL A 323 22.133 -3.895 -7.959 1.00 0.00 H ATOM 61 N GLU A 324 20.870 -7.909 -7.147 1.00 21.56 N ATOM 62 CA GLU A 324 21.270 -9.297 -7.407 1.00 21.35 C ATOM 63 C GLU A 324 20.350 -9.989 -8.395 1.00 19.85 C ATOM 64 O GLU A 324 20.797 -10.837 -9.150 1.00 18.86 O ATOM 65 CB GLU A 324 21.308 -10.104 -6.134 1.00 21.77 C ATOM 66 CG GLU A 324 22.010 -9.381 -5.040 1.00 28.19 C ATOM 67 CD GLU A 324 23.118 -10.193 -4.408 1.00 35.05 C ATOM 68 OE1 GLU A 324 23.391 -11.348 -4.844 1.00 37.94 O ATOM 69 OE2 GLU A 324 23.713 -9.651 -3.452 1.00 38.15 O ATOM 70 HA GLU A 324 22.269 -9.244 -7.840 1.00 0.00 H ATOM 71 HB2 GLU A 324 20.286 -10.314 -5.819 1.00 0.00 H ATOM 72 HB3 GLU A 324 21.828 -11.043 -6.327 1.00 0.00 H ATOM 73 HG2 GLU A 324 22.439 -8.466 -5.448 1.00 0.00 H ATOM 74 HG3 GLU A 324 21.283 -9.127 -4.269 1.00 0.00 H ATOM 75 H GLU A 324 20.253 -7.702 -6.336 1.00 0.00 H ATOM 76 N LYS A 325 19.065 -9.646 -8.359 1.00 16.47 N ATOM 77 CA LYS A 325 18.075 -10.257 -9.263 1.00 16.97 C ATOM 78 C LYS A 325 16.871 -9.357 -9.348 1.00 15.94 C ATOM 79 O LYS A 325 16.538 -8.691 -8.378 1.00 16.34 O ATOM 80 CB LYS A 325 17.653 -11.655 -8.775 1.00 16.16 C ATOM 81 CG LYS A 325 16.893 -12.468 -9.823 1.00 15.87 C ATOM 82 CD LYS A 325 16.822 -13.936 -9.353 1.00 15.55 C ATOM 83 CE LYS A 325 15.907 -14.721 -10.318 1.00 17.91 C ATOM 84 NZ LYS A 325 16.582 -14.897 -11.655 1.00 18.90 N ATOM 85 HA LYS A 325 18.528 -10.375 -10.248 1.00 0.00 H ATOM 86 HB2 LYS A 325 18.550 -12.207 -8.495 1.00 0.00 H ATOM 87 HB3 LYS A 325 17.013 -11.536 -7.901 1.00 0.00 H ATOM 88 HG2 LYS A 325 15.885 -12.070 -9.937 1.00 0.00 H ATOM 89 HG3 LYS A 325 17.414 -12.413 -10.779 1.00 0.00 H ATOM 90 HD2 LYS A 325 17.821 -14.372 -9.358 1.00 0.00 H ATOM 91 HD3 LYS A 325 16.414 -13.979 -8.343 1.00 0.00 H ATOM 92 HE2 LYS A 325 14.975 -14.173 -10.455 1.00 0.00 H ATOM 93 HE3 LYS A 325 15.692 -15.701 -9.892 1.00 0.00 H ATOM 94 HZ1 LYS A 325 16.786 -13.963 -12.065 1.00 0.00 H ATOM 95 HZ2 LYS A 325 17.470 -15.422 -11.527 1.00 0.00 H ATOM 96 HZ3 LYS A 325 15.954 -15.427 -12.292 1.00 0.00 H ATOM 97 H LYS A 325 18.751 -8.928 -7.675 1.00 0.00 H ATOM 98 N SER A 326 16.254 -9.301 -10.519 1.00 16.90 N ATOM 99 CA SER A 326 15.029 -8.538 -10.678 1.00 17.43 C ATOM 100 C SER A 326 14.174 -9.252 -11.690 1.00 16.57 C ATOM 101 O SER A 326 14.687 -9.998 -12.543 1.00 16.24 O ATOM 102 CB SER A 326 15.323 -7.072 -11.050 1.00 18.16 C ATOM 103 OG SER A 326 16.021 -7.015 -12.272 1.00 22.12 O ATOM 104 HA SER A 326 14.483 -8.481 -9.736 1.00 0.00 H ATOM 105 HB2 SER A 326 15.928 -6.615 -10.267 1.00 0.00 H ATOM 106 HB3 SER A 326 14.383 -6.528 -11.145 1.00 0.00 H ATOM 107 HG SER A 326 16.205 -6.070 -12.502 1.00 0.00 H ATOM 108 H SER A 326 16.652 -9.810 -11.334 1.00 0.00 H ATOM 109 N GLY A 327 12.863 -9.084 -11.586 1.00 15.41 N ATOM 110 CA GLY A 327 11.983 -9.853 -12.445 1.00 15.46 C ATOM 111 C GLY A 327 10.558 -9.696 -11.997 1.00 15.42 C ATOM 112 O GLY A 327 10.290 -9.184 -10.910 1.00 15.26 O ATOM 113 HA3 GLY A 327 12.262 -10.906 -12.398 1.00 0.00 H ATOM 114 HA2 GLY A 327 12.080 -9.498 -13.471 1.00 0.00 H ATOM 115 H GLY A 327 12.471 -8.410 -10.898 1.00 0.00 H ATOM 116 N LEU A 328 9.642 -10.097 -12.860 1.00 16.63 N ATOM 117 CA LEU A 328 8.226 -10.039 -12.536 1.00 16.66 C ATOM 118 C LEU A 328 7.840 -11.348 -11.820 1.00 15.67 C ATOM 119 O LEU A 328 8.188 -12.467 -12.275 1.00 17.02 O ATOM 120 CB LEU A 328 7.409 -9.873 -13.801 1.00 17.30 C ATOM 121 CG LEU A 328 5.934 -9.587 -13.597 1.00 21.21 C ATOM 122 CD1 LEU A 328 5.733 -8.116 -13.186 1.00 19.95 C ATOM 123 CD2 LEU A 328 5.226 -9.885 -14.888 1.00 24.84 C ATOM 124 HA LEU A 328 8.024 -9.187 -11.887 1.00 0.00 H ATOM 125 HB2 LEU A 328 7.835 -9.047 -14.370 1.00 0.00 H ATOM 126 HB3 LEU A 328 7.495 -10.793 -14.379 1.00 0.00 H ATOM 127 HG LEU A 328 5.527 -10.209 -12.800 1.00 0.00 H ATOM 128 HD21 LEU A 328 5.629 -9.250 -15.677 1.00 0.00 H ATOM 129 HD22 LEU A 328 5.376 -10.932 -15.150 1.00 0.00 H ATOM 130 HD23 LEU A 328 4.160 -9.688 -14.770 1.00 0.00 H ATOM 131 HD11 LEU A 328 6.268 -7.924 -12.256 1.00 0.00 H ATOM 132 HD12 LEU A 328 6.120 -7.465 -13.970 1.00 0.00 H ATOM 133 HD13 LEU A 328 4.670 -7.922 -13.042 1.00 0.00 H ATOM 134 H LEU A 328 9.939 -10.461 -13.788 1.00 0.00 H ATOM 135 N LEU A 329 7.169 -11.205 -10.682 1.00 14.31 N ATOM 136 CA LEU A 329 6.618 -12.336 -9.957 1.00 13.02 C ATOM 137 C LEU A 329 5.208 -11.979 -9.488 1.00 13.39 C ATOM 138 O LEU A 329 4.853 -10.805 -9.383 1.00 13.32 O ATOM 139 CB LEU A 329 7.455 -12.643 -8.717 1.00 12.72 C ATOM 140 CG LEU A 329 8.866 -13.196 -8.856 1.00 12.74 C ATOM 141 CD1 LEU A 329 9.510 -13.220 -7.439 1.00 12.83 C ATOM 142 CD2 LEU A 329 8.771 -14.612 -9.495 1.00 13.60 C ATOM 143 HA LEU A 329 6.613 -13.202 -10.618 1.00 0.00 H ATOM 144 HB2 LEU A 329 7.538 -11.711 -8.157 1.00 0.00 H ATOM 145 HB3 LEU A 329 6.891 -13.369 -8.131 1.00 0.00 H ATOM 146 HG LEU A 329 9.494 -12.582 -9.502 1.00 0.00 H ATOM 147 HD21 LEU A 329 8.175 -15.260 -8.852 1.00 0.00 H ATOM 148 HD22 LEU A 329 8.299 -14.536 -10.475 1.00 0.00 H ATOM 149 HD23 LEU A 329 9.773 -15.028 -9.604 1.00 0.00 H ATOM 150 HD11 LEU A 329 9.538 -12.207 -7.037 1.00 0.00 H ATOM 151 HD12 LEU A 329 8.917 -13.857 -6.782 1.00 0.00 H ATOM 152 HD13 LEU A 329 10.524 -13.613 -7.509 1.00 0.00 H ATOM 153 H LEU A 329 7.034 -10.249 -10.297 1.00 0.00 H ATOM 154 N ASN A 330 4.431 -12.997 -9.128 1.00 12.55 N ATOM 155 CA ASN A 330 3.169 -12.763 -8.451 1.00 12.98 C ATOM 156 C ASN A 330 3.479 -12.761 -6.997 1.00 12.57 C ATOM 157 O ASN A 330 4.346 -13.534 -6.569 1.00 12.61 O ATOM 158 CB ASN A 330 2.178 -13.880 -8.815 1.00 13.31 C ATOM 159 CG ASN A 330 1.829 -13.843 -10.289 1.00 16.08 C ATOM 160 OD1 ASN A 330 1.558 -12.766 -10.813 1.00 14.92 O ATOM 161 ND2 ASN A 330 1.858 -14.995 -10.965 1.00 16.43 N ATOM 162 HA ASN A 330 2.708 -11.820 -8.743 1.00 0.00 H ATOM 163 HB2 ASN A 330 2.627 -14.845 -8.580 1.00 0.00 H ATOM 164 HB3 ASN A 330 1.267 -13.752 -8.230 1.00 0.00 H ATOM 165 HD22 ASN A 330 2.094 -15.881 -10.473 1.00 0.00 H ATOM 166 HD21 ASN A 330 1.645 -15.006 -11.983 1.00 0.00 H ATOM 167 H ASN A 330 4.731 -13.971 -9.334 1.00 0.00 H ATOM 168 N MET A 331 2.772 -11.923 -6.230 1.00 12.26 N ATOM 169 CA MET A 331 3.068 -11.767 -4.803 1.00 13.86 C ATOM 170 C MET A 331 1.791 -11.446 -4.046 1.00 13.46 C ATOM 171 O MET A 331 0.869 -10.856 -4.601 1.00 14.31 O ATOM 172 CB MET A 331 4.150 -10.672 -4.587 1.00 13.47 C ATOM 173 CG MET A 331 4.537 -10.363 -3.115 1.00 16.59 C ATOM 174 SD MET A 331 3.349 -9.201 -2.361 1.00 20.47 S ATOM 175 CE MET A 331 3.871 -7.634 -3.031 1.00 23.27 C ATOM 176 HA MET A 331 3.469 -12.703 -4.414 1.00 0.00 H ATOM 177 HB2 MET A 331 5.053 -10.991 -5.107 1.00 0.00 H ATOM 178 HB3 MET A 331 3.781 -9.749 -5.034 1.00 0.00 H ATOM 179 HG2 MET A 331 5.533 -9.921 -3.093 1.00 0.00 H ATOM 180 HG3 MET A 331 4.540 -11.291 -2.544 1.00 0.00 H ATOM 181 HE1 MET A 331 4.902 -7.439 -2.735 1.00 0.00 H ATOM 182 HE2 MET A 331 3.803 -7.665 -4.118 1.00 0.00 H ATOM 183 HE3 MET A 331 3.226 -6.843 -2.648 1.00 0.00 H ATOM 184 H MET A 331 1.998 -11.372 -6.654 1.00 0.00 H ATOM 185 N THR A 332 1.716 -11.888 -2.797 1.00 13.23 N ATOM 186 CA THR A 332 0.672 -11.405 -1.900 1.00 14.05 C ATOM 187 C THR A 332 1.232 -11.318 -0.508 1.00 12.99 C ATOM 188 O THR A 332 2.058 -12.155 -0.119 1.00 12.66 O ATOM 189 CB THR A 332 -0.619 -12.274 -1.903 1.00 13.15 C ATOM 190 OG1 THR A 332 -1.559 -11.682 -0.984 1.00 14.03 O ATOM 191 CG2 THR A 332 -0.318 -13.721 -1.462 1.00 12.85 C ATOM 192 HA THR A 332 0.367 -10.424 -2.265 1.00 0.00 H ATOM 193 HB THR A 332 -1.026 -12.308 -2.914 1.00 0.00 H ATOM 194 HG1 THR A 332 -1.163 -11.661 -0.077 1.00 0.00 H ATOM 195 HG23 THR A 332 0.393 -14.170 -2.156 1.00 0.00 H ATOM 196 HG21 THR A 332 0.108 -13.713 -0.459 1.00 0.00 H ATOM 197 HG22 THR A 332 -1.242 -14.299 -1.461 1.00 0.00 H ATOM 198 H THR A 332 2.408 -12.585 -2.455 1.00 0.00 H ATOM 199 N LYS A 333 0.826 -10.271 0.211 1.00 14.44 N ATOM 200 CA LYS A 333 1.093 -10.182 1.631 1.00 16.52 C ATOM 201 C LYS A 333 0.168 -11.160 2.313 1.00 16.84 C ATOM 202 O LYS A 333 -0.974 -11.369 1.850 1.00 17.40 O ATOM 203 CB LYS A 333 0.772 -8.774 2.132 1.00 18.62 C ATOM 204 CG LYS A 333 1.977 -7.916 2.426 1.00 23.04 C ATOM 205 CD LYS A 333 2.355 -8.165 3.913 1.00 29.74 C ATOM 206 CE LYS A 333 3.458 -7.238 4.486 1.00 32.38 C ATOM 207 NZ LYS A 333 3.013 -5.904 5.058 1.00 36.21 N ATOM 208 HA LYS A 333 2.140 -10.402 1.840 1.00 0.00 H ATOM 209 HB2 LYS A 333 0.175 -8.271 1.371 1.00 0.00 H ATOM 210 HB3 LYS A 333 0.189 -8.865 3.048 1.00 0.00 H ATOM 211 HG2 LYS A 333 2.806 -8.197 1.776 1.00 0.00 H ATOM 212 HG3 LYS A 333 1.736 -6.864 2.271 1.00 0.00 H ATOM 213 HD2 LYS A 333 1.457 -8.030 4.515 1.00 0.00 H ATOM 214 HD3 LYS A 333 2.701 -9.195 4.004 1.00 0.00 H ATOM 215 HE2 LYS A 333 4.164 -7.031 3.682 1.00 0.00 H ATOM 216 HE3 LYS A 333 3.965 -7.784 5.282 1.00 0.00 H ATOM 217 HZ1 LYS A 333 2.541 -5.350 4.315 1.00 0.00 H ATOM 218 HZ2 LYS A 333 2.351 -6.068 5.843 1.00 0.00 H ATOM 219 HZ3 LYS A 333 3.843 -5.383 5.406 1.00 0.00 H ATOM 220 H LYS A 333 0.306 -9.502 -0.258 1.00 0.00 H ATOM 221 N ILE A 334 0.637 -11.791 3.387 1.00 14.43 N ATOM 222 CA ILE A 334 -0.281 -12.637 4.195 1.00 13.90 C ATOM 223 C ILE A 334 -0.294 -12.320 5.684 1.00 14.46 C ATOM 224 O ILE A 334 -1.193 -12.771 6.391 1.00 15.00 O ATOM 225 CB ILE A 334 -0.037 -14.168 4.010 1.00 14.09 C ATOM 226 CG1 ILE A 334 1.317 -14.596 4.617 1.00 13.11 C ATOM 227 CG2 ILE A 334 -0.192 -14.571 2.524 1.00 12.44 C ATOM 228 CD1 ILE A 334 1.627 -16.094 4.438 1.00 12.17 C ATOM 229 HA ILE A 334 -1.259 -12.377 3.791 1.00 0.00 H ATOM 230 HB ILE A 334 -0.801 -14.714 4.563 1.00 0.00 H ATOM 231 HG12 ILE A 334 2.108 -14.020 4.136 1.00 0.00 H ATOM 232 HG13 ILE A 334 1.303 -14.372 5.684 1.00 0.00 H ATOM 233 HD11 ILE A 334 0.850 -16.685 4.924 1.00 0.00 H ATOM 234 HD12 ILE A 334 1.656 -16.333 3.375 1.00 0.00 H ATOM 235 HD13 ILE A 334 2.593 -16.320 4.889 1.00 0.00 H ATOM 236 HG21 ILE A 334 -1.201 -14.331 2.187 1.00 0.00 H ATOM 237 HG22 ILE A 334 0.533 -14.023 1.923 1.00 0.00 H ATOM 238 HG23 ILE A 334 -0.018 -15.642 2.419 1.00 0.00 H ATOM 239 H ILE A 334 1.636 -11.693 3.659 1.00 0.00 H ATOM 240 N ALA A 335 0.703 -11.573 6.160 1.00 15.48 N ATOM 241 CA ALA A 335 0.715 -11.062 7.552 1.00 17.27 C ATOM 242 C ALA A 335 1.464 -9.750 7.647 1.00 18.84 C ATOM 243 O ALA A 335 2.423 -9.510 6.912 1.00 17.55 O ATOM 244 CB ALA A 335 1.331 -12.085 8.545 1.00 16.42 C ATOM 245 HA ALA A 335 -0.326 -10.901 7.831 1.00 0.00 H ATOM 246 HB1 ALA A 335 0.747 -13.005 8.526 1.00 0.00 H ATOM 247 HB2 ALA A 335 2.359 -12.299 8.253 1.00 0.00 H ATOM 248 HB3 ALA A 335 1.318 -11.666 9.551 1.00 0.00 H ATOM 249 H ALA A 335 1.500 -11.341 5.533 1.00 0.00 H ATOM 250 N GLN A 336 1.045 -8.897 8.585 1.00 20.21 N ATOM 251 CA GLN A 336 1.798 -7.689 8.831 1.00 22.69 C ATOM 252 C GLN A 336 1.930 -7.553 10.329 1.00 22.88 C ATOM 253 O GLN A 336 0.917 -7.602 11.058 1.00 20.63 O ATOM 254 CB GLN A 336 1.102 -6.478 8.227 1.00 24.20 C ATOM 255 CG GLN A 336 1.962 -5.241 8.259 1.00 29.98 C ATOM 256 CD GLN A 336 1.130 -3.984 8.214 1.00 37.58 C ATOM 257 OE1 GLN A 336 0.468 -3.703 7.211 1.00 41.58 O ATOM 258 NE2 GLN A 336 1.149 -3.215 9.305 1.00 40.15 N ATOM 259 HA GLN A 336 2.781 -7.744 8.363 1.00 0.00 H ATOM 260 HB2 GLN A 336 0.849 -6.701 7.191 1.00 0.00 H ATOM 261 HB3 GLN A 336 0.189 -6.283 8.789 1.00 0.00 H ATOM 262 HG2 GLN A 336 2.551 -5.243 9.176 1.00 0.00 H ATOM 263 HG3 GLN A 336 2.632 -5.253 7.399 1.00 0.00 H ATOM 264 HE22 GLN A 336 1.722 -3.493 10.127 1.00 0.00 H ATOM 265 HE21 GLN A 336 0.590 -2.338 9.333 1.00 0.00 H ATOM 266 H GLN A 336 0.185 -9.100 9.133 1.00 0.00 H ATOM 267 N GLY A 337 3.179 -7.444 10.788 1.00 23.95 N ATOM 268 CA GLY A 337 3.480 -7.337 12.219 1.00 25.59 C ATOM 269 C GLY A 337 2.746 -8.402 12.997 1.00 26.47 C ATOM 270 O GLY A 337 2.154 -8.129 14.055 1.00 27.45 O ATOM 271 HA3 GLY A 337 3.172 -6.355 12.578 1.00 0.00 H ATOM 272 HA2 GLY A 337 4.553 -7.458 12.370 1.00 0.00 H ATOM 273 H GLY A 337 3.965 -7.435 10.107 1.00 0.00 H ATOM 274 N GLY A 338 2.751 -9.611 12.432 1.00 26.79 N ATOM 275 CA GLY A 338 2.215 -10.798 13.082 1.00 27.03 C ATOM 276 C GLY A 338 0.715 -10.950 13.010 1.00 27.36 C ATOM 277 O GLY A 338 0.176 -11.866 13.603 1.00 28.86 O ATOM 278 HA3 GLY A 338 2.500 -10.765 14.133 1.00 0.00 H ATOM 279 HA2 GLY A 338 2.665 -11.672 12.612 1.00 0.00 H ATOM 280 H GLY A 338 3.158 -9.710 11.480 1.00 0.00 H ATOM 281 N ARG A 339 0.087 -10.074 12.290 1.00 20.00 N ATOM 282 CA ARG A 339 -1.358 -10.152 12.116 1.00 20.00 C ATOM 283 C ARG A 339 -1.721 -10.578 10.697 1.00 20.00 C ATOM 284 O ARG A 339 -1.226 -10.063 9.780 1.00 23.16 O ATOM 285 CB ARG A 339 -2.006 -8.817 12.452 1.00 20.00 C ATOM 286 HA ARG A 339 -1.739 -10.909 12.802 1.00 0.00 H ATOM 287 HB2 ARG A 339 -1.786 -8.558 13.488 1.00 0.00 H ATOM 288 HB3 ARG A 339 -1.610 -8.046 11.792 1.00 0.00 H ATOM 289 H ARG A 339 0.620 -9.307 11.832 1.00 0.00 H ATOM 290 N LYS A 340 -2.609 -11.552 10.597 1.00 24.31 N ATOM 291 CA LYS A 340 -3.028 -12.108 9.313 1.00 23.68 C ATOM 292 C LYS A 340 -3.780 -11.108 8.438 1.00 23.29 C ATOM 293 O LYS A 340 -4.567 -10.281 8.929 1.00 23.98 O ATOM 294 CB LYS A 340 -3.867 -13.372 9.554 1.00 24.52 C ATOM 295 HA LYS A 340 -2.126 -12.363 8.757 1.00 0.00 H ATOM 296 HB2 LYS A 340 -3.268 -14.107 10.092 1.00 0.00 H ATOM 297 HB3 LYS A 340 -4.746 -13.116 10.145 1.00 0.00 H ATOM 298 H LYS A 340 -3.026 -11.938 11.468 1.00 0.00 H ATOM 299 N LEU A 341 -3.506 -11.170 7.143 1.00 20.83 N ATOM 300 CA LEU A 341 -4.116 -10.303 6.133 1.00 19.88 C ATOM 301 C LEU A 341 -4.874 -11.137 5.122 1.00 19.05 C ATOM 302 O LEU A 341 -4.451 -12.237 4.807 1.00 19.08 O ATOM 303 CB LEU A 341 -3.038 -9.523 5.378 1.00 20.22 C ATOM 304 CG LEU A 341 -2.279 -8.455 6.157 1.00 20.72 C ATOM 305 CD1 LEU A 341 -1.200 -7.847 5.233 1.00 22.97 C ATOM 306 CD2 LEU A 341 -3.278 -7.414 6.595 1.00 23.40 C ATOM 307 HA LEU A 341 -4.790 -9.616 6.645 1.00 0.00 H ATOM 308 HB2 LEU A 341 -2.307 -10.244 5.011 1.00 0.00 H ATOM 309 HB3 LEU A 341 -3.519 -9.033 4.532 1.00 0.00 H ATOM 310 HG LEU A 341 -1.783 -8.866 7.036 1.00 0.00 H ATOM 311 HD21 LEU A 341 -3.755 -6.978 5.717 1.00 0.00 H ATOM 312 HD22 LEU A 341 -4.034 -7.881 7.227 1.00 0.00 H ATOM 313 HD23 LEU A 341 -2.765 -6.633 7.157 1.00 0.00 H ATOM 314 HD11 LEU A 341 -0.515 -8.631 4.912 1.00 0.00 H ATOM 315 HD12 LEU A 341 -1.679 -7.402 4.361 1.00 0.00 H ATOM 316 HD13 LEU A 341 -0.648 -7.080 5.777 1.00 0.00 H ATOM 317 H LEU A 341 -2.815 -11.879 6.824 1.00 0.00 H ATOM 318 N ARG A 342 -5.968 -10.608 4.583 1.00 17.78 N ATOM 319 CA ARG A 342 -6.564 -11.233 3.404 1.00 17.69 C ATOM 320 C ARG A 342 -5.614 -11.164 2.188 1.00 16.69 C ATOM 321 O ARG A 342 -5.006 -10.100 1.869 1.00 16.51 O ATOM 322 CB ARG A 342 -7.927 -10.591 3.067 1.00 17.49 C ATOM 323 CG ARG A 342 -8.670 -11.307 1.959 1.00 19.60 C ATOM 324 CD ARG A 342 -9.967 -10.592 1.609 1.00 19.68 C ATOM 325 NE ARG A 342 -10.615 -11.258 0.487 1.00 21.98 N ATOM 326 CZ ARG A 342 -11.388 -10.664 -0.418 1.00 21.93 C ATOM 327 NH1 ARG A 342 -11.658 -9.351 -0.338 1.00 24.12 N ATOM 328 NH2 ARG A 342 -11.921 -11.392 -1.402 1.00 23.02 N ATOM 329 HA ARG A 342 -6.730 -12.284 3.639 1.00 0.00 H ATOM 330 HB2 ARG A 342 -8.547 -10.604 3.964 1.00 0.00 H ATOM 331 HB3 ARG A 342 -7.757 -9.559 2.759 1.00 0.00 H ATOM 332 HG2 ARG A 342 -8.036 -11.346 1.073 1.00 0.00 H ATOM 333 HG3 ARG A 342 -8.900 -12.322 2.284 1.00 0.00 H ATOM 334 HD2 ARG A 342 -9.749 -9.559 1.339 1.00 0.00 H ATOM 335 HD3 ARG A 342 -10.633 -10.608 2.472 1.00 0.00 H ATOM 336 HE ARG A 342 -10.461 -12.281 0.385 1.00 0.00 H ATOM 337 HH12 ARG A 342 -12.264 -8.900 -1.053 1.00 0.00 H ATOM 338 HH11 ARG A 342 -11.261 -8.785 0.439 1.00 0.00 H ATOM 339 HH22 ARG A 342 -12.527 -10.938 -2.115 1.00 0.00 H ATOM 340 HH21 ARG A 342 -11.730 -12.413 -1.455 1.00 0.00 H ATOM 341 H ARG A 342 -6.397 -9.756 4.997 1.00 0.00 H ATOM 342 N LYS A 343 -5.507 -12.279 1.475 1.00 15.63 N ATOM 343 CA LYS A 343 -4.619 -12.327 0.328 1.00 15.30 C ATOM 344 C LYS A 343 -5.148 -11.428 -0.759 1.00 16.00 C ATOM 345 O LYS A 343 -6.364 -11.253 -0.917 1.00 15.69 O ATOM 346 CB LYS A 343 -4.512 -13.748 -0.237 1.00 14.58 C ATOM 347 CG LYS A 343 -3.571 -14.665 0.534 1.00 12.25 C ATOM 348 CD LYS A 343 -3.700 -16.062 -0.058 1.00 9.31 C ATOM 349 CE LYS A 343 -2.599 -16.994 0.539 1.00 10.76 C ATOM 350 NZ LYS A 343 -2.867 -18.417 0.158 1.00 11.12 N ATOM 351 HA LYS A 343 -3.634 -11.999 0.659 1.00 0.00 H ATOM 352 HB2 LYS A 343 -5.506 -14.194 -0.227 1.00 0.00 H ATOM 353 HB3 LYS A 343 -4.155 -13.680 -1.265 1.00 0.00 H ATOM 354 HG2 LYS A 343 -2.544 -14.313 0.435 1.00 0.00 H ATOM 355 HG3 LYS A 343 -3.848 -14.681 1.588 1.00 0.00 H ATOM 356 HD2 LYS A 343 -4.684 -16.466 0.179 1.00 0.00 H ATOM 357 HD3 LYS A 343 -3.582 -16.009 -1.140 1.00 0.00 H ATOM 358 HE2 LYS A 343 -2.601 -16.905 1.625 1.00 0.00 H ATOM 359 HE3 LYS A 343 -1.625 -16.695 0.153 1.00 0.00 H ATOM 360 HZ1 LYS A 343 -3.796 -18.705 0.528 1.00 0.00 H ATOM 361 HZ2 LYS A 343 -2.863 -18.504 -0.878 1.00 0.00 H ATOM 362 HZ3 LYS A 343 -2.128 -19.028 0.561 1.00 0.00 H ATOM 363 H LYS A 343 -6.060 -13.119 1.739 1.00 0.00 H ATOM 364 N ASN A 344 -4.218 -10.876 -1.524 1.00 16.35 N ATOM 365 CA ASN A 344 -4.522 -10.095 -2.692 1.00 17.07 C ATOM 366 C ASN A 344 -3.383 -10.316 -3.686 1.00 17.04 C ATOM 367 O ASN A 344 -2.404 -9.535 -3.746 1.00 17.15 O ATOM 368 CB ASN A 344 -4.679 -8.630 -2.305 1.00 19.16 C ATOM 369 CG ASN A 344 -5.049 -7.736 -3.500 1.00 22.57 C ATOM 370 OD1 ASN A 344 -5.461 -8.204 -4.572 1.00 25.57 O ATOM 371 ND2 ASN A 344 -4.880 -6.436 -3.314 1.00 27.19 N ATOM 372 HA ASN A 344 -5.464 -10.397 -3.151 1.00 0.00 H ATOM 373 HB2 ASN A 344 -5.464 -8.550 -1.553 1.00 0.00 H ATOM 374 HB3 ASN A 344 -3.737 -8.278 -1.884 1.00 0.00 H ATOM 375 HD22 ASN A 344 -4.532 -6.082 -2.400 1.00 0.00 H ATOM 376 HD21 ASN A 344 -5.095 -5.769 -4.082 1.00 0.00 H ATOM 377 H ASN A 344 -3.220 -11.014 -1.267 1.00 0.00 H ATOM 378 N TRP A 345 -3.468 -11.424 -4.412 1.00 16.18 N ATOM 379 CA TRP A 345 -2.420 -11.792 -5.348 1.00 16.04 C ATOM 380 C TRP A 345 -2.404 -10.840 -6.520 1.00 16.85 C ATOM 381 O TRP A 345 -3.464 -10.455 -7.032 1.00 17.13 O ATOM 382 CB TRP A 345 -2.650 -13.178 -5.929 1.00 14.67 C ATOM 383 CG TRP A 345 -2.295 -14.348 -5.091 1.00 13.62 C ATOM 384 CD1 TRP A 345 -3.165 -15.236 -4.519 1.00 10.59 C ATOM 385 CD2 TRP A 345 -0.967 -14.871 -4.860 1.00 12.17 C ATOM 386 NE1 TRP A 345 -2.454 -16.258 -3.873 1.00 13.78 N ATOM 387 CE2 TRP A 345 -1.110 -16.067 -4.094 1.00 12.14 C ATOM 388 CE3 TRP A 345 0.321 -14.465 -5.256 1.00 11.75 C ATOM 389 CZ2 TRP A 345 -0.002 -16.840 -3.689 1.00 12.65 C ATOM 390 CZ3 TRP A 345 1.415 -15.235 -4.855 1.00 9.96 C ATOM 391 CH2 TRP A 345 1.245 -16.408 -4.073 1.00 9.07 C ATOM 392 HA TRP A 345 -1.484 -11.762 -4.790 1.00 0.00 H ATOM 393 HB2 TRP A 345 -3.711 -13.259 -6.167 1.00 0.00 H ATOM 394 HB3 TRP A 345 -2.066 -13.247 -6.847 1.00 0.00 H ATOM 395 HE1 TRP A 345 -2.873 -17.032 -3.319 1.00 0.00 H ATOM 396 HD1 TRP A 345 -4.252 -15.160 -4.559 1.00 0.00 H ATOM 397 HZ2 TRP A 345 -0.130 -17.745 -3.095 1.00 0.00 H ATOM 398 HH2 TRP A 345 2.123 -16.979 -3.770 1.00 0.00 H ATOM 399 HZ3 TRP A 345 2.419 -14.929 -5.148 1.00 0.00 H ATOM 400 HE3 TRP A 345 0.462 -13.570 -5.862 1.00 0.00 H ATOM 401 H TRP A 345 -4.300 -12.040 -4.309 1.00 0.00 H ATOM 402 N GLY A 346 -1.211 -10.496 -6.976 1.00 16.51 N ATOM 403 CA GLY A 346 -1.066 -9.657 -8.173 1.00 17.36 C ATOM 404 C GLY A 346 0.374 -9.668 -8.626 1.00 18.33 C ATOM 405 O GLY A 346 1.257 -10.028 -7.840 1.00 16.78 O ATOM 406 HA3 GLY A 346 -1.365 -8.635 -7.939 1.00 0.00 H ATOM 407 HA2 GLY A 346 -1.700 -10.047 -8.969 1.00 0.00 H ATOM 408 H GLY A 346 -0.360 -10.826 -6.478 1.00 0.00 H ATOM 409 N PRO A 347 0.628 -9.287 -9.893 1.00 18.60 N ATOM 410 CA PRO A 347 2.005 -9.186 -10.379 1.00 18.73 C ATOM 411 C PRO A 347 2.711 -8.000 -9.755 1.00 18.32 C ATOM 412 O PRO A 347 2.077 -6.985 -9.447 1.00 18.75 O ATOM 413 CB PRO A 347 1.852 -8.969 -11.897 1.00 19.42 C ATOM 414 CG PRO A 347 0.522 -8.285 -12.047 1.00 19.42 C ATOM 415 CD PRO A 347 -0.355 -8.922 -10.939 1.00 19.86 C ATOM 416 HA PRO A 347 2.597 -10.067 -10.131 1.00 0.00 H ATOM 417 HD3 PRO A 347 -1.084 -8.206 -10.558 1.00 0.00 H ATOM 418 HD2 PRO A 347 -0.875 -9.805 -11.311 1.00 0.00 H ATOM 419 HG3 PRO A 347 0.098 -8.474 -13.033 1.00 0.00 H ATOM 420 HG2 PRO A 347 0.619 -7.210 -11.894 1.00 0.00 H ATOM 421 HB2 PRO A 347 2.655 -8.339 -12.279 1.00 0.00 H ATOM 422 HB3 PRO A 347 1.857 -9.922 -12.425 1.00 0.00 H ATOM 423 N SER A 348 4.006 -8.175 -9.547 1.00 16.72 N ATOM 424 CA SER A 348 4.883 -7.171 -8.953 1.00 16.32 C ATOM 425 C SER A 348 6.248 -7.241 -9.637 1.00 15.24 C ATOM 426 O SER A 348 6.759 -8.344 -9.923 1.00 14.77 O ATOM 427 CB SER A 348 5.044 -7.470 -7.456 1.00 17.76 C ATOM 428 OG SER A 348 5.758 -6.440 -6.826 1.00 21.03 O ATOM 429 HA SER A 348 4.457 -6.176 -9.082 1.00 0.00 H ATOM 430 HB2 SER A 348 5.584 -8.409 -7.333 1.00 0.00 H ATOM 431 HB3 SER A 348 4.058 -7.556 -6.999 1.00 0.00 H ATOM 432 HG SER A 348 5.853 -6.647 -5.863 1.00 0.00 H ATOM 433 H SER A 348 4.425 -9.085 -9.824 1.00 0.00 H ATOM 434 N TRP A 349 6.849 -6.080 -9.906 1.00 14.78 N ATOM 435 CA TRP A 349 8.244 -6.065 -10.339 1.00 14.88 C ATOM 436 C TRP A 349 9.106 -6.154 -9.045 1.00 14.91 C ATOM 437 O TRP A 349 9.016 -5.304 -8.160 1.00 16.96 O ATOM 438 CB TRP A 349 8.540 -4.801 -11.141 1.00 15.15 C ATOM 439 CG TRP A 349 10.001 -4.630 -11.488 1.00 15.27 C ATOM 440 CD1 TRP A 349 10.888 -3.744 -10.917 1.00 16.82 C ATOM 441 CD2 TRP A 349 10.739 -5.359 -12.481 1.00 16.20 C ATOM 442 NE1 TRP A 349 12.123 -3.876 -11.501 1.00 17.82 N ATOM 443 CE2 TRP A 349 12.066 -4.865 -12.460 1.00 17.76 C ATOM 444 CE3 TRP A 349 10.407 -6.385 -13.388 1.00 14.17 C ATOM 445 CZ2 TRP A 349 13.052 -5.349 -13.311 1.00 17.64 C ATOM 446 CZ3 TRP A 349 11.376 -6.870 -14.218 1.00 14.61 C ATOM 447 CH2 TRP A 349 12.692 -6.360 -14.193 1.00 17.21 C ATOM 448 HA TRP A 349 8.472 -6.901 -11.000 1.00 0.00 H ATOM 449 HB2 TRP A 349 7.968 -4.839 -12.068 1.00 0.00 H ATOM 450 HB3 TRP A 349 8.222 -3.939 -10.555 1.00 0.00 H ATOM 451 HE1 TRP A 349 12.967 -3.319 -11.259 1.00 0.00 H ATOM 452 HD1 TRP A 349 10.645 -3.042 -10.119 1.00 0.00 H ATOM 453 HZ2 TRP A 349 14.067 -4.952 -13.287 1.00 0.00 H ATOM 454 HH2 TRP A 349 13.438 -6.766 -14.877 1.00 0.00 H ATOM 455 HZ3 TRP A 349 11.128 -7.669 -14.916 1.00 0.00 H ATOM 456 HE3 TRP A 349 9.394 -6.785 -13.426 1.00 0.00 H ATOM 457 H TRP A 349 6.325 -5.187 -9.807 1.00 0.00 H ATOM 458 N VAL A 350 9.883 -7.223 -8.919 1.00 15.07 N ATOM 459 CA VAL A 350 10.552 -7.537 -7.669 1.00 13.78 C ATOM 460 C VAL A 350 12.040 -7.325 -7.865 1.00 13.43 C ATOM 461 O VAL A 350 12.615 -7.770 -8.841 1.00 13.84 O ATOM 462 CB VAL A 350 10.246 -8.981 -7.230 1.00 15.50 C ATOM 463 CG1 VAL A 350 10.992 -9.326 -5.964 1.00 14.87 C ATOM 464 CG2 VAL A 350 8.729 -9.160 -7.052 1.00 15.10 C ATOM 465 HA VAL A 350 10.190 -6.883 -6.876 1.00 0.00 H ATOM 466 HB VAL A 350 10.586 -9.668 -8.005 1.00 0.00 H ATOM 467 HG11 VAL A 350 12.064 -9.231 -6.138 1.00 0.00 H ATOM 468 HG12 VAL A 350 10.690 -8.645 -5.169 1.00 0.00 H ATOM 469 HG13 VAL A 350 10.759 -10.351 -5.674 1.00 0.00 H ATOM 470 HG21 VAL A 350 8.369 -8.467 -6.291 1.00 0.00 H ATOM 471 HG22 VAL A 350 8.227 -8.956 -7.998 1.00 0.00 H ATOM 472 HG23 VAL A 350 8.519 -10.184 -6.741 1.00 0.00 H ATOM 473 H VAL A 350 10.016 -7.852 -9.737 1.00 0.00 H ATOM 474 N VAL A 351 12.643 -6.614 -6.921 1.00 12.14 N ATOM 475 CA VAL A 351 14.077 -6.316 -6.964 1.00 12.72 C ATOM 476 C VAL A 351 14.732 -6.840 -5.688 1.00 13.21 C ATOM 477 O VAL A 351 14.407 -6.396 -4.568 1.00 12.50 O ATOM 478 CB VAL A 351 14.301 -4.766 -7.166 1.00 12.02 C ATOM 479 CG1 VAL A 351 15.737 -4.405 -7.049 1.00 14.27 C ATOM 480 CG2 VAL A 351 13.736 -4.333 -8.550 1.00 13.19 C ATOM 481 HA VAL A 351 14.546 -6.816 -7.811 1.00 0.00 H ATOM 482 HB VAL A 351 13.768 -4.234 -6.378 1.00 0.00 H ATOM 483 HG11 VAL A 351 16.100 -4.681 -6.059 1.00 0.00 H ATOM 484 HG12 VAL A 351 16.308 -4.939 -7.809 1.00 0.00 H ATOM 485 HG13 VAL A 351 15.853 -3.331 -7.194 1.00 0.00 H ATOM 486 HG21 VAL A 351 14.252 -4.880 -9.339 1.00 0.00 H ATOM 487 HG22 VAL A 351 12.669 -4.554 -8.591 1.00 0.00 H ATOM 488 HG23 VAL A 351 13.892 -3.263 -8.686 1.00 0.00 H ATOM 489 H VAL A 351 12.079 -6.256 -6.124 1.00 0.00 H ATOM 490 N LEU A 352 15.664 -7.791 -5.873 1.00 13.41 N ATOM 491 CA LEU A 352 16.476 -8.328 -4.775 1.00 14.08 C ATOM 492 C LEU A 352 17.834 -7.600 -4.758 1.00 15.05 C ATOM 493 O LEU A 352 18.575 -7.671 -5.722 1.00 14.47 O ATOM 494 CB LEU A 352 16.711 -9.837 -4.945 1.00 13.97 C ATOM 495 CG LEU A 352 17.632 -10.573 -3.951 1.00 13.46 C ATOM 496 CD1 LEU A 352 17.140 -10.442 -2.500 1.00 11.63 C ATOM 497 CD2 LEU A 352 17.840 -12.083 -4.278 1.00 14.89 C ATOM 498 HA LEU A 352 15.944 -8.169 -3.837 1.00 0.00 H ATOM 499 HB2 LEU A 352 15.735 -10.319 -4.892 1.00 0.00 H ATOM 500 HB3 LEU A 352 17.134 -9.984 -5.939 1.00 0.00 H ATOM 501 HG LEU A 352 18.595 -10.074 -4.061 1.00 0.00 H ATOM 502 HD21 LEU A 352 16.877 -12.593 -4.263 1.00 0.00 H ATOM 503 HD22 LEU A 352 18.289 -12.181 -5.266 1.00 0.00 H ATOM 504 HD23 LEU A 352 18.499 -12.527 -3.532 1.00 0.00 H ATOM 505 HD11 LEU A 352 17.112 -9.389 -2.221 1.00 0.00 H ATOM 506 HD12 LEU A 352 16.140 -10.868 -2.417 1.00 0.00 H ATOM 507 HD13 LEU A 352 17.821 -10.976 -1.837 1.00 0.00 H ATOM 508 H LEU A 352 15.816 -8.161 -6.833 1.00 0.00 H ATOM 509 N THR A 353 18.138 -6.927 -3.649 1.00 15.39 N ATOM 510 CA THR A 353 19.433 -6.268 -3.493 1.00 17.43 C ATOM 511 C THR A 353 20.254 -7.134 -2.556 1.00 17.69 C ATOM 512 O THR A 353 19.816 -8.198 -2.161 1.00 18.49 O ATOM 513 CB THR A 353 19.281 -4.828 -2.897 1.00 16.69 C ATOM 514 OG1 THR A 353 18.895 -4.923 -1.526 1.00 18.56 O ATOM 515 CG2 THR A 353 18.256 -4.045 -3.664 1.00 18.50 C ATOM 516 HA THR A 353 19.915 -6.157 -4.464 1.00 0.00 H ATOM 517 HB THR A 353 20.237 -4.310 -2.974 1.00 0.00 H ATOM 518 HG1 THR A 353 18.798 -4.013 -1.148 1.00 0.00 H ATOM 519 HG23 THR A 353 18.559 -3.978 -4.709 1.00 0.00 H ATOM 520 HG21 THR A 353 17.291 -4.547 -3.596 1.00 0.00 H ATOM 521 HG22 THR A 353 18.176 -3.043 -3.242 1.00 0.00 H ATOM 522 H THR A 353 17.440 -6.870 -2.880 1.00 0.00 H ATOM 523 N GLY A 354 21.431 -6.658 -2.142 1.00 18.29 N ATOM 524 CA GLY A 354 22.212 -7.381 -1.166 1.00 17.47 C ATOM 525 C GLY A 354 21.642 -7.403 0.230 1.00 17.82 C ATOM 526 O GLY A 354 22.086 -8.194 1.070 1.00 17.82 O ATOM 527 HA3 GLY A 354 23.200 -6.923 -1.119 1.00 0.00 H ATOM 528 HA2 GLY A 354 22.307 -8.412 -1.507 1.00 0.00 H ATOM 529 H GLY A 354 21.788 -5.760 -2.525 1.00 0.00 H ATOM 530 N ASN A 355 20.633 -6.584 0.525 1.00 17.77 N ATOM 531 CA ASN A 355 19.977 -6.834 1.807 1.00 19.45 C ATOM 532 C ASN A 355 18.482 -6.629 1.952 1.00 17.64 C ATOM 533 O ASN A 355 17.962 -6.703 3.068 1.00 17.74 O ATOM 534 CB ASN A 355 20.675 -6.135 2.939 1.00 21.67 C ATOM 535 CG ASN A 355 20.834 -4.724 2.681 1.00 24.56 C ATOM 536 OD1 ASN A 355 19.911 -4.071 2.213 1.00 28.58 O ATOM 537 ND2 ASN A 355 22.044 -4.222 2.909 1.00 31.90 N ATOM 538 HA ASN A 355 20.079 -7.918 1.846 1.00 0.00 H ATOM 539 HB2 ASN A 355 20.089 -6.264 3.849 1.00 0.00 H ATOM 540 HB3 ASN A 355 21.660 -6.582 3.077 1.00 0.00 H ATOM 541 HD22 ASN A 355 22.791 -4.826 3.309 1.00 0.00 H ATOM 542 HD21 ASN A 355 22.244 -3.226 2.687 1.00 0.00 H ATOM 543 H ASN A 355 20.333 -5.820 -0.113 1.00 0.00 H ATOM 544 N SER A 356 17.792 -6.418 0.845 1.00 17.42 N ATOM 545 CA SER A 356 16.356 -6.177 0.917 1.00 17.44 C ATOM 546 C SER A 356 15.642 -6.721 -0.314 1.00 16.45 C ATOM 547 O SER A 356 16.265 -7.002 -1.345 1.00 15.47 O ATOM 548 CB SER A 356 16.098 -4.684 1.085 1.00 18.10 C ATOM 549 OG SER A 356 16.459 -4.037 -0.108 1.00 24.36 O ATOM 550 HA SER A 356 15.954 -6.706 1.781 1.00 0.00 H ATOM 551 HB2 SER A 356 16.696 -4.297 1.910 1.00 0.00 H ATOM 552 HB3 SER A 356 15.042 -4.513 1.292 1.00 0.00 H ATOM 553 HG SER A 356 17.418 -4.198 -0.292 1.00 0.00 H ATOM 554 H SER A 356 18.273 -6.424 -0.077 1.00 0.00 H ATOM 555 N LEU A 357 14.331 -6.872 -0.202 1.00 14.34 N ATOM 556 CA LEU A 357 13.515 -7.235 -1.354 1.00 13.53 C ATOM 557 C LEU A 357 12.554 -6.082 -1.521 1.00 13.29 C ATOM 558 O LEU A 357 11.918 -5.662 -0.538 1.00 14.46 O ATOM 559 CB LEU A 357 12.779 -8.554 -1.074 1.00 13.70 C ATOM 560 CG LEU A 357 12.003 -9.251 -2.184 1.00 15.19 C ATOM 561 CD1 LEU A 357 12.932 -9.688 -3.333 1.00 13.92 C ATOM 562 CD2 LEU A 357 11.261 -10.469 -1.557 1.00 14.66 C ATOM 563 HA LEU A 357 14.099 -7.397 -2.260 1.00 0.00 H ATOM 564 HB2 LEU A 357 13.529 -9.263 -0.723 1.00 0.00 H ATOM 565 HB3 LEU A 357 12.068 -8.352 -0.273 1.00 0.00 H ATOM 566 HG LEU A 357 11.281 -8.561 -2.621 1.00 0.00 H ATOM 567 HD21 LEU A 357 11.990 -11.151 -1.120 1.00 0.00 H ATOM 568 HD22 LEU A 357 10.579 -10.118 -0.782 1.00 0.00 H ATOM 569 HD23 LEU A 357 10.696 -10.987 -2.332 1.00 0.00 H ATOM 570 HD11 LEU A 357 13.425 -8.811 -3.753 1.00 0.00 H ATOM 571 HD12 LEU A 357 13.682 -10.379 -2.949 1.00 0.00 H ATOM 572 HD13 LEU A 357 12.344 -10.182 -4.107 1.00 0.00 H ATOM 573 H LEU A 357 13.877 -6.729 0.723 1.00 0.00 H ATOM 574 N VAL A 358 12.501 -5.556 -2.741 1.00 14.23 N ATOM 575 CA VAL A 358 11.832 -4.300 -3.021 1.00 14.38 C ATOM 576 C VAL A 358 10.755 -4.595 -4.062 1.00 14.59 C ATOM 577 O VAL A 358 11.005 -5.296 -5.047 1.00 14.70 O ATOM 578 CB VAL A 358 12.842 -3.216 -3.503 1.00 15.36 C ATOM 579 CG1 VAL A 358 12.145 -1.905 -3.676 1.00 18.18 C ATOM 580 CG2 VAL A 358 13.954 -3.034 -2.496 1.00 14.71 C ATOM 581 HA VAL A 358 11.376 -3.890 -2.120 1.00 0.00 H ATOM 582 HB VAL A 358 13.260 -3.549 -4.453 1.00 0.00 H ATOM 583 HG11 VAL A 358 11.353 -2.011 -4.417 1.00 0.00 H ATOM 584 HG12 VAL A 358 11.714 -1.595 -2.724 1.00 0.00 H ATOM 585 HG13 VAL A 358 12.861 -1.156 -4.013 1.00 0.00 H ATOM 586 HG21 VAL A 358 13.531 -2.721 -1.542 1.00 0.00 H ATOM 587 HG22 VAL A 358 14.484 -3.978 -2.368 1.00 0.00 H ATOM 588 HG23 VAL A 358 14.646 -2.272 -2.855 1.00 0.00 H ATOM 589 H VAL A 358 12.957 -6.065 -3.525 1.00 0.00 H ATOM 590 N PHE A 359 9.543 -4.080 -3.829 1.00 14.74 N ATOM 591 CA PHE A 359 8.417 -4.346 -4.736 1.00 16.01 C ATOM 592 C PHE A 359 8.014 -3.056 -5.389 1.00 16.95 C ATOM 593 O PHE A 359 7.832 -2.044 -4.717 1.00 16.68 O ATOM 594 CB PHE A 359 7.235 -4.890 -3.950 1.00 16.41 C ATOM 595 CG PHE A 359 7.538 -6.183 -3.226 1.00 16.79 C ATOM 596 CD1 PHE A 359 7.839 -6.183 -1.876 1.00 20.48 C ATOM 597 CD2 PHE A 359 7.541 -7.384 -3.912 1.00 16.08 C ATOM 598 CE1 PHE A 359 8.138 -7.357 -1.226 1.00 21.92 C ATOM 599 CE2 PHE A 359 7.842 -8.555 -3.258 1.00 19.37 C ATOM 600 CZ PHE A 359 8.140 -8.535 -1.928 1.00 17.31 C ATOM 601 HA PHE A 359 8.717 -5.078 -5.486 1.00 0.00 H ATOM 602 HB2 PHE A 359 6.936 -4.144 -3.214 1.00 0.00 H ATOM 603 HB3 PHE A 359 6.411 -5.066 -4.642 1.00 0.00 H ATOM 604 HD2 PHE A 359 7.304 -7.402 -4.976 1.00 0.00 H ATOM 605 HE2 PHE A 359 7.842 -9.499 -3.803 1.00 0.00 H ATOM 606 HZ PHE A 359 8.383 -9.466 -1.416 1.00 0.00 H ATOM 607 HE1 PHE A 359 8.372 -7.351 -0.161 1.00 0.00 H ATOM 608 HD1 PHE A 359 7.839 -5.244 -1.323 1.00 0.00 H ATOM 609 H PHE A 359 9.394 -3.481 -2.992 1.00 0.00 H ATOM 610 N TYR A 360 7.870 -3.111 -6.699 1.00 18.48 N ATOM 611 CA TYR A 360 7.355 -2.006 -7.484 1.00 20.39 C ATOM 612 C TYR A 360 6.127 -2.456 -8.252 1.00 23.13 C ATOM 613 O TYR A 360 6.001 -3.624 -8.610 1.00 22.00 O ATOM 614 CB TYR A 360 8.377 -1.615 -8.525 1.00 19.59 C ATOM 615 CG TYR A 360 9.679 -1.084 -8.005 1.00 18.73 C ATOM 616 CD1 TYR A 360 10.672 -1.948 -7.548 1.00 16.31 C ATOM 617 CD2 TYR A 360 9.946 0.289 -8.044 1.00 18.89 C ATOM 618 CE1 TYR A 360 11.903 -1.448 -7.095 1.00 16.34 C ATOM 619 CE2 TYR A 360 11.149 0.792 -7.615 1.00 20.11 C ATOM 620 CZ TYR A 360 12.134 -0.080 -7.146 1.00 21.03 C ATOM 621 OH TYR A 360 13.346 0.448 -6.715 1.00 22.92 O ATOM 622 HA TYR A 360 7.126 -1.181 -6.809 1.00 0.00 H ATOM 623 HB3 TYR A 360 7.932 -0.846 -9.157 1.00 0.00 H ATOM 624 HB2 TYR A 360 8.594 -2.497 -9.127 1.00 0.00 H ATOM 625 HD2 TYR A 360 9.185 0.972 -8.422 1.00 0.00 H ATOM 626 HE2 TYR A 360 11.334 1.866 -7.640 1.00 0.00 H ATOM 627 HE1 TYR A 360 12.666 -2.124 -6.709 1.00 0.00 H ATOM 628 HD1 TYR A 360 10.491 -3.023 -7.542 1.00 0.00 H ATOM 629 HH TYR A 360 13.937 -0.287 -6.414 1.00 0.00 H ATOM 630 H TYR A 360 8.138 -3.987 -7.191 1.00 0.00 H ATOM 631 N ARG A 361 5.230 -1.523 -8.553 1.00 27.06 N ATOM 632 CA ARG A 361 4.169 -1.802 -9.530 1.00 30.86 C ATOM 633 C ARG A 361 4.725 -2.175 -10.926 1.00 33.03 C ATOM 634 O ARG A 361 4.142 -3.035 -11.602 1.00 34.52 O ATOM 635 CB ARG A 361 3.160 -0.641 -9.611 1.00 30.79 C ATOM 636 HA ARG A 361 3.636 -2.681 -9.168 1.00 0.00 H ATOM 637 HB2 ARG A 361 2.701 -0.492 -8.634 1.00 0.00 H ATOM 638 HB3 ARG A 361 3.679 0.269 -9.913 1.00 0.00 H ATOM 639 H ARG A 361 5.279 -0.591 -8.095 1.00 0.00 H ATOM 640 N GLU A 362 5.863 -1.583 -11.334 1.00 35.78 N ATOM 641 CA GLU A 362 6.458 -1.788 -12.689 1.00 38.09 C ATOM 642 C GLU A 362 7.992 -1.553 -12.775 1.00 38.64 C ATOM 643 O GLU A 362 8.561 -0.914 -11.899 1.00 38.85 O ATOM 644 CB GLU A 362 5.739 -0.885 -13.705 1.00 39.32 C ATOM 645 CG GLU A 362 4.311 -0.501 -13.278 1.00 43.10 C ATOM 646 CD GLU A 362 3.534 0.217 -14.356 1.00 49.59 C ATOM 647 OE1 GLU A 362 3.977 1.317 -14.786 1.00 51.72 O ATOM 648 OE2 GLU A 362 2.474 -0.325 -14.760 1.00 52.09 O ATOM 649 HA GLU A 362 6.312 -2.843 -12.919 1.00 0.00 H ATOM 650 HB2 GLU A 362 6.321 0.029 -13.828 1.00 0.00 H ATOM 651 HB3 GLU A 362 5.685 -1.411 -14.658 1.00 0.00 H ATOM 652 HG2 GLU A 362 3.773 -1.411 -13.012 1.00 0.00 H ATOM 653 HG3 GLU A 362 4.374 0.150 -12.406 1.00 0.00 H ATOM 654 H GLU A 362 6.354 -0.950 -10.671 1.00 0.00 H ATOM 655 N PRO A 363 8.672 -2.071 -13.836 1.00 39.46 N ATOM 656 CA PRO A 363 10.150 -1.937 -13.966 1.00 39.82 C ATOM 657 C PRO A 363 10.717 -0.502 -13.877 1.00 40.73 C ATOM 658 O PRO A 363 10.799 0.213 -14.888 1.00 41.35 O ATOM 659 CB PRO A 363 10.454 -2.555 -15.342 1.00 39.92 C ATOM 660 CG PRO A 363 9.297 -3.421 -15.638 1.00 39.11 C ATOM 661 CD PRO A 363 8.098 -2.835 -14.961 1.00 39.32 C ATOM 662 HA PRO A 363 10.632 -2.429 -13.121 1.00 0.00 H ATOM 663 HD3 PRO A 363 7.550 -2.179 -15.638 1.00 0.00 H ATOM 664 HD2 PRO A 363 7.433 -3.619 -14.600 1.00 0.00 H ATOM 665 HG3 PRO A 363 9.481 -4.427 -15.261 1.00 0.00 H ATOM 666 HG2 PRO A 363 9.131 -3.463 -16.715 1.00 0.00 H ATOM 667 HB2 PRO A 363 10.553 -1.776 -16.098 1.00 0.00 H ATOM 668 HB3 PRO A 363 11.372 -3.142 -15.304 1.00 0.00 H TER 669 PRO A 363 ATOM 670 N ARG A 378 9.130 5.012 -7.672 1.00 33.37 N ATOM 671 CA ARG A 378 9.319 4.695 -6.241 1.00 32.70 C ATOM 672 C ARG A 378 8.608 3.408 -5.824 1.00 31.82 C ATOM 673 O ARG A 378 7.469 3.172 -6.244 1.00 31.14 O ATOM 674 CB ARG A 378 8.925 5.875 -5.328 1.00 33.25 C ATOM 675 CG ARG A 378 10.143 6.674 -4.889 1.00 34.63 C ATOM 676 CD ARG A 378 9.826 8.094 -4.446 1.00 34.98 C ATOM 677 NE ARG A 378 9.155 8.141 -3.158 1.00 34.05 N ATOM 678 CZ ARG A 378 8.708 9.264 -2.591 1.00 31.18 C ATOM 679 NH1 ARG A 378 8.889 10.439 -3.180 1.00 28.04 N ATOM 680 NH2 ARG A 378 8.111 9.205 -1.420 1.00 27.90 N ATOM 681 HA ARG A 378 10.387 4.522 -6.110 1.00 0.00 H ATOM 682 HB2 ARG A 378 8.247 6.533 -5.872 1.00 0.00 H ATOM 683 HB3 ARG A 378 8.420 5.486 -4.444 1.00 0.00 H ATOM 684 HG2 ARG A 378 10.613 6.152 -4.056 1.00 0.00 H ATOM 685 HG3 ARG A 378 10.840 6.723 -5.725 1.00 0.00 H ATOM 686 HD2 ARG A 378 9.181 8.557 -5.193 1.00 0.00 H ATOM 687 HD3 ARG A 378 10.758 8.654 -4.375 1.00 0.00 H ATOM 688 HE ARG A 378 9.015 7.246 -2.647 1.00 0.00 H ATOM 689 HH12 ARG A 378 8.536 11.307 -2.728 1.00 0.00 H ATOM 690 HH11 ARG A 378 9.384 10.492 -4.093 1.00 0.00 H ATOM 691 HH22 ARG A 378 7.760 10.075 -0.971 1.00 0.00 H ATOM 692 HH21 ARG A 378 7.990 8.289 -0.943 1.00 0.00 H ATOM 693 HN3 ARG A 378 8.116 5.129 -7.869 1.00 0.00 H ATOM 694 HN2 ARG A 378 9.509 4.236 -8.251 1.00 0.00 H ATOM 695 HN1 ARG A 378 9.633 5.893 -7.900 1.00 0.00 H ATOM 696 N PRO A 379 9.294 2.559 -5.014 1.00 31.13 N ATOM 697 CA PRO A 379 8.765 1.264 -4.552 1.00 30.53 C ATOM 698 C PRO A 379 7.422 1.366 -3.862 1.00 30.42 C ATOM 699 O PRO A 379 7.210 2.308 -3.100 1.00 30.17 O ATOM 700 CB PRO A 379 9.788 0.821 -3.503 1.00 30.52 C ATOM 701 CG PRO A 379 11.031 1.496 -3.875 1.00 30.44 C ATOM 702 CD PRO A 379 10.665 2.796 -4.512 1.00 30.34 C ATOM 703 HA PRO A 379 8.622 0.592 -5.398 1.00 0.00 H ATOM 704 HD3 PRO A 379 10.679 3.606 -3.782 1.00 0.00 H ATOM 705 HD2 PRO A 379 11.344 3.034 -5.330 1.00 0.00 H ATOM 706 HG3 PRO A 379 11.592 0.881 -4.579 1.00 0.00 H ATOM 707 HG2 PRO A 379 11.638 1.674 -2.987 1.00 0.00 H ATOM 708 HB2 PRO A 379 9.470 1.125 -2.506 1.00 0.00 H ATOM 709 HB3 PRO A 379 9.918 -0.261 -3.527 1.00 0.00 H ATOM 710 N GLU A 380 6.535 0.402 -4.110 1.00 29.78 N ATOM 711 CA GLU A 380 5.328 0.239 -3.292 1.00 30.76 C ATOM 712 C GLU A 380 5.742 -0.086 -1.844 1.00 29.79 C ATOM 713 O GLU A 380 5.212 0.505 -0.883 1.00 29.63 O ATOM 714 CB GLU A 380 4.324 -0.792 -3.899 1.00 31.66 C ATOM 715 CG GLU A 380 4.692 -2.332 -3.837 1.00 37.07 C ATOM 716 CD GLU A 380 3.523 -3.318 -4.263 1.00 42.70 C ATOM 717 OE1 GLU A 380 3.731 -4.215 -5.150 1.00 41.85 O ATOM 718 OE2 GLU A 380 2.397 -3.192 -3.709 1.00 46.06 O ATOM 719 HA GLU A 380 4.774 1.178 -3.284 1.00 0.00 H ATOM 720 HB2 GLU A 380 3.377 -0.666 -3.375 1.00 0.00 H ATOM 721 HB3 GLU A 380 4.194 -0.534 -4.950 1.00 0.00 H ATOM 722 HG2 GLU A 380 5.539 -2.505 -4.501 1.00 0.00 H ATOM 723 HG3 GLU A 380 4.980 -2.570 -2.813 1.00 0.00 H ATOM 724 H GLU A 380 6.703 -0.250 -4.903 1.00 0.00 H ATOM 725 N SER A 381 6.722 -0.984 -1.705 1.00 27.91 N ATOM 726 CA SER A 381 7.222 -1.436 -0.401 1.00 27.30 C ATOM 727 C SER A 381 8.614 -2.084 -0.492 1.00 26.05 C ATOM 728 O SER A 381 9.083 -2.411 -1.559 1.00 23.87 O ATOM 729 CB SER A 381 6.254 -2.422 0.241 1.00 27.43 C ATOM 730 OG SER A 381 6.283 -3.635 -0.456 1.00 30.17 O ATOM 731 HA SER A 381 7.305 -0.542 0.217 1.00 0.00 H ATOM 732 HB2 SER A 381 5.245 -2.011 0.211 1.00 0.00 H ATOM 733 HB3 SER A 381 6.545 -2.593 1.278 1.00 0.00 H ATOM 734 HG SER A 381 5.653 -4.271 -0.035 1.00 0.00 H ATOM 735 H SER A 381 7.152 -1.383 -2.564 1.00 0.00 H ATOM 736 N SER A 382 9.263 -2.222 0.655 1.00 25.79 N ATOM 737 CA SER A 382 10.623 -2.760 0.769 1.00 25.68 C ATOM 738 C SER A 382 10.688 -3.529 2.073 1.00 25.23 C ATOM 739 O SER A 382 10.060 -3.112 3.052 1.00 26.05 O ATOM 740 CB SER A 382 11.608 -1.593 0.848 1.00 25.50 C ATOM 741 OG SER A 382 12.929 -2.077 0.948 1.00 29.33 O ATOM 742 HA SER A 382 10.868 -3.395 -0.082 1.00 0.00 H ATOM 743 HB2 SER A 382 11.379 -0.987 1.724 1.00 0.00 H ATOM 744 HB3 SER A 382 11.515 -0.982 -0.050 1.00 0.00 H ATOM 745 HG SER A 382 13.556 -1.313 0.998 1.00 0.00 H ATOM 746 H SER A 382 8.778 -1.931 1.528 1.00 0.00 H ATOM 747 N VAL A 383 11.420 -4.640 2.117 1.00 23.19 N ATOM 748 CA VAL A 383 11.653 -5.323 3.403 1.00 22.67 C ATOM 749 C VAL A 383 13.131 -5.689 3.536 1.00 21.32 C ATOM 750 O VAL A 383 13.726 -6.111 2.558 1.00 19.59 O ATOM 751 CB VAL A 383 10.756 -6.584 3.634 1.00 22.33 C ATOM 752 CG1 VAL A 383 9.262 -6.230 3.551 1.00 25.43 C ATOM 753 CG2 VAL A 383 11.084 -7.680 2.651 1.00 22.28 C ATOM 754 HA VAL A 383 11.366 -4.614 4.179 1.00 0.00 H ATOM 755 HB VAL A 383 10.969 -6.949 4.639 1.00 0.00 H ATOM 756 HG11 VAL A 383 9.023 -5.489 4.314 1.00 0.00 H ATOM 757 HG12 VAL A 383 9.041 -5.822 2.565 1.00 0.00 H ATOM 758 HG13 VAL A 383 8.667 -7.128 3.716 1.00 0.00 H ATOM 759 HG21 VAL A 383 10.918 -7.318 1.636 1.00 0.00 H ATOM 760 HG22 VAL A 383 12.128 -7.971 2.768 1.00 0.00 H ATOM 761 HG23 VAL A 383 10.442 -8.540 2.841 1.00 0.00 H ATOM 762 H VAL A 383 11.828 -5.027 1.242 1.00 0.00 H ATOM 763 N ASP A 384 13.704 -5.485 4.721 1.00 21.81 N ATOM 764 CA ASP A 384 15.091 -5.902 4.994 1.00 21.51 C ATOM 765 C ASP A 384 15.089 -7.397 5.186 1.00 19.48 C ATOM 766 O ASP A 384 14.259 -7.929 5.922 1.00 18.02 O ATOM 767 CB ASP A 384 15.698 -5.262 6.268 1.00 23.50 C ATOM 768 CG ASP A 384 17.007 -6.001 6.733 1.00 26.25 C ATOM 769 OD1 ASP A 384 17.966 -6.190 5.921 1.00 31.63 O ATOM 770 OD2 ASP A 384 17.058 -6.423 7.909 1.00 33.39 O ATOM 771 HA ASP A 384 15.699 -5.575 4.150 1.00 0.00 H ATOM 772 HB2 ASP A 384 15.938 -4.220 6.058 1.00 0.00 H ATOM 773 HB3 ASP A 384 14.962 -5.310 7.071 1.00 0.00 H ATOM 774 H ASP A 384 13.158 -5.019 5.474 1.00 0.00 H ATOM 775 N LEU A 385 16.054 -8.066 4.562 1.00 17.50 N ATOM 776 CA LEU A 385 16.092 -9.522 4.585 1.00 16.68 C ATOM 777 C LEU A 385 16.979 -10.121 5.691 1.00 16.71 C ATOM 778 O LEU A 385 17.076 -11.336 5.825 1.00 15.81 O ATOM 779 CB LEU A 385 16.525 -10.041 3.206 1.00 16.62 C ATOM 780 CG LEU A 385 15.504 -9.904 2.059 1.00 14.56 C ATOM 781 CD1 LEU A 385 16.204 -10.199 0.747 1.00 14.91 C ATOM 782 CD2 LEU A 385 14.266 -10.858 2.324 1.00 12.52 C ATOM 783 HA LEU A 385 15.081 -9.853 4.822 1.00 0.00 H ATOM 784 HB2 LEU A 385 17.423 -9.496 2.915 1.00 0.00 H ATOM 785 HB3 LEU A 385 16.763 -11.100 3.312 1.00 0.00 H ATOM 786 HG LEU A 385 15.111 -8.889 2.007 1.00 0.00 H ATOM 787 HD21 LEU A 385 14.610 -11.891 2.379 1.00 0.00 H ATOM 788 HD22 LEU A 385 13.791 -10.581 3.265 1.00 0.00 H ATOM 789 HD23 LEU A 385 13.549 -10.756 1.509 1.00 0.00 H ATOM 790 HD11 LEU A 385 17.019 -9.490 0.604 1.00 0.00 H ATOM 791 HD12 LEU A 385 16.603 -11.213 0.769 1.00 0.00 H ATOM 792 HD13 LEU A 385 15.492 -10.105 -0.073 1.00 0.00 H ATOM 793 H LEU A 385 16.792 -7.542 4.050 1.00 0.00 H ATOM 794 N ARG A 386 17.670 -9.263 6.448 1.00 17.05 N ATOM 795 CA ARG A 386 18.447 -9.735 7.567 1.00 17.74 C ATOM 796 C ARG A 386 17.579 -10.510 8.569 1.00 16.38 C ATOM 797 O ARG A 386 16.589 -9.983 9.132 1.00 17.01 O ATOM 798 CB ARG A 386 19.248 -8.593 8.224 1.00 18.13 C ATOM 799 CG ARG A 386 20.009 -9.068 9.476 1.00 23.94 C ATOM 800 CD ARG A 386 21.051 -8.061 9.990 1.00 27.77 C ATOM 801 NE ARG A 386 22.360 -8.484 9.485 1.00 35.04 N ATOM 802 CZ ARG A 386 23.072 -7.839 8.563 1.00 36.30 C ATOM 803 NH1 ARG A 386 22.646 -6.678 8.054 1.00 36.83 N ATOM 804 NH2 ARG A 386 24.224 -8.358 8.161 1.00 35.00 N ATOM 805 HA ARG A 386 19.183 -10.444 7.186 1.00 0.00 H ATOM 806 HB2 ARG A 386 19.966 -8.205 7.501 1.00 0.00 H ATOM 807 HB3 ARG A 386 18.559 -7.799 8.511 1.00 0.00 H ATOM 808 HG2 ARG A 386 19.285 -9.249 10.270 1.00 0.00 H ATOM 809 HG3 ARG A 386 20.521 -9.999 9.234 1.00 0.00 H ATOM 810 HD2 ARG A 386 21.057 -8.055 11.080 1.00 0.00 H ATOM 811 HD3 ARG A 386 20.816 -7.062 9.623 1.00 0.00 H ATOM 812 HE ARG A 386 22.765 -9.358 9.878 1.00 0.00 H ATOM 813 HH12 ARG A 386 23.213 -6.186 7.334 1.00 0.00 H ATOM 814 HH11 ARG A 386 21.747 -6.267 8.378 1.00 0.00 H ATOM 815 HH22 ARG A 386 24.793 -7.867 7.442 1.00 0.00 H ATOM 816 HH21 ARG A 386 24.559 -9.256 8.565 1.00 0.00 H ATOM 817 H ARG A 386 17.647 -8.247 6.228 1.00 0.00 H ATOM 818 N GLY A 387 17.965 -11.762 8.786 1.00 15.76 N ATOM 819 CA GLY A 387 17.267 -12.664 9.707 1.00 15.72 C ATOM 820 C GLY A 387 15.917 -13.179 9.179 1.00 15.67 C ATOM 821 O GLY A 387 15.181 -13.833 9.929 1.00 14.90 O ATOM 822 HA3 GLY A 387 17.089 -12.130 10.640 1.00 0.00 H ATOM 823 HA2 GLY A 387 17.910 -13.523 9.899 1.00 0.00 H ATOM 824 H GLY A 387 18.800 -12.119 8.280 1.00 0.00 H ATOM 825 N ALA A 388 15.589 -12.892 7.905 1.00 14.76 N ATOM 826 CA ALA A 388 14.318 -13.383 7.309 1.00 13.84 C ATOM 827 C ALA A 388 14.296 -14.907 7.271 1.00 13.69 C ATOM 828 O ALA A 388 15.345 -15.547 7.144 1.00 15.18 O ATOM 829 CB ALA A 388 14.093 -12.796 5.880 1.00 13.19 C ATOM 830 HA ALA A 388 13.501 -13.038 7.943 1.00 0.00 H ATOM 831 HB1 ALA A 388 14.050 -11.708 5.938 1.00 0.00 H ATOM 832 HB2 ALA A 388 14.917 -13.095 5.232 1.00 0.00 H ATOM 833 HB3 ALA A 388 13.155 -13.177 5.476 1.00 0.00 H ATOM 834 H ALA A 388 16.236 -12.317 7.328 1.00 0.00 H ATOM 835 N ALA A 389 13.104 -15.485 7.386 1.00 12.12 N ATOM 836 CA ALA A 389 12.919 -16.913 7.268 1.00 13.35 C ATOM 837 C ALA A 389 12.321 -17.173 5.900 1.00 13.00 C ATOM 838 O ALA A 389 11.195 -16.746 5.637 1.00 15.07 O ATOM 839 CB ALA A 389 11.928 -17.436 8.325 1.00 12.22 C ATOM 840 HA ALA A 389 13.876 -17.415 7.410 1.00 0.00 H ATOM 841 HB1 ALA A 389 12.312 -17.216 9.321 1.00 0.00 H ATOM 842 HB2 ALA A 389 10.963 -16.948 8.190 1.00 0.00 H ATOM 843 HB3 ALA A 389 11.811 -18.513 8.209 1.00 0.00 H ATOM 844 H ALA A 389 12.273 -14.886 7.568 1.00 0.00 H ATOM 845 N LEU A 390 13.018 -17.970 5.090 1.00 11.94 N ATOM 846 CA LEU A 390 12.562 -18.304 3.740 1.00 11.16 C ATOM 847 C LEU A 390 12.291 -19.787 3.668 1.00 11.08 C ATOM 848 O LEU A 390 13.082 -20.592 4.167 1.00 10.76 O ATOM 849 CB LEU A 390 13.681 -17.924 2.763 1.00 12.09 C ATOM 850 CG LEU A 390 13.597 -18.503 1.354 1.00 9.83 C ATOM 851 CD1 LEU A 390 12.387 -17.806 0.652 1.00 13.34 C ATOM 852 CD2 LEU A 390 14.888 -18.222 0.679 1.00 10.21 C ATOM 853 HA LEU A 390 11.648 -17.767 3.488 1.00 0.00 H ATOM 854 HB2 LEU A 390 13.684 -16.838 2.673 1.00 0.00 H ATOM 855 HB3 LEU A 390 14.624 -18.254 3.199 1.00 0.00 H ATOM 856 HG LEU A 390 13.437 -19.581 1.333 1.00 0.00 H ATOM 857 HD21 LEU A 390 15.049 -17.145 0.640 1.00 0.00 H ATOM 858 HD22 LEU A 390 15.698 -18.692 1.237 1.00 0.00 H ATOM 859 HD23 LEU A 390 14.862 -18.624 -0.334 1.00 0.00 H ATOM 860 HD11 LEU A 390 11.475 -18.014 1.212 1.00 0.00 H ATOM 861 HD12 LEU A 390 12.558 -16.730 0.620 1.00 0.00 H ATOM 862 HD13 LEU A 390 12.287 -18.190 -0.363 1.00 0.00 H ATOM 863 H LEU A 390 13.917 -18.368 5.429 1.00 0.00 H ATOM 864 N ALA A 391 11.154 -20.168 3.092 1.00 10.27 N ATOM 865 CA ALA A 391 10.827 -21.573 2.944 1.00 10.68 C ATOM 866 C ALA A 391 9.974 -21.745 1.710 1.00 10.59 C ATOM 867 O ALA A 391 9.431 -20.766 1.118 1.00 9.59 O ATOM 868 CB ALA A 391 10.048 -22.083 4.167 1.00 11.09 C ATOM 869 HA ALA A 391 11.751 -22.144 2.856 1.00 0.00 H ATOM 870 HB1 ALA A 391 10.656 -21.955 5.063 1.00 0.00 H ATOM 871 HB2 ALA A 391 9.123 -21.515 4.270 1.00 0.00 H ATOM 872 HB3 ALA A 391 9.814 -23.139 4.033 1.00 0.00 H ATOM 873 H ALA A 391 10.490 -19.448 2.743 1.00 0.00 H ATOM 874 N HIS A 392 9.810 -23.009 1.358 1.00 10.95 N ATOM 875 CA HIS A 392 8.742 -23.348 0.464 1.00 12.02 C ATOM 876 C HIS A 392 7.387 -23.044 1.049 1.00 11.60 C ATOM 877 O HIS A 392 7.191 -23.175 2.232 1.00 11.78 O ATOM 878 CB HIS A 392 8.818 -24.824 -0.017 1.00 10.56 C ATOM 879 CG HIS A 392 9.945 -25.078 -0.990 1.00 12.71 C ATOM 880 ND1 HIS A 392 11.099 -25.743 -0.634 1.00 13.39 N ATOM 881 CD2 HIS A 392 10.079 -24.764 -2.301 1.00 11.97 C ATOM 882 CE1 HIS A 392 11.881 -25.869 -1.701 1.00 9.72 C ATOM 883 NE2 HIS A 392 11.288 -25.275 -2.720 1.00 17.62 N ATOM 884 HA HIS A 392 8.873 -22.711 -0.411 1.00 0.00 H ATOM 885 HB2 HIS A 392 8.961 -25.465 0.853 1.00 0.00 H ATOM 886 HB3 HIS A 392 7.876 -25.079 -0.504 1.00 0.00 H ATOM 887 HD2 HIS A 392 9.364 -24.211 -2.910 1.00 0.00 H ATOM 888 HE1 HIS A 392 12.846 -26.375 -1.730 1.00 0.00 H ATOM 889 H HIS A 392 10.446 -23.746 1.724 1.00 0.00 H ATOM 890 N GLY A 393 6.483 -22.597 0.171 1.00 11.27 N ATOM 891 CA GLY A 393 5.125 -22.269 0.579 1.00 12.21 C ATOM 892 C GLY A 393 4.028 -23.104 -0.054 1.00 13.28 C ATOM 893 O GLY A 393 2.862 -22.611 -0.115 1.00 11.59 O ATOM 894 HA3 GLY A 393 4.941 -21.225 0.324 1.00 0.00 H ATOM 895 HA2 GLY A 393 5.060 -22.394 1.660 1.00 0.00 H ATOM 896 H GLY A 393 6.756 -22.481 -0.826 1.00 0.00 H ATOM 897 N ARG A 394 4.376 -24.390 -0.437 1.00 11.92 N ATOM 898 CA ARG A 394 3.487 -25.422 -0.964 1.00 12.80 C ATOM 899 C ARG A 394 2.275 -25.692 -0.095 1.00 12.83 C ATOM 900 O ARG A 394 1.217 -26.070 -0.617 1.00 14.37 O ATOM 901 CB ARG A 394 4.314 -26.735 -1.237 1.00 12.74 C ATOM 902 CG ARG A 394 5.369 -26.301 -2.320 1.00 15.98 C ATOM 903 CD ARG A 394 6.471 -27.188 -2.940 1.00 26.26 C ATOM 904 NE ARG A 394 7.279 -27.831 -1.964 1.00 21.64 N ATOM 905 CZ ARG A 394 8.551 -28.225 -2.095 1.00 23.27 C ATOM 906 NH1 ARG A 394 9.331 -27.985 -3.165 1.00 20.58 N ATOM 907 NH2 ARG A 394 9.055 -28.860 -1.065 1.00 21.57 N ATOM 908 HA ARG A 394 3.076 -25.047 -1.901 1.00 0.00 H ATOM 909 HB2 ARG A 394 4.809 -27.077 -0.328 1.00 0.00 H ATOM 910 HB3 ARG A 394 3.670 -27.527 -1.619 1.00 0.00 H ATOM 911 HG2 ARG A 394 4.778 -25.951 -3.166 1.00 0.00 H ATOM 912 HG3 ARG A 394 5.900 -25.459 -1.876 1.00 0.00 H ATOM 913 HD2 ARG A 394 7.110 -26.563 -3.564 1.00 0.00 H ATOM 914 HD3 ARG A 394 5.997 -27.951 -3.557 1.00 0.00 H ATOM 915 HE ARG A 394 6.831 -28.016 -1.044 1.00 0.00 H ATOM 916 HH12 ARG A 394 10.312 -28.330 -3.181 1.00 0.00 H ATOM 917 HH11 ARG A 394 8.953 -27.454 -3.976 1.00 0.00 H ATOM 918 HH22 ARG A 394 10.038 -29.197 -1.092 1.00 0.00 H ATOM 919 HH21 ARG A 394 8.471 -29.027 -0.220 1.00 0.00 H ATOM 920 H ARG A 394 5.379 -24.648 -0.338 1.00 0.00 H ATOM 921 N HIS A 395 2.416 -25.460 1.206 1.00 11.81 N ATOM 922 CA HIS A 395 1.351 -25.725 2.171 1.00 12.48 C ATOM 923 C HIS A 395 0.446 -24.513 2.423 1.00 11.82 C ATOM 924 O HIS A 395 -0.570 -24.619 3.128 1.00 12.56 O ATOM 925 CB HIS A 395 1.960 -26.219 3.473 1.00 12.66 C ATOM 926 CG HIS A 395 2.902 -25.233 4.099 1.00 15.10 C ATOM 927 ND1 HIS A 395 4.034 -24.776 3.456 1.00 15.35 N ATOM 928 CD2 HIS A 395 2.871 -24.613 5.299 1.00 13.86 C ATOM 929 CE1 HIS A 395 4.675 -23.930 4.245 1.00 17.34 C ATOM 930 NE2 HIS A 395 3.988 -23.808 5.366 1.00 15.34 N ATOM 931 HA HIS A 395 0.709 -26.495 1.742 1.00 0.00 H ATOM 932 HB2 HIS A 395 1.153 -26.423 4.177 1.00 0.00 H ATOM 933 HB3 HIS A 395 2.506 -27.140 3.272 1.00 0.00 H ATOM 934 HD2 HIS A 395 2.107 -24.728 6.068 1.00 0.00 H ATOM 935 HE1 HIS A 395 5.610 -23.421 4.010 1.00 0.00 H ATOM 936 H HIS A 395 3.319 -25.075 1.550 1.00 0.00 H ATOM 937 N LEU A 396 0.791 -23.369 1.815 1.00 11.35 N ATOM 938 CA LEU A 396 0.153 -22.076 2.139 1.00 10.74 C ATOM 939 C LEU A 396 -0.697 -21.502 0.983 1.00 10.27 C ATOM 940 O LEU A 396 -1.252 -20.415 1.107 1.00 10.58 O ATOM 941 CB LEU A 396 1.223 -21.036 2.548 1.00 9.96 C ATOM 942 CG LEU A 396 2.000 -21.392 3.838 1.00 13.06 C ATOM 943 CD1 LEU A 396 3.138 -20.362 4.195 1.00 11.85 C ATOM 944 CD2 LEU A 396 1.042 -21.552 5.013 1.00 12.88 C ATOM 945 HA LEU A 396 -0.524 -22.275 2.969 1.00 0.00 H ATOM 946 HB2 LEU A 396 1.940 -20.945 1.732 1.00 0.00 H ATOM 947 HB3 LEU A 396 0.726 -20.078 2.702 1.00 0.00 H ATOM 948 HG LEU A 396 2.498 -22.341 3.639 1.00 0.00 H ATOM 949 HD21 LEU A 396 0.503 -20.618 5.171 1.00 0.00 H ATOM 950 HD22 LEU A 396 0.332 -22.350 4.795 1.00 0.00 H ATOM 951 HD23 LEU A 396 1.608 -21.802 5.910 1.00 0.00 H ATOM 952 HD11 LEU A 396 3.860 -20.324 3.380 1.00 0.00 H ATOM 953 HD12 LEU A 396 2.700 -19.375 4.341 1.00 0.00 H ATOM 954 HD13 LEU A 396 3.638 -20.678 5.111 1.00 0.00 H ATOM 955 H LEU A 396 1.535 -23.392 1.089 1.00 0.00 H ATOM 956 N SER A 397 -0.762 -22.220 -0.124 1.00 10.00 N ATOM 957 CA SER A 397 -1.449 -21.727 -1.314 1.00 10.10 C ATOM 958 C SER A 397 -1.867 -22.891 -2.192 1.00 11.47 C ATOM 959 O SER A 397 -1.191 -23.929 -2.250 1.00 12.11 O ATOM 960 CB SER A 397 -0.521 -20.812 -2.117 1.00 10.17 C ATOM 961 OG SER A 397 -1.174 -20.263 -3.255 1.00 12.33 O ATOM 962 HA SER A 397 -2.330 -21.169 -0.997 1.00 0.00 H ATOM 963 HB2 SER A 397 0.342 -21.389 -2.449 1.00 0.00 H ATOM 964 HB3 SER A 397 -0.187 -19.997 -1.475 1.00 0.00 H ATOM 965 HG SER A 397 -1.956 -19.732 -2.961 1.00 0.00 H ATOM 966 H SER A 397 -0.313 -23.158 -0.148 1.00 0.00 H ATOM 967 N SER A 398 -2.953 -22.693 -2.931 1.00 12.33 N ATOM 968 CA SER A 398 -3.290 -23.638 -3.981 1.00 13.15 C ATOM 969 C SER A 398 -2.446 -23.425 -5.254 1.00 14.62 C ATOM 970 O SER A 398 -2.521 -24.240 -6.170 1.00 12.63 O ATOM 971 CB SER A 398 -4.764 -23.486 -4.346 1.00 14.30 C ATOM 972 OG SER A 398 -4.977 -22.205 -4.944 1.00 14.76 O ATOM 973 HA SER A 398 -3.080 -24.636 -3.597 1.00 0.00 H ATOM 974 HB2 SER A 398 -5.372 -23.573 -3.446 1.00 0.00 H ATOM 975 HB3 SER A 398 -5.047 -24.268 -5.051 1.00 0.00 H ATOM 976 HG SER A 398 -4.720 -21.496 -4.303 1.00 0.00 H ATOM 977 H SER A 398 -3.559 -21.865 -2.758 1.00 0.00 H ATOM 978 N ARG A 399 -1.678 -22.322 -5.330 1.00 14.05 N ATOM 979 CA ARG A 399 -0.873 -22.026 -6.524 1.00 14.74 C ATOM 980 C ARG A 399 0.374 -22.928 -6.597 1.00 14.05 C ATOM 981 O ARG A 399 0.866 -23.404 -5.592 1.00 13.59 O ATOM 982 CB ARG A 399 -0.448 -20.544 -6.562 1.00 14.28 C ATOM 983 CG ARG A 399 -1.603 -19.557 -6.653 1.00 14.89 C ATOM 984 CD ARG A 399 -1.101 -18.201 -7.119 1.00 17.03 C ATOM 985 NE ARG A 399 -2.196 -17.294 -7.418 1.00 18.58 N ATOM 986 CZ ARG A 399 -2.063 -16.189 -8.150 1.00 18.04 C ATOM 987 NH1 ARG A 399 -0.869 -15.848 -8.663 1.00 21.58 N ATOM 988 NH2 ARG A 399 -3.111 -15.429 -8.369 1.00 17.18 N ATOM 989 HA ARG A 399 -1.502 -22.230 -7.390 1.00 0.00 H ATOM 990 HB2 ARG A 399 0.114 -20.328 -5.654 1.00 0.00 H ATOM 991 HB3 ARG A 399 0.195 -20.396 -7.430 1.00 0.00 H ATOM 992 HG2 ARG A 399 -2.341 -19.931 -7.363 1.00 0.00 H ATOM 993 HG3 ARG A 399 -2.065 -19.452 -5.671 1.00 0.00 H ATOM 994 HD2 ARG A 399 -0.500 -18.337 -8.018 1.00 0.00 H ATOM 995 HD3 ARG A 399 -0.485 -17.764 -6.334 1.00 0.00 H ATOM 996 HE ARG A 399 -3.138 -17.520 -7.039 1.00 0.00 H ATOM 997 HH12 ARG A 399 -0.776 -14.983 -9.233 1.00 0.00 H ATOM 998 HH11 ARG A 399 -0.038 -16.449 -8.490 1.00 0.00 H ATOM 999 HH22 ARG A 399 -3.016 -14.564 -8.939 1.00 0.00 H ATOM 1000 HH21 ARG A 399 -4.036 -15.691 -7.972 1.00 0.00 H ATOM 1001 H ARG A 399 -1.654 -21.664 -4.525 1.00 0.00 H ATOM 1002 N ARG A 400 0.850 -23.082 -7.784 1.00 20.00 N ATOM 1003 CA ARG A 400 2.081 -23.829 -8.014 1.00 20.00 C ATOM 1004 C ARG A 400 3.305 -22.932 -7.872 1.00 20.00 C ATOM 1005 O ARG A 400 3.332 -21.864 -8.341 1.00 16.14 O ATOM 1006 CB ARG A 400 2.056 -24.481 -9.388 1.00 20.00 C ATOM 1007 HA ARG A 400 2.148 -24.610 -7.256 1.00 0.00 H ATOM 1008 HB2 ARG A 400 1.209 -25.164 -9.449 1.00 0.00 H ATOM 1009 HB3 ARG A 400 1.959 -23.710 -10.153 1.00 0.00 H ATOM 1010 H ARG A 400 0.347 -22.666 -8.593 1.00 0.00 H ATOM 1011 N ASN A 401 4.378 -23.514 -7.322 1.00 13.55 N ATOM 1012 CA ASN A 401 5.704 -22.838 -7.251 1.00 12.17 C ATOM 1013 C ASN A 401 5.634 -21.580 -6.374 1.00 10.55 C ATOM 1014 O ASN A 401 5.704 -20.419 -6.888 1.00 11.21 O ATOM 1015 CB ASN A 401 6.248 -22.444 -8.631 1.00 12.42 C ATOM 1016 CG ASN A 401 6.095 -23.541 -9.661 1.00 15.45 C ATOM 1017 OD1 ASN A 401 6.445 -24.684 -9.395 1.00 19.35 O ATOM 1018 ND2 ASN A 401 5.584 -23.196 -10.841 1.00 15.77 N ATOM 1019 HA ASN A 401 6.385 -23.567 -6.811 1.00 0.00 H ATOM 1020 HB2 ASN A 401 5.709 -21.563 -8.979 1.00 0.00 H ATOM 1021 HB3 ASN A 401 7.307 -22.205 -8.532 1.00 0.00 H ATOM 1022 HD22 ASN A 401 5.302 -22.211 -11.017 1.00 0.00 H ATOM 1023 HD21 ASN A 401 5.467 -23.912 -11.586 1.00 0.00 H ATOM 1024 H ASN A 401 4.283 -24.473 -6.930 1.00 0.00 H ATOM 1025 N VAL A 402 5.477 -21.796 -5.074 1.00 10.00 N ATOM 1026 CA VAL A 402 5.265 -20.686 -4.131 1.00 9.58 C ATOM 1027 C VAL A 402 6.404 -20.703 -3.100 1.00 10.18 C ATOM 1028 O VAL A 402 6.750 -21.759 -2.598 1.00 10.02 O ATOM 1029 CB VAL A 402 3.888 -20.826 -3.381 1.00 9.22 C ATOM 1030 CG1 VAL A 402 3.678 -19.716 -2.308 1.00 9.87 C ATOM 1031 CG2 VAL A 402 2.768 -20.799 -4.358 1.00 10.33 C ATOM 1032 HA VAL A 402 5.253 -19.749 -4.687 1.00 0.00 H ATOM 1033 HB VAL A 402 3.904 -21.784 -2.861 1.00 0.00 H ATOM 1034 HG11 VAL A 402 4.473 -19.776 -1.565 1.00 0.00 H ATOM 1035 HG12 VAL A 402 3.701 -18.738 -2.789 1.00 0.00 H ATOM 1036 HG13 VAL A 402 2.713 -19.860 -1.822 1.00 0.00 H ATOM 1037 HG21 VAL A 402 2.785 -19.855 -4.902 1.00 0.00 H ATOM 1038 HG22 VAL A 402 2.879 -21.626 -5.059 1.00 0.00 H ATOM 1039 HG23 VAL A 402 1.821 -20.897 -3.826 1.00 0.00 H ATOM 1040 H VAL A 402 5.504 -22.771 -4.714 1.00 0.00 H ATOM 1041 N LEU A 403 6.946 -19.515 -2.810 1.00 9.98 N ATOM 1042 CA LEU A 403 7.913 -19.311 -1.733 1.00 10.16 C ATOM 1043 C LEU A 403 7.264 -18.439 -0.658 1.00 9.78 C ATOM 1044 O LEU A 403 6.444 -17.579 -0.974 1.00 10.15 O ATOM 1045 CB LEU A 403 9.153 -18.595 -2.254 1.00 10.22 C ATOM 1046 CG LEU A 403 9.927 -19.227 -3.400 1.00 12.04 C ATOM 1047 CD1 LEU A 403 11.142 -18.320 -3.734 1.00 10.11 C ATOM 1048 CD2 LEU A 403 10.345 -20.653 -3.010 1.00 10.12 C ATOM 1049 HA LEU A 403 8.206 -20.280 -1.329 1.00 0.00 H ATOM 1050 HB2 LEU A 403 8.838 -17.605 -2.585 1.00 0.00 H ATOM 1051 HB3 LEU A 403 9.843 -18.494 -1.416 1.00 0.00 H ATOM 1052 HG LEU A 403 9.311 -19.308 -4.295 1.00 0.00 H ATOM 1053 HD21 LEU A 403 10.976 -20.615 -2.122 1.00 0.00 H ATOM 1054 HD22 LEU A 403 9.455 -21.247 -2.800 1.00 0.00 H ATOM 1055 HD23 LEU A 403 10.900 -21.105 -3.832 1.00 0.00 H ATOM 1056 HD11 LEU A 403 10.787 -17.331 -4.025 1.00 0.00 H ATOM 1057 HD12 LEU A 403 11.782 -18.234 -2.856 1.00 0.00 H ATOM 1058 HD13 LEU A 403 11.708 -18.760 -4.555 1.00 0.00 H ATOM 1059 H LEU A 403 6.664 -18.693 -3.381 1.00 0.00 H ATOM 1060 N HIS A 404 7.656 -18.671 0.593 1.00 9.74 N ATOM 1061 CA HIS A 404 7.096 -17.944 1.765 1.00 9.58 C ATOM 1062 C HIS A 404 8.280 -17.245 2.410 1.00 10.05 C ATOM 1063 O HIS A 404 9.315 -17.891 2.675 1.00 9.34 O ATOM 1064 CB HIS A 404 6.532 -18.996 2.722 1.00 10.06 C ATOM 1065 CG HIS A 404 6.158 -18.473 4.086 1.00 12.13 C ATOM 1066 ND1 HIS A 404 5.361 -17.354 4.299 1.00 15.64 N ATOM 1067 CD2 HIS A 404 6.423 -18.984 5.307 1.00 10.01 C ATOM 1068 CE1 HIS A 404 5.182 -17.189 5.609 1.00 7.83 C ATOM 1069 NE2 HIS A 404 5.832 -18.156 6.239 1.00 13.44 N ATOM 1070 HA HIS A 404 6.313 -17.232 1.504 1.00 0.00 H ATOM 1071 HB2 HIS A 404 5.640 -19.426 2.267 1.00 0.00 H ATOM 1072 HB3 HIS A 404 7.283 -19.775 2.851 1.00 0.00 H ATOM 1073 HD2 HIS A 404 6.998 -19.885 5.518 1.00 0.00 H ATOM 1074 HE1 HIS A 404 4.601 -16.396 6.080 1.00 0.00 H ATOM 1075 H HIS A 404 8.386 -19.393 0.759 1.00 0.00 H ATOM 1076 N ILE A 405 8.118 -15.950 2.708 1.00 8.59 N ATOM 1077 CA ILE A 405 9.143 -15.225 3.477 1.00 9.17 C ATOM 1078 C ILE A 405 8.504 -14.578 4.684 1.00 9.73 C ATOM 1079 O ILE A 405 7.413 -13.988 4.580 1.00 9.54 O ATOM 1080 CB ILE A 405 9.827 -14.127 2.608 1.00 9.13 C ATOM 1081 CG1 ILE A 405 10.742 -14.823 1.599 1.00 12.49 C ATOM 1082 CG2 ILE A 405 10.689 -13.144 3.514 1.00 12.14 C ATOM 1083 CD1 ILE A 405 11.434 -13.806 0.652 1.00 18.40 C ATOM 1084 HA ILE A 405 9.903 -15.940 3.791 1.00 0.00 H ATOM 1085 HB ILE A 405 9.064 -13.538 2.099 1.00 0.00 H ATOM 1086 HG12 ILE A 405 11.507 -15.379 2.141 1.00 0.00 H ATOM 1087 HG13 ILE A 405 10.148 -15.514 1.001 1.00 0.00 H ATOM 1088 HD11 ILE A 405 10.675 -13.250 0.101 1.00 0.00 H ATOM 1089 HD12 ILE A 405 12.036 -13.114 1.241 1.00 0.00 H ATOM 1090 HD13 ILE A 405 12.075 -14.342 -0.049 1.00 0.00 H ATOM 1091 HG21 ILE A 405 10.039 -12.661 4.244 1.00 0.00 H ATOM 1092 HG22 ILE A 405 11.460 -13.713 4.033 1.00 0.00 H ATOM 1093 HG23 ILE A 405 11.156 -12.387 2.884 1.00 0.00 H ATOM 1094 H ILE A 405 7.261 -15.452 2.394 1.00 0.00 H ATOM 1095 N ARG A 406 9.154 -14.729 5.826 1.00 9.72 N ATOM 1096 CA ARG A 406 8.657 -14.066 7.045 1.00 10.59 C ATOM 1097 C ARG A 406 9.792 -13.270 7.599 1.00 12.34 C ATOM 1098 O ARG A 406 10.835 -13.870 7.930 1.00 11.98 O ATOM 1099 CB ARG A 406 8.261 -15.142 8.055 1.00 11.17 C ATOM 1100 CG ARG A 406 7.857 -14.601 9.454 1.00 12.95 C ATOM 1101 CD ARG A 406 7.221 -15.756 10.310 1.00 16.76 C ATOM 1102 NE ARG A 406 8.137 -16.900 10.463 1.00 20.44 N ATOM 1103 CZ ARG A 406 9.215 -16.933 11.250 1.00 24.01 C ATOM 1104 NH1 ARG A 406 9.555 -15.886 12.010 1.00 23.75 N ATOM 1105 NH2 ARG A 406 9.974 -18.027 11.256 1.00 24.52 N ATOM 1106 HA ARG A 406 7.798 -13.429 6.835 1.00 0.00 H ATOM 1107 HB2 ARG A 406 7.415 -15.696 7.648 1.00 0.00 H ATOM 1108 HB3 ARG A 406 9.108 -15.816 8.183 1.00 0.00 H ATOM 1109 HG2 ARG A 406 8.741 -14.218 9.963 1.00 0.00 H ATOM 1110 HG3 ARG A 406 7.131 -13.797 9.335 1.00 0.00 H ATOM 1111 HD2 ARG A 406 6.310 -16.098 9.818 1.00 0.00 H ATOM 1112 HD3 ARG A 406 6.975 -15.367 11.298 1.00 0.00 H ATOM 1113 HE ARG A 406 7.926 -17.755 9.910 1.00 0.00 H ATOM 1114 HH12 ARG A 406 10.399 -15.935 12.615 1.00 0.00 H ATOM 1115 HH11 ARG A 406 8.975 -15.023 11.996 1.00 0.00 H ATOM 1116 HH22 ARG A 406 10.818 -18.071 11.863 1.00 0.00 H ATOM 1117 HH21 ARG A 406 9.723 -18.837 10.654 1.00 0.00 H ATOM 1118 H ARG A 406 10.013 -15.314 5.864 1.00 0.00 H ATOM 1119 N THR A 407 9.570 -11.960 7.781 1.00 13.68 N ATOM 1120 CA THR A 407 10.659 -11.039 8.191 1.00 15.33 C ATOM 1121 C THR A 407 10.653 -10.860 9.722 1.00 17.19 C ATOM 1122 O THR A 407 9.661 -11.180 10.389 1.00 16.00 O ATOM 1123 CB THR A 407 10.558 -9.669 7.480 1.00 16.42 C ATOM 1124 OG1 THR A 407 9.386 -8.976 7.940 1.00 16.49 O ATOM 1125 CG2 THR A 407 10.517 -9.836 5.920 1.00 14.78 C ATOM 1126 HA THR A 407 11.605 -11.488 7.888 1.00 0.00 H ATOM 1127 HB THR A 407 11.446 -9.086 7.725 1.00 0.00 H ATOM 1128 HG1 THR A 407 9.322 -8.099 7.484 1.00 0.00 H ATOM 1129 HG23 THR A 407 11.412 -10.363 5.589 1.00 0.00 H ATOM 1130 HG21 THR A 407 9.632 -10.408 5.640 1.00 0.00 H ATOM 1131 HG22 THR A 407 10.478 -8.853 5.451 1.00 0.00 H ATOM 1132 H THR A 407 8.613 -11.581 7.631 1.00 0.00 H ATOM 1133 N ILE A 408 11.773 -10.387 10.267 1.00 17.71 N ATOM 1134 CA ILE A 408 11.921 -10.190 11.714 1.00 20.25 C ATOM 1135 C ILE A 408 10.788 -9.315 12.346 1.00 20.02 C ATOM 1136 O ILE A 408 10.269 -9.647 13.409 1.00 21.10 O ATOM 1137 CB ILE A 408 13.349 -9.627 12.037 1.00 19.95 C ATOM 1138 CG1 ILE A 408 14.389 -10.746 11.995 1.00 23.08 C ATOM 1139 CG2 ILE A 408 13.380 -8.839 13.372 1.00 23.27 C ATOM 1140 CD1 ILE A 408 14.066 -11.977 12.782 1.00 25.59 C ATOM 1141 HA ILE A 408 11.814 -11.168 12.183 1.00 0.00 H ATOM 1142 HB ILE A 408 13.608 -8.907 11.261 1.00 0.00 H ATOM 1143 HG12 ILE A 408 14.519 -11.041 10.954 1.00 0.00 H ATOM 1144 HG13 ILE A 408 15.327 -10.343 12.377 1.00 0.00 H ATOM 1145 HD11 ILE A 408 13.948 -11.714 13.833 1.00 0.00 H ATOM 1146 HD12 ILE A 408 13.139 -12.412 12.409 1.00 0.00 H ATOM 1147 HD13 ILE A 408 14.876 -12.698 12.675 1.00 0.00 H ATOM 1148 HG21 ILE A 408 12.689 -7.998 13.312 1.00 0.00 H ATOM 1149 HG22 ILE A 408 13.083 -9.497 14.188 1.00 0.00 H ATOM 1150 HG23 ILE A 408 14.390 -8.470 13.551 1.00 0.00 H ATOM 1151 H ILE A 408 12.571 -10.149 9.645 1.00 0.00 H ATOM 1152 N PRO A 409 10.427 -8.194 11.707 1.00 19.79 N ATOM 1153 CA PRO A 409 9.251 -7.453 12.204 1.00 19.16 C ATOM 1154 C PRO A 409 7.892 -8.175 12.094 1.00 18.09 C ATOM 1155 O PRO A 409 6.868 -7.629 12.534 1.00 17.73 O ATOM 1156 CB PRO A 409 9.215 -6.231 11.295 1.00 19.15 C ATOM 1157 CG PRO A 409 10.583 -6.094 10.766 1.00 21.44 C ATOM 1158 CD PRO A 409 11.063 -7.489 10.586 1.00 20.37 C ATOM 1159 HA PRO A 409 9.366 -7.274 13.273 1.00 0.00 H ATOM 1160 HD3 PRO A 409 10.738 -7.897 9.629 1.00 0.00 H ATOM 1161 HD2 PRO A 409 12.150 -7.543 10.652 1.00 0.00 H ATOM 1162 HG3 PRO A 409 11.216 -5.558 11.473 1.00 0.00 H ATOM 1163 HG2 PRO A 409 10.575 -5.564 9.813 1.00 0.00 H ATOM 1164 HB2 PRO A 409 8.505 -6.381 10.482 1.00 0.00 H ATOM 1165 HB3 PRO A 409 8.934 -5.343 11.861 1.00 0.00 H ATOM 1166 N GLY A 410 7.847 -9.349 11.469 1.00 16.49 N ATOM 1167 CA GLY A 410 6.602 -10.113 11.397 1.00 16.50 C ATOM 1168 C GLY A 410 5.781 -10.014 10.117 1.00 16.27 C ATOM 1169 O GLY A 410 4.639 -10.487 10.066 1.00 16.84 O ATOM 1170 HA3 GLY A 410 5.967 -9.779 12.218 1.00 0.00 H ATOM 1171 HA2 GLY A 410 6.856 -11.163 11.540 1.00 0.00 H ATOM 1172 H GLY A 410 8.708 -9.728 11.026 1.00 0.00 H ATOM 1173 N HIS A 411 6.356 -9.421 9.080 1.00 14.93 N ATOM 1174 CA HIS A 411 5.643 -9.298 7.818 1.00 16.61 C ATOM 1175 C HIS A 411 5.865 -10.585 7.060 1.00 14.90 C ATOM 1176 O HIS A 411 6.975 -11.155 7.086 1.00 15.91 O ATOM 1177 CB HIS A 411 6.148 -8.101 7.015 1.00 16.51 C ATOM 1178 CG HIS A 411 6.212 -6.843 7.826 1.00 22.16 C ATOM 1179 ND1 HIS A 411 5.289 -6.558 8.813 1.00 24.99 N ATOM 1180 CD2 HIS A 411 7.091 -5.815 7.819 1.00 24.64 C ATOM 1181 CE1 HIS A 411 5.593 -5.396 9.370 1.00 28.54 C ATOM 1182 NE2 HIS A 411 6.681 -4.927 8.786 1.00 26.13 N ATOM 1183 HA HIS A 411 4.580 -9.130 7.994 1.00 0.00 H ATOM 1184 HB2 HIS A 411 7.147 -8.327 6.643 1.00 0.00 H ATOM 1185 HB3 HIS A 411 5.476 -7.938 6.172 1.00 0.00 H ATOM 1186 HD2 HIS A 411 7.960 -5.710 7.170 1.00 0.00 H ATOM 1187 HE1 HIS A 411 5.040 -4.909 10.173 1.00 0.00 H ATOM 1188 H HIS A 411 7.320 -9.042 9.169 1.00 0.00 H ATOM 1189 N GLU A 412 4.832 -11.053 6.377 1.00 14.17 N ATOM 1190 CA GLU A 412 4.969 -12.339 5.682 1.00 12.90 C ATOM 1191 C GLU A 412 4.340 -12.187 4.312 1.00 12.40 C ATOM 1192 O GLU A 412 3.308 -11.513 4.142 1.00 13.21 O ATOM 1193 CB GLU A 412 4.220 -13.474 6.379 1.00 11.49 C ATOM 1194 CG GLU A 412 4.725 -13.866 7.773 1.00 14.31 C ATOM 1195 CD GLU A 412 4.018 -15.046 8.333 1.00 19.10 C ATOM 1196 OE1 GLU A 412 3.740 -16.026 7.601 1.00 19.05 O ATOM 1197 OE2 GLU A 412 3.707 -14.984 9.535 1.00 20.44 O ATOM 1198 HA GLU A 412 6.030 -12.587 5.655 1.00 0.00 H ATOM 1199 HB2 GLU A 412 3.177 -13.174 6.476 1.00 0.00 H ATOM 1200 HB3 GLU A 412 4.285 -14.356 5.742 1.00 0.00 H ATOM 1201 HG2 GLU A 412 5.788 -14.097 7.706 1.00 0.00 H ATOM 1202 HG3 GLU A 412 4.580 -13.021 8.446 1.00 0.00 H ATOM 1203 H GLU A 412 3.940 -10.520 6.334 1.00 0.00 H ATOM 1204 N PHE A 413 4.957 -12.826 3.340 1.00 11.12 N ATOM 1205 CA PHE A 413 4.647 -12.631 1.922 1.00 11.15 C ATOM 1206 C PHE A 413 4.751 -14.005 1.261 1.00 10.26 C ATOM 1207 O PHE A 413 5.625 -14.804 1.667 1.00 10.12 O ATOM 1208 CB PHE A 413 5.738 -11.754 1.248 1.00 11.28 C ATOM 1209 CG PHE A 413 5.857 -10.335 1.782 1.00 14.08 C ATOM 1210 CD1 PHE A 413 5.215 -9.271 1.123 1.00 16.50 C ATOM 1211 CD2 PHE A 413 6.664 -10.053 2.901 1.00 14.02 C ATOM 1212 CE1 PHE A 413 5.337 -7.944 1.588 1.00 16.31 C ATOM 1213 CE2 PHE A 413 6.789 -8.737 3.392 1.00 17.26 C ATOM 1214 CZ PHE A 413 6.119 -7.675 2.737 1.00 15.21 C ATOM 1215 HA PHE A 413 3.667 -12.164 1.820 1.00 0.00 H ATOM 1216 HB2 PHE A 413 6.700 -12.248 1.387 1.00 0.00 H ATOM 1217 HB3 PHE A 413 5.512 -11.695 0.183 1.00 0.00 H ATOM 1218 HD2 PHE A 413 7.200 -10.864 3.395 1.00 0.00 H ATOM 1219 HE2 PHE A 413 7.399 -8.538 4.273 1.00 0.00 H ATOM 1220 HZ PHE A 413 6.205 -6.656 3.115 1.00 0.00 H ATOM 1221 HE1 PHE A 413 4.832 -7.131 1.066 1.00 0.00 H ATOM 1222 HD1 PHE A 413 4.613 -9.475 0.238 1.00 0.00 H ATOM 1223 H PHE A 413 5.704 -13.505 3.592 1.00 0.00 H ATOM 1224 N LEU A 414 4.004 -14.227 0.192 1.00 9.64 N ATOM 1225 CA LEU A 414 4.274 -15.330 -0.717 1.00 8.77 C ATOM 1226 C LEU A 414 4.706 -14.777 -2.079 1.00 9.06 C ATOM 1227 O LEU A 414 4.142 -13.775 -2.531 1.00 8.97 O ATOM 1228 CB LEU A 414 2.986 -16.141 -0.944 1.00 9.91 C ATOM 1229 CG LEU A 414 2.449 -16.806 0.363 1.00 8.65 C ATOM 1230 CD1 LEU A 414 1.092 -17.463 0.049 1.00 8.14 C ATOM 1231 CD2 LEU A 414 3.399 -17.801 1.035 1.00 10.38 C ATOM 1232 HA LEU A 414 5.055 -15.954 -0.283 1.00 0.00 H ATOM 1233 HB2 LEU A 414 2.219 -15.473 -1.336 1.00 0.00 H ATOM 1234 HB3 LEU A 414 3.192 -16.924 -1.674 1.00 0.00 H ATOM 1235 HG LEU A 414 2.347 -16.009 1.100 1.00 0.00 H ATOM 1236 HD21 LEU A 414 3.620 -18.614 0.344 1.00 0.00 H ATOM 1237 HD22 LEU A 414 4.324 -17.292 1.306 1.00 0.00 H ATOM 1238 HD23 LEU A 414 2.927 -18.203 1.932 1.00 0.00 H ATOM 1239 HD11 LEU A 414 0.393 -16.702 -0.298 1.00 0.00 H ATOM 1240 HD12 LEU A 414 1.226 -18.217 -0.727 1.00 0.00 H ATOM 1241 HD13 LEU A 414 0.700 -17.934 0.951 1.00 0.00 H ATOM 1242 H LEU A 414 3.201 -13.595 -0.004 1.00 0.00 H ATOM 1243 N LEU A 415 5.654 -15.458 -2.738 1.00 9.22 N ATOM 1244 CA LEU A 415 6.078 -15.154 -4.124 1.00 9.76 C ATOM 1245 C LEU A 415 5.734 -16.370 -4.967 1.00 10.21 C ATOM 1246 O LEU A 415 5.818 -17.506 -4.488 1.00 10.44 O ATOM 1247 CB LEU A 415 7.614 -14.951 -4.220 1.00 8.75 C ATOM 1248 CG LEU A 415 8.102 -13.745 -3.414 1.00 10.62 C ATOM 1249 CD1 LEU A 415 9.648 -13.716 -3.246 1.00 13.37 C ATOM 1250 CD2 LEU A 415 7.570 -12.385 -3.898 1.00 12.72 C ATOM 1251 HA LEU A 415 5.581 -14.242 -4.456 1.00 0.00 H ATOM 1252 HB2 LEU A 415 8.109 -15.846 -3.843 1.00 0.00 H ATOM 1253 HB3 LEU A 415 7.882 -14.803 -5.266 1.00 0.00 H ATOM 1254 HG LEU A 415 7.660 -13.899 -2.430 1.00 0.00 H ATOM 1255 HD21 LEU A 415 7.882 -12.220 -4.929 1.00 0.00 H ATOM 1256 HD22 LEU A 415 6.481 -12.381 -3.841 1.00 0.00 H ATOM 1257 HD23 LEU A 415 7.971 -11.593 -3.265 1.00 0.00 H ATOM 1258 HD11 LEU A 415 9.973 -14.617 -2.726 1.00 0.00 H ATOM 1259 HD12 LEU A 415 10.118 -13.672 -4.228 1.00 0.00 H ATOM 1260 HD13 LEU A 415 9.933 -12.838 -2.666 1.00 0.00 H ATOM 1261 H LEU A 415 6.120 -16.247 -2.246 1.00 0.00 H ATOM 1262 N GLN A 416 5.340 -16.145 -6.210 1.00 9.44 N ATOM 1263 CA GLN A 416 4.882 -17.291 -7.024 1.00 10.39 C ATOM 1264 C GLN A 416 5.199 -17.020 -8.510 1.00 10.25 C ATOM 1265 O GLN A 416 5.173 -15.862 -8.971 1.00 10.69 O ATOM 1266 CB GLN A 416 3.364 -17.544 -6.742 1.00 9.98 C ATOM 1267 CG GLN A 416 2.720 -18.745 -7.477 1.00 10.85 C ATOM 1268 CD GLN A 416 2.328 -18.435 -8.913 1.00 11.92 C ATOM 1269 OE1 GLN A 416 1.966 -17.287 -9.264 1.00 15.75 O ATOM 1270 NE2 GLN A 416 2.312 -19.478 -9.742 1.00 15.55 N ATOM 1271 HA GLN A 416 5.410 -18.206 -6.755 1.00 0.00 H ATOM 1272 HB2 GLN A 416 3.248 -17.709 -5.671 1.00 0.00 H ATOM 1273 HB3 GLN A 416 2.818 -16.646 -7.031 1.00 0.00 H ATOM 1274 HG2 GLN A 416 3.433 -19.569 -7.484 1.00 0.00 H ATOM 1275 HG3 GLN A 416 1.825 -19.045 -6.931 1.00 0.00 H ATOM 1276 HE22 GLN A 416 2.621 -20.413 -9.408 1.00 0.00 H ATOM 1277 HE21 GLN A 416 1.990 -19.357 -10.724 1.00 0.00 H ATOM 1278 H GLN A 416 5.352 -15.183 -6.606 1.00 0.00 H ATOM 1279 N SER A 417 5.508 -18.017 -9.296 1.00 20.00 N ATOM 1280 CA SER A 417 5.588 -17.914 -10.748 1.00 20.00 C ATOM 1281 C SER A 417 5.089 -19.190 -11.420 1.00 20.00 C ATOM 1282 O SER A 417 5.278 -20.230 -10.783 1.00 14.36 O ATOM 1283 CB SER A 417 7.023 -17.616 -11.187 1.00 20.00 C ATOM 1284 OG SER A 417 7.117 -17.536 -12.599 1.00 20.00 O ATOM 1285 HA SER A 417 4.945 -17.091 -11.059 1.00 0.00 H ATOM 1286 HB2 SER A 417 7.677 -18.411 -10.831 1.00 0.00 H ATOM 1287 HB3 SER A 417 7.338 -16.667 -10.754 1.00 0.00 H ATOM 1288 HG SER A 417 8.053 -17.343 -12.856 1.00 0.00 H ATOM 1289 H SER A 417 5.709 -18.939 -8.860 1.00 0.00 H ATOM 1290 N ASP A 418 4.488 -19.071 -12.524 1.00 16.68 N ATOM 1291 CA ASP A 418 4.082 -20.248 -13.278 1.00 18.37 C ATOM 1292 C ASP A 418 5.270 -20.957 -13.899 1.00 19.24 C ATOM 1293 O ASP A 418 5.123 -22.031 -14.466 1.00 21.01 O ATOM 1294 CB ASP A 418 3.119 -19.806 -14.379 1.00 19.55 C ATOM 1295 CG ASP A 418 1.812 -19.291 -13.844 1.00 22.85 C ATOM 1296 OD1 ASP A 418 1.457 -19.587 -12.673 1.00 24.47 O ATOM 1297 OD2 ASP A 418 1.133 -18.584 -14.608 1.00 27.21 O ATOM 1298 HA ASP A 418 3.601 -20.950 -12.597 1.00 0.00 H ATOM 1299 HB2 ASP A 418 3.594 -19.014 -14.959 1.00 0.00 H ATOM 1300 HB3 ASP A 418 2.917 -20.659 -15.028 1.00 0.00 H ATOM 1301 H ASP A 418 4.281 -18.123 -12.898 1.00 0.00 H ATOM 1302 N HIS A 419 6.454 -20.356 -13.796 1.00 19.19 N ATOM 1303 CA HIS A 419 7.662 -20.875 -14.444 1.00 21.38 C ATOM 1304 C HIS A 419 8.600 -21.408 -13.390 1.00 21.58 C ATOM 1305 O HIS A 419 9.283 -20.651 -12.709 1.00 21.61 O ATOM 1306 CB HIS A 419 8.274 -19.807 -15.377 1.00 21.86 C ATOM 1307 CG HIS A 419 7.242 -19.193 -16.287 1.00 23.49 C ATOM 1308 ND1 HIS A 419 6.761 -17.910 -16.118 1.00 26.48 N ATOM 1309 CD2 HIS A 419 6.512 -19.736 -17.294 1.00 24.67 C ATOM 1310 CE1 HIS A 419 5.817 -17.672 -17.011 1.00 22.32 C ATOM 1311 NE2 HIS A 419 5.643 -18.766 -17.732 1.00 23.53 N ATOM 1312 HA HIS A 419 7.426 -21.716 -15.096 1.00 0.00 H ATOM 1313 HB2 HIS A 419 8.719 -19.020 -14.768 1.00 0.00 H ATOM 1314 HB3 HIS A 419 9.048 -20.274 -15.987 1.00 0.00 H ATOM 1315 HD2 HIS A 419 6.599 -20.751 -17.682 1.00 0.00 H ATOM 1316 HE1 HIS A 419 5.275 -16.734 -17.132 1.00 0.00 H ATOM 1317 H HIS A 419 6.524 -19.484 -13.234 1.00 0.00 H ATOM 1318 N GLU A 420 8.572 -22.731 -13.239 1.00 21.85 N ATOM 1319 CA GLU A 420 9.197 -23.416 -12.118 1.00 22.89 C ATOM 1320 C GLU A 420 10.702 -23.152 -12.104 1.00 22.56 C ATOM 1321 O GLU A 420 11.267 -22.942 -11.051 1.00 21.33 O ATOM 1322 CB GLU A 420 8.867 -24.906 -12.195 1.00 22.81 C ATOM 1323 CG GLU A 420 9.515 -25.823 -11.152 1.00 28.62 C ATOM 1324 CD GLU A 420 9.538 -27.307 -11.624 1.00 36.02 C ATOM 1325 OE1 GLU A 420 8.972 -27.620 -12.710 1.00 36.62 O ATOM 1326 OE2 GLU A 420 10.122 -28.154 -10.906 1.00 39.69 O ATOM 1327 HA GLU A 420 8.804 -23.032 -11.177 1.00 0.00 H ATOM 1328 HB2 GLU A 420 7.786 -25.008 -12.095 1.00 0.00 H ATOM 1329 HB3 GLU A 420 9.175 -25.260 -13.179 1.00 0.00 H ATOM 1330 HG2 GLU A 420 10.539 -25.492 -10.977 1.00 0.00 H ATOM 1331 HG3 GLU A 420 8.949 -25.756 -10.223 1.00 0.00 H ATOM 1332 H GLU A 420 8.080 -23.301 -13.956 1.00 0.00 H ATOM 1333 N THR A 421 11.340 -23.094 -13.277 1.00 22.66 N ATOM 1334 CA THR A 421 12.796 -22.863 -13.308 1.00 23.44 C ATOM 1335 C THR A 421 13.184 -21.449 -12.865 1.00 22.33 C ATOM 1336 O THR A 421 14.226 -21.251 -12.249 1.00 21.80 O ATOM 1337 CB THR A 421 13.446 -23.190 -14.666 1.00 25.32 C ATOM 1338 OG1 THR A 421 13.010 -22.253 -15.650 1.00 27.42 O ATOM 1339 CG2 THR A 421 13.106 -24.698 -15.108 1.00 24.73 C ATOM 1340 HA THR A 421 13.194 -23.570 -12.580 1.00 0.00 H ATOM 1341 HB THR A 421 14.529 -23.110 -14.570 1.00 0.00 H ATOM 1342 HG1 THR A 421 12.025 -22.303 -15.738 1.00 0.00 H ATOM 1343 HG23 THR A 421 13.451 -25.388 -14.337 1.00 0.00 H ATOM 1344 HG21 THR A 421 12.029 -24.804 -15.236 1.00 0.00 H ATOM 1345 HG22 THR A 421 13.609 -24.922 -16.049 1.00 0.00 H ATOM 1346 H THR A 421 10.811 -23.211 -14.165 1.00 0.00 H ATOM 1347 N GLU A 422 12.339 -20.483 -13.166 1.00 21.02 N ATOM 1348 CA GLU A 422 12.624 -19.131 -12.741 1.00 21.23 C ATOM 1349 C GLU A 422 12.297 -18.957 -11.254 1.00 19.92 C ATOM 1350 O GLU A 422 13.025 -18.253 -10.542 1.00 17.14 O ATOM 1351 CB GLU A 422 11.903 -18.136 -13.617 1.00 23.03 C ATOM 1352 CG GLU A 422 10.483 -17.851 -13.229 1.00 28.18 C ATOM 1353 CD GLU A 422 9.984 -16.590 -13.868 1.00 34.03 C ATOM 1354 OE1 GLU A 422 10.718 -16.060 -14.747 1.00 37.91 O ATOM 1355 OE2 GLU A 422 8.872 -16.141 -13.506 1.00 34.56 O ATOM 1356 HA GLU A 422 13.690 -18.936 -12.856 1.00 0.00 H ATOM 1357 HB2 GLU A 422 12.456 -17.197 -13.586 1.00 0.00 H ATOM 1358 HB3 GLU A 422 11.903 -18.522 -14.636 1.00 0.00 H ATOM 1359 HG2 GLU A 422 9.854 -18.683 -13.547 1.00 0.00 H ATOM 1360 HG3 GLU A 422 10.425 -17.747 -12.146 1.00 0.00 H ATOM 1361 H GLU A 422 11.474 -20.692 -13.705 1.00 0.00 H ATOM 1362 N LEU A 423 11.263 -19.661 -10.782 1.00 17.79 N ATOM 1363 CA LEU A 423 10.963 -19.682 -9.343 1.00 16.64 C ATOM 1364 C LEU A 423 12.129 -20.322 -8.580 1.00 16.16 C ATOM 1365 O LEU A 423 12.580 -19.797 -7.538 1.00 13.90 O ATOM 1366 CB LEU A 423 9.598 -20.351 -9.014 1.00 17.41 C ATOM 1367 CG LEU A 423 9.463 -19.955 -7.528 1.00 19.03 C ATOM 1368 CD1 LEU A 423 8.726 -18.601 -7.280 1.00 19.80 C ATOM 1369 CD2 LEU A 423 9.171 -20.957 -6.463 1.00 18.91 C ATOM 1370 HA LEU A 423 10.855 -18.650 -9.009 1.00 0.00 H ATOM 1371 HB2 LEU A 423 8.789 -19.941 -9.618 1.00 0.00 H ATOM 1372 HB3 LEU A 423 9.634 -21.433 -9.144 1.00 0.00 H ATOM 1373 HG LEU A 423 10.534 -19.842 -7.363 1.00 0.00 H ATOM 1374 HD21 LEU A 423 8.217 -21.441 -6.673 1.00 0.00 H ATOM 1375 HD22 LEU A 423 9.963 -21.706 -6.443 1.00 0.00 H ATOM 1376 HD23 LEU A 423 9.120 -20.454 -5.497 1.00 0.00 H ATOM 1377 HD11 LEU A 423 9.271 -17.796 -7.774 1.00 0.00 H ATOM 1378 HD12 LEU A 423 7.716 -18.659 -7.685 1.00 0.00 H ATOM 1379 HD13 LEU A 423 8.679 -18.405 -6.209 1.00 0.00 H ATOM 1380 H LEU A 423 10.664 -20.200 -11.440 1.00 0.00 H ATOM 1381 N ARG A 424 12.656 -21.446 -9.097 1.00 14.75 N ATOM 1382 CA ARG A 424 13.832 -22.050 -8.443 1.00 16.37 C ATOM 1383 C ARG A 424 15.057 -21.089 -8.432 1.00 15.07 C ATOM 1384 O ARG A 424 15.810 -21.013 -7.425 1.00 14.76 O ATOM 1385 CB ARG A 424 14.147 -23.428 -9.052 1.00 17.00 C ATOM 1386 CG ARG A 424 15.444 -24.112 -8.511 1.00 21.60 C ATOM 1387 CD ARG A 424 15.860 -25.298 -9.472 1.00 28.92 C ATOM 1388 NE ARG A 424 14.699 -26.121 -9.872 1.00 37.92 N ATOM 1389 CZ ARG A 424 14.279 -26.305 -11.132 1.00 41.64 C ATOM 1390 NH1 ARG A 424 14.933 -25.771 -12.166 1.00 44.12 N ATOM 1391 NH2 ARG A 424 13.204 -27.049 -11.367 1.00 44.00 N ATOM 1392 HA ARG A 424 13.587 -22.216 -7.394 1.00 0.00 H ATOM 1393 HB2 ARG A 424 13.305 -24.089 -8.846 1.00 0.00 H ATOM 1394 HB3 ARG A 424 14.255 -23.304 -10.130 1.00 0.00 H ATOM 1395 HG2 ARG A 424 16.250 -23.379 -8.469 1.00 0.00 H ATOM 1396 HG3 ARG A 424 15.258 -24.504 -7.511 1.00 0.00 H ATOM 1397 HD2 ARG A 424 16.581 -25.933 -8.956 1.00 0.00 H ATOM 1398 HD3 ARG A 424 16.321 -24.881 -10.367 1.00 0.00 H ATOM 1399 HE ARG A 424 14.165 -26.595 -9.116 1.00 0.00 H ATOM 1400 HH12 ARG A 424 14.589 -25.927 -13.135 1.00 0.00 H ATOM 1401 HH11 ARG A 424 15.786 -25.199 -12.002 1.00 0.00 H ATOM 1402 HH22 ARG A 424 12.875 -27.194 -12.343 1.00 0.00 H ATOM 1403 HH21 ARG A 424 12.691 -27.487 -10.575 1.00 0.00 H ATOM 1404 H ARG A 424 12.241 -21.883 -9.945 1.00 0.00 H ATOM 1405 N ALA A 425 15.220 -20.318 -9.509 1.00 14.75 N ATOM 1406 CA ALA A 425 16.355 -19.389 -9.615 1.00 13.90 C ATOM 1407 C ALA A 425 16.179 -18.324 -8.527 1.00 13.29 C ATOM 1408 O ALA A 425 17.150 -17.943 -7.829 1.00 13.09 O ATOM 1409 CB ALA A 425 16.404 -18.745 -11.006 1.00 14.29 C ATOM 1410 HA ALA A 425 17.296 -19.921 -9.477 1.00 0.00 H ATOM 1411 HB1 ALA A 425 16.514 -19.523 -11.761 1.00 0.00 H ATOM 1412 HB2 ALA A 425 15.480 -18.194 -11.182 1.00 0.00 H ATOM 1413 HB3 ALA A 425 17.252 -18.062 -11.059 1.00 0.00 H ATOM 1414 H ALA A 425 14.532 -20.375 -10.287 1.00 0.00 H ATOM 1415 N TRP A 426 14.936 -17.853 -8.373 1.00 11.96 N ATOM 1416 CA TRP A 426 14.660 -16.873 -7.309 1.00 11.82 C ATOM 1417 C TRP A 426 14.945 -17.462 -5.930 1.00 11.23 C ATOM 1418 O TRP A 426 15.481 -16.780 -5.066 1.00 9.87 O ATOM 1419 CB TRP A 426 13.221 -16.386 -7.367 1.00 11.19 C ATOM 1420 CG TRP A 426 13.000 -15.210 -8.281 1.00 12.21 C ATOM 1421 CD1 TRP A 426 12.447 -15.243 -9.530 1.00 15.01 C ATOM 1422 CD2 TRP A 426 13.225 -13.836 -7.979 1.00 14.53 C ATOM 1423 NE1 TRP A 426 12.351 -13.972 -10.051 1.00 15.92 N ATOM 1424 CE2 TRP A 426 12.813 -13.081 -9.119 1.00 14.90 C ATOM 1425 CE3 TRP A 426 13.741 -13.152 -6.857 1.00 15.09 C ATOM 1426 CZ2 TRP A 426 12.917 -11.682 -9.185 1.00 13.24 C ATOM 1427 CZ3 TRP A 426 13.837 -11.739 -6.930 1.00 15.04 C ATOM 1428 CH2 TRP A 426 13.454 -11.036 -8.096 1.00 12.32 C ATOM 1429 HA TRP A 426 15.324 -16.025 -7.475 1.00 0.00 H ATOM 1430 HB2 TRP A 426 12.596 -17.209 -7.712 1.00 0.00 H ATOM 1431 HB3 TRP A 426 12.917 -16.098 -6.361 1.00 0.00 H ATOM 1432 HE1 TRP A 426 11.988 -13.729 -10.995 1.00 0.00 H ATOM 1433 HD1 TRP A 426 12.126 -16.150 -10.043 1.00 0.00 H ATOM 1434 HZ2 TRP A 426 12.585 -11.130 -10.064 1.00 0.00 H ATOM 1435 HH2 TRP A 426 13.588 -9.955 -8.132 1.00 0.00 H ATOM 1436 HZ3 TRP A 426 14.213 -11.184 -6.071 1.00 0.00 H ATOM 1437 HE3 TRP A 426 14.055 -13.692 -5.964 1.00 0.00 H ATOM 1438 H TRP A 426 14.171 -18.176 -8.999 1.00 0.00 H ATOM 1439 N HIS A 427 14.544 -18.721 -5.715 1.00 10.91 N ATOM 1440 CA HIS A 427 14.702 -19.376 -4.430 1.00 11.85 C ATOM 1441 C HIS A 427 16.191 -19.408 -4.025 1.00 11.59 C ATOM 1442 O HIS A 427 16.569 -19.051 -2.914 1.00 11.21 O ATOM 1443 CB HIS A 427 14.099 -20.796 -4.531 1.00 10.13 C ATOM 1444 CG HIS A 427 13.849 -21.442 -3.203 1.00 14.33 C ATOM 1445 ND1 HIS A 427 14.193 -20.860 -2.002 1.00 16.00 N ATOM 1446 CD2 HIS A 427 13.285 -22.636 -2.889 1.00 15.61 C ATOM 1447 CE1 HIS A 427 13.832 -21.651 -1.005 1.00 12.02 C ATOM 1448 NE2 HIS A 427 13.310 -22.749 -1.518 1.00 18.70 N ATOM 1449 HA HIS A 427 14.175 -18.824 -3.651 1.00 0.00 H ATOM 1450 HB2 HIS A 427 13.151 -20.730 -5.065 1.00 0.00 H ATOM 1451 HB3 HIS A 427 14.789 -21.424 -5.094 1.00 0.00 H ATOM 1452 HD2 HIS A 427 12.887 -23.368 -3.591 1.00 0.00 H ATOM 1453 HE1 HIS A 427 13.946 -21.433 0.057 1.00 0.00 H ATOM 1454 H HIS A 427 14.104 -19.248 -6.496 1.00 0.00 H ATOM 1455 N ARG A 428 17.029 -19.777 -4.982 1.00 11.95 N ATOM 1456 CA ARG A 428 18.472 -19.862 -4.767 1.00 12.85 C ATOM 1457 C ARG A 428 19.091 -18.498 -4.531 1.00 11.91 C ATOM 1458 O ARG A 428 19.970 -18.379 -3.698 1.00 11.30 O ATOM 1459 CB ARG A 428 19.150 -20.525 -5.967 1.00 12.24 C ATOM 1460 CG ARG A 428 18.796 -21.995 -6.079 1.00 14.79 C ATOM 1461 CD ARG A 428 19.660 -22.731 -7.099 1.00 20.18 C ATOM 1462 NE ARG A 428 19.250 -24.146 -7.094 1.00 28.34 N ATOM 1463 CZ ARG A 428 19.778 -25.091 -7.874 1.00 32.08 C ATOM 1464 NH1 ARG A 428 20.757 -24.781 -8.727 1.00 33.62 N ATOM 1465 NH2 ARG A 428 19.340 -26.346 -7.785 1.00 31.63 N ATOM 1466 HA ARG A 428 18.629 -20.466 -3.873 1.00 0.00 H ATOM 1467 HB2 ARG A 428 18.832 -20.016 -6.877 1.00 0.00 H ATOM 1468 HB3 ARG A 428 20.230 -20.430 -5.858 1.00 0.00 H ATOM 1469 HG2 ARG A 428 18.932 -22.462 -5.104 1.00 0.00 H ATOM 1470 HG3 ARG A 428 17.752 -22.081 -6.379 1.00 0.00 H ATOM 1471 HD2 ARG A 428 20.712 -22.648 -6.824 1.00 0.00 H ATOM 1472 HD3 ARG A 428 19.510 -22.304 -8.091 1.00 0.00 H ATOM 1473 HE ARG A 428 18.496 -24.428 -6.436 1.00 0.00 H ATOM 1474 HH12 ARG A 428 21.169 -25.517 -9.335 1.00 0.00 H ATOM 1475 HH11 ARG A 428 21.108 -23.803 -8.783 1.00 0.00 H ATOM 1476 HH22 ARG A 428 19.750 -27.084 -8.392 1.00 0.00 H ATOM 1477 HH21 ARG A 428 18.588 -26.588 -7.109 1.00 0.00 H ATOM 1478 H ARG A 428 16.647 -20.015 -5.920 1.00 0.00 H ATOM 1479 N ALA A 429 18.613 -17.483 -5.241 1.00 11.74 N ATOM 1480 CA ALA A 429 19.161 -16.134 -5.107 1.00 12.28 C ATOM 1481 C ALA A 429 18.776 -15.585 -3.714 1.00 12.13 C ATOM 1482 O ALA A 429 19.584 -14.962 -3.022 1.00 11.54 O ATOM 1483 CB ALA A 429 18.612 -15.237 -6.182 1.00 11.70 C ATOM 1484 HA ALA A 429 20.246 -16.166 -5.211 1.00 0.00 H ATOM 1485 HB1 ALA A 429 18.883 -15.636 -7.160 1.00 0.00 H ATOM 1486 HB2 ALA A 429 17.526 -15.190 -6.095 1.00 0.00 H ATOM 1487 HB3 ALA A 429 19.030 -14.237 -6.068 1.00 0.00 H ATOM 1488 H ALA A 429 17.832 -17.651 -5.907 1.00 0.00 H ATOM 1489 N LEU A 430 17.517 -15.798 -3.341 1.00 10.87 N ATOM 1490 CA LEU A 430 17.033 -15.351 -2.033 1.00 10.19 C ATOM 1491 C LEU A 430 17.767 -16.058 -0.913 1.00 11.02 C ATOM 1492 O LEU A 430 18.191 -15.417 0.049 1.00 11.29 O ATOM 1493 CB LEU A 430 15.534 -15.627 -1.920 1.00 9.78 C ATOM 1494 CG LEU A 430 14.713 -14.638 -2.753 1.00 8.71 C ATOM 1495 CD1 LEU A 430 13.328 -15.260 -2.981 1.00 12.40 C ATOM 1496 CD2 LEU A 430 14.598 -13.304 -1.987 1.00 9.93 C ATOM 1497 HA LEU A 430 17.219 -14.281 -1.944 1.00 0.00 H ATOM 1498 HB2 LEU A 430 15.333 -16.639 -2.272 1.00 0.00 H ATOM 1499 HB3 LEU A 430 15.236 -15.542 -0.875 1.00 0.00 H ATOM 1500 HG LEU A 430 15.188 -14.438 -3.714 1.00 0.00 H ATOM 1501 HD21 LEU A 430 14.104 -13.477 -1.031 1.00 0.00 H ATOM 1502 HD22 LEU A 430 15.595 -12.899 -1.814 1.00 0.00 H ATOM 1503 HD23 LEU A 430 14.014 -12.597 -2.577 1.00 0.00 H ATOM 1504 HD11 LEU A 430 13.439 -16.205 -3.513 1.00 0.00 H ATOM 1505 HD12 LEU A 430 12.848 -15.437 -2.019 1.00 0.00 H ATOM 1506 HD13 LEU A 430 12.718 -14.578 -3.573 1.00 0.00 H ATOM 1507 H LEU A 430 16.867 -16.289 -3.988 1.00 0.00 H ATOM 1508 N ARG A 431 17.965 -17.373 -1.044 1.00 10.75 N ATOM 1509 CA ARG A 431 18.777 -18.110 -0.061 1.00 12.10 C ATOM 1510 C ARG A 431 20.168 -17.511 0.113 1.00 12.29 C ATOM 1511 O ARG A 431 20.656 -17.346 1.229 1.00 13.03 O ATOM 1512 CB ARG A 431 18.994 -19.579 -0.486 1.00 12.73 C ATOM 1513 CG ARG A 431 17.888 -20.495 -0.078 1.00 16.10 C ATOM 1514 CD ARG A 431 18.163 -21.845 -0.698 1.00 19.71 C ATOM 1515 NE ARG A 431 17.131 -22.834 -0.378 1.00 18.35 N ATOM 1516 CZ ARG A 431 16.873 -23.879 -1.174 1.00 20.08 C ATOM 1517 NH1 ARG A 431 17.565 -24.005 -2.306 1.00 22.39 N ATOM 1518 NH2 ARG A 431 15.924 -24.788 -0.851 1.00 16.37 N ATOM 1519 HA ARG A 431 18.214 -18.045 0.870 1.00 0.00 H ATOM 1520 HB2 ARG A 431 19.086 -19.613 -1.572 1.00 0.00 H ATOM 1521 HB3 ARG A 431 19.920 -19.935 -0.033 1.00 0.00 H ATOM 1522 HG2 ARG A 431 17.859 -20.583 1.008 1.00 0.00 H ATOM 1523 HG3 ARG A 431 16.934 -20.109 -0.436 1.00 0.00 H ATOM 1524 HD2 ARG A 431 19.122 -22.209 -0.330 1.00 0.00 H ATOM 1525 HD3 ARG A 431 18.211 -21.729 -1.781 1.00 0.00 H ATOM 1526 HE ARG A 431 16.580 -22.721 0.497 1.00 0.00 H ATOM 1527 HH12 ARG A 431 17.382 -24.809 -2.940 1.00 0.00 H ATOM 1528 HH11 ARG A 431 18.288 -23.300 -2.555 1.00 0.00 H ATOM 1529 HH22 ARG A 431 15.739 -25.593 -1.483 1.00 0.00 H ATOM 1530 HH21 ARG A 431 15.380 -24.682 0.029 1.00 0.00 H ATOM 1531 H ARG A 431 17.542 -17.880 -1.847 1.00 0.00 H ATOM 1532 N THR A 432 20.791 -17.218 -1.014 1.00 12.38 N ATOM 1533 CA THR A 432 22.169 -16.678 -1.025 1.00 13.69 C ATOM 1534 C THR A 432 22.246 -15.347 -0.292 1.00 13.08 C ATOM 1535 O THR A 432 23.146 -15.133 0.510 1.00 11.64 O ATOM 1536 CB THR A 432 22.658 -16.518 -2.477 1.00 13.91 C ATOM 1537 OG1 THR A 432 22.716 -17.818 -3.082 1.00 14.87 O ATOM 1538 CG2 THR A 432 24.051 -15.877 -2.565 1.00 14.03 C ATOM 1539 HA THR A 432 22.816 -17.384 -0.504 1.00 0.00 H ATOM 1540 HB THR A 432 21.958 -15.860 -2.992 1.00 0.00 H ATOM 1541 HG1 THR A 432 21.814 -18.226 -3.071 1.00 0.00 H ATOM 1542 HG23 THR A 432 24.024 -14.887 -2.109 1.00 0.00 H ATOM 1543 HG21 THR A 432 24.771 -16.502 -2.037 1.00 0.00 H ATOM 1544 HG22 THR A 432 24.343 -15.788 -3.611 1.00 0.00 H ATOM 1545 H THR A 432 20.300 -17.371 -1.918 1.00 0.00 H ATOM 1546 N VAL A 433 21.306 -14.452 -0.576 1.00 13.04 N ATOM 1547 CA VAL A 433 21.353 -13.105 0.030 1.00 13.97 C ATOM 1548 C VAL A 433 21.070 -13.238 1.545 1.00 13.87 C ATOM 1549 O VAL A 433 21.768 -12.654 2.366 1.00 14.59 O ATOM 1550 CB VAL A 433 20.363 -12.133 -0.672 1.00 13.10 C ATOM 1551 CG1 VAL A 433 20.044 -10.888 0.216 1.00 12.73 C ATOM 1552 CG2 VAL A 433 20.880 -11.733 -2.063 1.00 13.62 C ATOM 1553 HA VAL A 433 22.344 -12.672 -0.107 1.00 0.00 H ATOM 1554 HB VAL A 433 19.421 -12.663 -0.813 1.00 0.00 H ATOM 1555 HG11 VAL A 433 19.595 -11.217 1.153 1.00 0.00 H ATOM 1556 HG12 VAL A 433 20.966 -10.346 0.425 1.00 0.00 H ATOM 1557 HG13 VAL A 433 19.349 -10.235 -0.312 1.00 0.00 H ATOM 1558 HG21 VAL A 433 21.846 -11.238 -1.962 1.00 0.00 H ATOM 1559 HG22 VAL A 433 20.991 -12.626 -2.678 1.00 0.00 H ATOM 1560 HG23 VAL A 433 20.169 -11.053 -2.532 1.00 0.00 H ATOM 1561 H VAL A 433 20.534 -14.700 -1.227 1.00 0.00 H ATOM 1562 N ILE A 434 20.023 -13.988 1.913 1.00 13.34 N ATOM 1563 CA ILE A 434 19.654 -14.205 3.323 1.00 12.98 C ATOM 1564 C ILE A 434 20.768 -14.851 4.163 1.00 14.50 C ATOM 1565 O ILE A 434 21.146 -14.342 5.230 1.00 15.23 O ATOM 1566 CB ILE A 434 18.303 -14.972 3.475 1.00 11.80 C ATOM 1567 CG1 ILE A 434 17.168 -14.058 3.038 1.00 11.14 C ATOM 1568 CG2 ILE A 434 18.102 -15.409 4.955 1.00 14.17 C ATOM 1569 CD1 ILE A 434 15.812 -14.788 2.796 1.00 11.09 C ATOM 1570 HA ILE A 434 19.511 -13.205 3.733 1.00 0.00 H ATOM 1571 HB ILE A 434 18.314 -15.866 2.851 1.00 0.00 H ATOM 1572 HG12 ILE A 434 17.018 -13.306 3.813 1.00 0.00 H ATOM 1573 HG13 ILE A 434 17.462 -13.568 2.110 1.00 0.00 H ATOM 1574 HD11 ILE A 434 15.938 -15.536 2.014 1.00 0.00 H ATOM 1575 HD12 ILE A 434 15.493 -15.274 3.718 1.00 0.00 H ATOM 1576 HD13 ILE A 434 15.060 -14.062 2.488 1.00 0.00 H ATOM 1577 HG21 ILE A 434 18.921 -16.063 5.254 1.00 0.00 H ATOM 1578 HG22 ILE A 434 18.088 -14.526 5.594 1.00 0.00 H ATOM 1579 HG23 ILE A 434 17.157 -15.943 5.050 1.00 0.00 H ATOM 1580 H ILE A 434 19.446 -14.436 1.173 1.00 0.00 H ATOM 1581 N GLU A 435 21.341 -15.942 3.653 1.00 14.19 N ATOM 1582 CA GLU A 435 22.479 -16.540 4.332 1.00 16.38 C ATOM 1583 C GLU A 435 23.704 -15.623 4.424 1.00 14.92 C ATOM 1584 O GLU A 435 24.399 -15.619 5.453 1.00 17.10 O ATOM 1585 CB GLU A 435 22.863 -17.857 3.667 1.00 15.31 C ATOM 1586 CG GLU A 435 23.809 -18.723 4.499 1.00 19.88 C ATOM 1587 CD GLU A 435 25.243 -18.308 4.328 1.00 23.00 C ATOM 1588 OE1 GLU A 435 26.012 -18.474 5.306 1.00 25.74 O ATOM 1589 OE2 GLU A 435 25.603 -17.778 3.237 1.00 23.37 O ATOM 1590 HA GLU A 435 22.153 -16.717 5.357 1.00 0.00 H ATOM 1591 HB2 GLU A 435 21.952 -18.426 3.481 1.00 0.00 H ATOM 1592 HB3 GLU A 435 23.349 -17.633 2.718 1.00 0.00 H ATOM 1593 HG2 GLU A 435 23.538 -18.631 5.551 1.00 0.00 H ATOM 1594 HG3 GLU A 435 23.703 -19.762 4.187 1.00 0.00 H ATOM 1595 H GLU A 435 20.976 -16.363 2.775 1.00 0.00 H ATOM 1596 N ARG A 436 23.985 -14.855 3.381 1.00 15.48 N ATOM 1597 CA ARG A 436 25.104 -13.917 3.429 1.00 16.38 C ATOM 1598 C ARG A 436 24.993 -12.923 4.588 1.00 18.25 C ATOM 1599 O ARG A 436 26.002 -12.597 5.234 1.00 18.18 O ATOM 1600 CB ARG A 436 25.238 -13.171 2.108 1.00 17.43 C ATOM 1601 CG ARG A 436 26.592 -12.472 1.917 1.00 17.48 C ATOM 1602 CD ARG A 436 26.619 -11.932 0.521 1.00 22.54 C ATOM 1603 NE ARG A 436 26.980 -13.004 -0.390 1.00 24.07 N ATOM 1604 CZ ARG A 436 26.517 -13.161 -1.626 1.00 25.99 C ATOM 1605 NH1 ARG A 436 25.596 -12.346 -2.131 1.00 27.23 N ATOM 1606 NH2 ARG A 436 26.975 -14.159 -2.354 1.00 22.63 N ATOM 1607 HA ARG A 436 26.001 -14.511 3.600 1.00 0.00 H ATOM 1608 HB2 ARG A 436 25.104 -13.886 1.296 1.00 0.00 H ATOM 1609 HB3 ARG A 436 24.453 -12.416 2.060 1.00 0.00 H ATOM 1610 HG2 ARG A 436 26.697 -11.658 2.635 1.00 0.00 H ATOM 1611 HG3 ARG A 436 27.404 -13.185 2.057 1.00 0.00 H ATOM 1612 HD2 ARG A 436 27.354 -11.130 0.453 1.00 0.00 H ATOM 1613 HD3 ARG A 436 25.635 -11.544 0.259 1.00 0.00 H ATOM 1614 HE ARG A 436 27.660 -13.711 -0.045 1.00 0.00 H ATOM 1615 HH12 ARG A 436 25.250 -12.490 -3.101 1.00 0.00 H ATOM 1616 HH11 ARG A 436 25.222 -11.564 -1.556 1.00 0.00 H ATOM 1617 HH22 ARG A 436 26.625 -14.299 -3.323 1.00 0.00 H ATOM 1618 HH21 ARG A 436 27.686 -14.807 -1.959 1.00 0.00 H ATOM 1619 H ARG A 436 23.404 -14.921 2.521 1.00 0.00 H ATOM 1620 N LEU A 437 23.770 -12.414 4.821 1.00 17.90 N ATOM 1621 CA LEU A 437 23.469 -11.529 5.954 1.00 19.61 C ATOM 1622 C LEU A 437 23.674 -12.182 7.329 1.00 21.10 C ATOM 1623 O LEU A 437 23.771 -11.494 8.356 1.00 22.18 O ATOM 1624 CB LEU A 437 22.026 -11.020 5.814 1.00 18.51 C ATOM 1625 CG LEU A 437 21.840 -10.172 4.552 1.00 18.24 C ATOM 1626 CD1 LEU A 437 20.338 -9.871 4.259 1.00 16.53 C ATOM 1627 CD2 LEU A 437 22.677 -8.882 4.589 1.00 17.65 C ATOM 1628 HA LEU A 437 24.181 -10.704 5.915 1.00 0.00 H ATOM 1629 HB2 LEU A 437 21.353 -11.876 5.766 1.00 0.00 H ATOM 1630 HB3 LEU A 437 21.780 -10.414 6.686 1.00 0.00 H ATOM 1631 HG LEU A 437 22.214 -10.773 3.723 1.00 0.00 H ATOM 1632 HD21 LEU A 437 22.378 -8.281 5.448 1.00 0.00 H ATOM 1633 HD22 LEU A 437 23.733 -9.138 4.673 1.00 0.00 H ATOM 1634 HD23 LEU A 437 22.510 -8.316 3.673 1.00 0.00 H ATOM 1635 HD11 LEU A 437 19.801 -10.809 4.119 1.00 0.00 H ATOM 1636 HD12 LEU A 437 19.907 -9.327 5.099 1.00 0.00 H ATOM 1637 HD13 LEU A 437 20.259 -9.267 3.355 1.00 0.00 H ATOM 1638 H LEU A 437 23.000 -12.659 4.167 1.00 0.00 H ATOM 1639 N VAL A 438 23.697 -13.511 7.357 1.00 22.27 N ATOM 1640 CA VAL A 438 23.989 -14.240 8.590 1.00 24.24 C ATOM 1641 C VAL A 438 25.485 -14.144 8.924 1.00 25.58 C ATOM 1642 O VAL A 438 25.855 -14.009 10.080 1.00 24.32 O ATOM 1643 CB VAL A 438 23.513 -15.713 8.538 1.00 23.90 C ATOM 1644 CG1 VAL A 438 23.902 -16.465 9.797 1.00 26.25 C ATOM 1645 CG2 VAL A 438 21.994 -15.786 8.348 1.00 23.76 C ATOM 1646 HA VAL A 438 23.422 -13.766 9.391 1.00 0.00 H ATOM 1647 HB VAL A 438 24.005 -16.183 7.686 1.00 0.00 H ATOM 1648 HG11 VAL A 438 24.987 -16.455 9.904 1.00 0.00 H ATOM 1649 HG12 VAL A 438 23.446 -15.984 10.662 1.00 0.00 H ATOM 1650 HG13 VAL A 438 23.552 -17.495 9.726 1.00 0.00 H ATOM 1651 HG21 VAL A 438 21.500 -15.285 9.181 1.00 0.00 H ATOM 1652 HG22 VAL A 438 21.722 -15.294 7.414 1.00 0.00 H ATOM 1653 HG23 VAL A 438 21.683 -16.830 8.314 1.00 0.00 H ATOM 1654 H VAL A 438 23.503 -14.043 6.484 1.00 0.00 H ATOM 1655 N ARG A 439 26.360 -14.189 7.927 1.00 27.70 N ATOM 1656 CA ARG A 439 27.777 -14.073 8.285 1.00 29.33 C ATOM 1657 C ARG A 439 28.432 -12.706 8.052 1.00 30.30 C ATOM 1658 O ARG A 439 29.421 -12.386 8.724 1.00 30.75 O ATOM 1659 CB ARG A 439 28.605 -15.281 7.813 1.00 30.12 C ATOM 1660 CG ARG A 439 28.844 -15.372 6.374 1.00 29.19 C ATOM 1661 CD ARG A 439 28.929 -16.837 5.846 1.00 27.27 C ATOM 1662 NE ARG A 439 28.269 -16.783 4.555 1.00 24.35 N ATOM 1663 CZ ARG A 439 28.792 -16.249 3.451 1.00 23.21 C ATOM 1664 NH1 ARG A 439 30.066 -15.843 3.425 1.00 23.65 N ATOM 1665 NH2 ARG A 439 28.038 -16.159 2.357 1.00 18.85 N ATOM 1666 HA ARG A 439 27.779 -14.115 9.374 1.00 0.00 H ATOM 1667 HB2 ARG A 439 29.574 -15.236 8.310 1.00 0.00 H ATOM 1668 HB3 ARG A 439 28.081 -16.186 8.122 1.00 0.00 H ATOM 1669 HG2 ARG A 439 28.029 -14.866 5.856 1.00 0.00 H ATOM 1670 HG3 ARG A 439 29.784 -14.869 6.148 1.00 0.00 H ATOM 1671 HD2 ARG A 439 28.412 -17.522 6.518 1.00 0.00 H ATOM 1672 HD3 ARG A 439 29.967 -17.151 5.738 1.00 0.00 H ATOM 1673 HE ARG A 439 27.315 -17.192 4.486 1.00 0.00 H ATOM 1674 HH12 ARG A 439 30.462 -15.428 2.557 1.00 0.00 H ATOM 1675 HH11 ARG A 439 30.661 -15.942 4.272 1.00 0.00 H ATOM 1676 HH22 ARG A 439 28.431 -15.745 1.487 1.00 0.00 H ATOM 1677 HH21 ARG A 439 27.057 -16.503 2.372 1.00 0.00 H ATOM 1678 H ARG A 439 26.055 -14.301 6.939 1.00 0.00 H ATOM 1679 N TRP A 440 27.851 -11.892 7.160 1.00 30.77 N ATOM 1680 CA TRP A 440 28.307 -10.512 6.885 1.00 31.81 C ATOM 1681 C TRP A 440 27.126 -9.529 6.805 1.00 33.00 C ATOM 1682 O TRP A 440 26.443 -9.285 7.796 1.00 34.50 O ATOM 1683 CB TRP A 440 29.103 -10.424 5.574 1.00 31.85 C ATOM 1684 CG TRP A 440 30.219 -11.414 5.455 1.00 32.05 C ATOM 1685 CD1 TRP A 440 30.249 -12.519 4.650 1.00 31.20 C ATOM 1686 CD2 TRP A 440 31.460 -11.401 6.166 1.00 33.06 C ATOM 1687 NE1 TRP A 440 31.430 -13.189 4.813 1.00 29.12 N ATOM 1688 CE2 TRP A 440 32.197 -12.525 5.734 1.00 30.71 C ATOM 1689 CE3 TRP A 440 32.033 -10.537 7.119 1.00 32.45 C ATOM 1690 CZ2 TRP A 440 33.476 -12.817 6.227 1.00 30.60 C ATOM 1691 CZ3 TRP A 440 33.307 -10.826 7.594 1.00 32.70 C ATOM 1692 CH2 TRP A 440 34.007 -11.961 7.153 1.00 31.53 C ATOM 1693 HA TRP A 440 28.953 -10.238 7.719 1.00 0.00 H ATOM 1694 HB2 TRP A 440 28.414 -10.587 4.746 1.00 0.00 H ATOM 1695 HB3 TRP A 440 29.527 -9.423 5.500 1.00 0.00 H ATOM 1696 HE1 TRP A 440 31.702 -14.062 4.318 1.00 0.00 H ATOM 1697 HD1 TRP A 440 29.448 -12.822 3.976 1.00 0.00 H ATOM 1698 HZ2 TRP A 440 34.027 -13.693 5.886 1.00 0.00 H ATOM 1699 HH2 TRP A 440 34.998 -12.165 7.559 1.00 0.00 H ATOM 1700 HZ3 TRP A 440 33.771 -10.160 8.322 1.00 0.00 H ATOM 1701 HE3 TRP A 440 31.490 -9.662 7.476 1.00 0.00 H ATOM 1702 H TRP A 440 27.032 -12.252 6.630 1.00 0.00 H TER 1703 TRP A 440 HETATM 1704 O HOH 1 -6.352 -16.237 3.454 1.00 25.62 O HETATM 1705 O HOH 2 13.880 -10.022 8.305 1.00 15.77 O HETATM 1706 O HOH 3 8.105 -23.733 -3.981 1.00 14.67 O HETATM 1707 O HOH 4 9.291 -18.855 5.977 1.00 13.90 O HETATM 1708 O HOH 5 15.669 -20.937 3.351 1.00 19.57 O HETATM 1709 O HOH 6 5.946 -26.159 1.820 1.00 11.71 O HETATM 1710 O HOH 7 4.010 -16.348 -13.416 1.00 27.18 O HETATM 1711 O HOH 8 11.681 -25.022 2.669 1.00 15.36 O HETATM 1712 O HOH 9 -5.072 -21.546 -7.534 1.00 27.04 O HETATM 1713 O HOH 10 25.175 -16.965 0.707 1.00 13.17 O HETATM 1714 O HOH 11 -0.792 -22.115 -10.133 1.00 20.89 O HETATM 1715 O HOH 12 12.270 -13.739 10.478 1.00 23.13 O HETATM 1716 O HOH 13 0.205 -26.192 -2.923 1.00 23.23 O HETATM 1717 O HOH 14 15.553 -18.531 5.979 1.00 23.80 O HETATM 1718 O HOH 15 14.942 -22.297 1.533 1.00 20.48 O HETATM 1719 O HOH 16 -2.656 -8.845 1.211 1.00 19.13 O HETATM 1720 O HOH 17 6.502 -21.765 5.808 1.00 21.89 O HETATM 1721 O HOH 18 -0.054 -7.893 -4.421 1.00 32.20 O HETATM 1722 O HOH 19 -7.347 -14.529 1.685 1.00 24.58 O HETATM 1723 O HOH 20 1.070 -15.459 -13.875 1.00 29.11 O HETATM 1724 O HOH 21 19.620 -17.921 -8.822 1.00 16.74 O HETATM 1725 O HOH 22 19.873 -13.413 7.439 1.00 20.62 O HETATM 1726 O HOH 23 6.948 -24.591 -15.103 1.00 32.20 O HETATM 1727 O HOH 24 8.566 -12.861 12.449 1.00 25.41 O HETATM 1728 O HOH 25 15.404 -16.660 -13.602 1.00 28.10 O HETATM 1729 O HOH 26 -4.739 -18.061 -6.563 1.00 22.94 O HETATM 1730 O HOH 27 -8.110 -13.104 -1.726 1.00 17.20 O HETATM 1731 O HOH 28 10.241 -6.404 7.079 1.00 29.17 O HETATM 1732 O HOH 29 15.296 -12.569 -13.120 1.00 29.20 O HETATM 1733 O HOH 30 27.885 -17.399 -0.651 1.00 32.09 O HETATM 1734 O HOH 31 -6.472 -22.334 -1.316 1.00 24.87 O HETATM 1735 O HOH 32 10.916 -13.517 -12.383 1.00 25.04 O HETATM 1736 O HOH 33 -7.047 -8.152 5.508 1.00 26.52 O HETATM 1737 O HOH 34 13.374 -22.329 6.181 1.00 25.20 O HETATM 1738 O HOH 35 18.019 -15.528 8.301 1.00 20.59 O HETATM 1739 O HOH 36 4.128 -22.081 7.934 1.00 30.02 O HETATM 1740 O HOH 37 17.388 -25.627 -5.535 1.00 32.29 O HETATM 1741 O HOH 38 -5.928 -12.907 -3.962 1.00 26.84 O HETATM 1742 O HOH 39 8.033 -25.325 3.847 1.00 30.72 O HETATM 1743 O HOH 40 6.112 1.199 -7.610 1.00 23.65 O HETATM 1744 O HOH 41 4.391 -24.206 -4.192 1.00 27.21 O HETATM 1745 O HOH 42 -1.032 -8.404 -1.072 1.00 22.35 O HETATM 1746 O HOH 43 23.502 -10.453 1.293 1.00 29.15 O HETATM 1747 O HOH 44 12.843 -23.737 -5.315 1.00 25.52 O HETATM 1748 O HOH 45 19.118 -16.036 -10.911 1.00 30.49 O HETATM 1749 O HOH 46 10.525 -11.574 14.693 1.00 32.27 O HETATM 1750 O HOH 47 3.769 -22.334 -17.117 1.00 37.92 O HETATM 1751 O HOH 48 2.132 -5.887 15.210 1.00 33.85 O HETATM 1752 O HOH 49 20.849 -12.704 9.887 1.00 34.17 O HETATM 1753 O HOH 50 4.204 -12.862 11.292 1.00 30.42 O HETATM 1754 O HOH 51 24.515 -10.321 -1.387 1.00 30.62 O HETATM 1755 O HOH 52 24.160 -7.061 -4.230 1.00 32.63 O HETATM 1756 O HOH 53 -4.407 -15.031 4.731 1.00 39.43 O HETATM 1757 O HOH 54 1.770 -25.495 -4.390 1.00 30.69 O HETATM 1758 O HOH 55 18.070 -10.390 -12.822 1.00 28.58 O HETATM 1759 O HOH 56 8.224 -18.973 8.716 1.00 26.00 O HETATM 1760 O HOH 57 -2.794 -20.005 3.466 1.00 32.34 O HETATM 1761 O HOH 58 21.592 -13.745 -5.002 1.00 29.87 O HETATM 1762 O HOH 59 19.261 -2.245 -0.194 1.00 37.21 O HETATM 1763 O HOH 60 7.654 -0.724 2.911 1.00 33.72 O HETATM 1764 O HOH 61 1.740 -18.232 -17.275 1.00 30.00 O HETATM 1765 O HOH 62 -6.607 -7.555 -7.222 1.00 39.11 O HETATM 1766 O HOH 63 -8.265 -22.481 -5.096 1.00 29.28 O HETATM 1767 O HOH 64 7.387 -26.167 -5.324 1.00 40.60 O HETATM 1768 O HOH 65 10.125 -23.722 -16.120 1.00 38.43 O HETATM 1769 O HOH 66 17.065 -8.730 -14.581 1.00 37.79 O HETATM 1770 O HOH 67 0.612 -22.280 -12.480 1.00 37.78 O HETATM 1771 O HOH 68 21.681 -17.567 -7.536 1.00 33.68 O HETATM 1772 O HOH 69 19.621 -18.979 3.370 1.00 34.37 O HETATM 1773 O HOH 70 15.784 -0.434 -8.845 1.00 46.73 O HETATM 1774 O HOH 71 -7.612 -19.846 -5.167 1.00 33.76 O HETATM 1775 O HOH 72 2.209 -23.925 -13.140 1.00 42.85 O HETATM 1776 C1 I A 3 -9.073 -16.655 -0.578 1.00 0.15 C HETATM 1777 C2 I A 3 -8.713 -16.634 -2.040 1.00 0.12 C HETATM 1778 C3 I A 3 -7.213 -16.826 -2.207 1.00 0.12 C HETATM 1779 C4 I A 3 -6.807 -18.164 -1.516 1.00 0.15 C HETATM 1780 C5 I A 3 -7.231 -18.205 -0.053 1.00 0.15 C HETATM 1781 C6 I A 3 -8.753 -17.990 0.130 1.00 0.12 C HETATM 1782 O6 I A 3 -8.978 -17.755 1.509 1.00 -0.39 O HETATM 1783 H9 I A 3 -8.683 -18.507 2.009 1.00 0.21 H HETATM 1784 H6 I A 3 -9.347 -18.831 -0.257 1.00 0.07 H HETATM 1785 O5 I A 3 -6.864 -19.435 0.549 1.00 -0.27 O HETATM 1786 P5 I A 3 -6.213 -19.569 2.003 1.00 0.20 P HETATM 1787 O51 I A 3 -6.190 -21.069 2.161 1.00 -0.55 O HETATM 1788 O52 I A 3 -7.092 -18.859 2.983 1.00 -0.55 O HETATM 1789 O53 I A 3 -4.866 -18.900 1.917 1.00 -0.55 O HETATM 1790 H5 I A 3 -6.706 -17.392 0.470 1.00 0.07 H HETATM 1791 O4 I A 3 -5.361 -18.337 -1.624 1.00 -0.27 O HETATM 1792 P4 I A 3 -4.601 -19.152 -2.768 1.00 0.20 P HETATM 1793 O41 I A 3 -4.883 -20.617 -2.671 1.00 -0.55 O HETATM 1794 O42 I A 3 -5.041 -18.630 -4.103 1.00 -0.55 O HETATM 1795 O43 I A 3 -3.161 -18.810 -2.450 1.00 -0.55 O HETATM 1796 H4 I A 3 -7.304 -18.992 -2.042 1.00 0.07 H HETATM 1797 O3 I A 3 -6.917 -16.939 -3.607 1.00 -0.39 O HETATM 1798 H8 I A 3 -5.987 -17.098 -3.721 1.00 0.21 H HETATM 1799 H3 I A 3 -6.666 -15.981 -1.764 1.00 0.07 H HETATM 1800 O2 I A 3 -9.458 -17.661 -2.734 1.00 -0.39 O HETATM 1801 H7 I A 3 -10.388 -17.514 -2.611 1.00 0.21 H HETATM 1802 H2 I A 3 -8.989 -15.656 -2.461 1.00 0.07 H HETATM 1803 O1 I A 3 -10.451 -16.327 -0.567 1.00 -0.27 O HETATM 1804 P1 I A 3 -10.950 -14.855 -0.150 1.00 0.20 P HETATM 1805 O11 I A 3 -10.410 -14.433 1.160 1.00 -0.55 O HETATM 1806 O12 I A 3 -12.477 -15.082 0.003 1.00 -0.55 O HETATM 1807 O13 I A 3 -10.615 -14.091 -1.403 1.00 -0.55 O HETATM 1808 H1 I A 3 -8.509 -15.867 -0.057 1.00 0.07 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 670 671 693 694 695 CONECT 693 670 CONECT 694 670 CONECT 695 670 CONECT 1776 1777 1781 1803 1808 CONECT 1777 1776 1778 1800 1802 CONECT 1778 1777 1779 1797 1799 CONECT 1779 1778 1780 1791 1796 CONECT 1780 1779 1781 1785 1790 CONECT 1781 1776 1780 1782 1784 CONECT 1782 1781 1783 CONECT 1783 1782 CONECT 1784 1781 CONECT 1785 1780 1786 CONECT 1786 1785 1787 1788 1789 CONECT 1787 1786 CONECT 1788 1786 CONECT 1789 1786 CONECT 1790 1780 CONECT 1791 1779 1792 CONECT 1792 1791 1793 1794 1795 CONECT 1793 1792 CONECT 1794 1792 CONECT 1795 1792 CONECT 1796 1779 CONECT 1797 1778 1798 CONECT 1798 1797 CONECT 1799 1778 CONECT 1800 1777 1801 CONECT 1801 1800 CONECT 1802 1777 CONECT 1803 1776 1804 CONECT 1804 1803 1805 1806 1807 CONECT 1805 1804 CONECT 1806 1804 CONECT 1807 1804 CONECT 1808 1776 MASTER 0 0 0 0 0 0 0 0 1806 2 41 9 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 2p0d
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1btn
RCSB PDB
PDBbind
I3P
1h0a
RCSB PDB
PDBbind
I3P
1mai
RCSB PDB
PDBbind
I3P
1n4k
RCSB PDB
PDBbind
I3P
3t8s
RCSB PDB
PDBbind
I3P
4np9
RCSB PDB
PDBbind
I3P
5hjq
RCSB PDB
PDBbind
I3P
6cv8
RCSB PDB
PDBbind
I3P
Entry Information
PDB ID
2p0d
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Rho GTPase-activating protein 9
Ligand Name
I3P
EC.Number
E.C.-.-.-.-
Resolution
1.81(Å)
Affinity (Kd/Ki/IC50)
Kd=0.1uM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
J.Biol.Chem. 282: 13864-13874
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
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