Browse entries in the PDBbind-CN Database
HEADER 5C1X_COMPLEX COMPND 5C1X_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 181 MET GLY PRO SER LEU ASP PHE ALA LEU SER LEU LEU ARG SEQRES 2 A 181 ARG ASN VAL ARG GLN VAL GLN THR ASP GLN GLY HIS PHE SEQRES 3 A 181 THR MET LEU GLY VAL ARG ASP ARG LEU ALA VAL LEU PRO SEQRES 4 A 181 ARG HIS SER GLN PRO GLY LYS THR ILE TRP ILE GLU HIS SEQRES 5 A 181 LYS LEU VAL ASN ILE LEU ASP ALA VAL GLU LEU VAL ASP SEQRES 6 A 181 GLU GLN GLY VAL ASN LEU GLU LEU THR LEU ILE THR LEU SEQRES 7 A 181 ASP THR ASN GLU LYS PHE ARG ASP ILE THR LYS PHE ILE SEQRES 8 A 181 PRO GLU ASN ILE SER THR ALA SER ASP ALA THR LEU VAL SEQRES 9 A 181 ILE ASN THR GLU HIS MET PRO SER MET PHE VAL PRO VAL SEQRES 10 A 181 GLY ASP VAL VAL GLN TYR GLY PHE LEU ASN LEU SER GLY SEQRES 11 A 181 LYS PRO THR HIS ARG THR MET MET TYR ASN PHE PRO THR SEQRES 12 A 181 LYS ALA GLY GLN CYS GLY GLY VAL VAL THR SER VAL GLY SEQRES 13 A 181 LYS VAL ILE GLY ILE HIS ILE GLY GLY ASN GLY ARG GLN SEQRES 14 A 181 GLY PHE CYS ALA GLY LEU LYS ARG SER TYR PHE ALA HET GHX A 299 61 ATOM 1 N MET A 0 -0.055 -17.125 11.655 1.00 54.22 N ATOM 2 CA MET A 0 0.685 -16.885 12.924 1.00 47.82 C ATOM 3 C MET A 0 -0.195 -16.326 14.005 1.00 41.52 C ATOM 4 O MET A 0 -1.012 -15.428 13.782 1.00 42.12 O ATOM 5 CB MET A 0 1.791 -15.898 12.700 1.00 48.42 C ATOM 6 CG MET A 0 2.592 -15.587 13.950 1.00 44.79 C ATOM 7 SD MET A 0 3.845 -14.461 13.449 1.00 47.54 S ATOM 8 CE MET A 0 4.721 -15.448 12.243 1.00 48.45 C ATOM 9 HN3 MET A 0 -0.454 -16.228 11.313 1.00 0.00 H ATOM 10 HN2 MET A 0 -0.824 -17.804 11.827 1.00 0.00 H ATOM 11 HN1 MET A 0 0.597 -17.510 10.942 1.00 0.00 H ATOM 12 N GLY A 1 0.039 -16.827 15.203 1.00 33.88 N ATOM 13 CA GLY A 1 -0.692 -16.377 16.356 1.00 30.83 C ATOM 14 C GLY A 1 -0.253 -15.008 16.928 1.00 31.47 C ATOM 15 O GLY A 1 0.711 -14.376 16.487 1.00 30.44 O ATOM 16 H GLY A 1 0.766 -17.562 15.315 1.00 0.00 H ATOM 17 N PRO A 2 -0.939 -14.579 17.955 1.00 31.65 N ATOM 18 CA PRO A 2 -0.750 -13.229 18.449 1.00 32.34 C ATOM 19 C PRO A 2 0.464 -12.978 19.286 1.00 29.06 C ATOM 20 O PRO A 2 1.017 -11.884 19.184 1.00 27.44 O ATOM 21 CB PRO A 2 -1.958 -13.031 19.360 1.00 30.92 C ATOM 22 CG PRO A 2 -2.335 -14.429 19.790 1.00 26.74 C ATOM 23 CD PRO A 2 -2.140 -15.203 18.529 1.00 30.01 C ATOM 24 N SER A 3 0.837 -13.930 20.146 1.00 26.15 N ATOM 25 CA SER A 3 1.968 -13.736 21.022 1.00 25.23 C ATOM 26 C SER A 3 3.243 -13.787 20.223 1.00 21.97 C ATOM 27 O SER A 3 4.138 -12.998 20.424 1.00 18.64 O ATOM 28 CB SER A 3 2.052 -14.781 22.126 1.00 29.77 C ATOM 29 OG SER A 3 1.011 -14.601 23.032 1.00 30.90 O ATOM 30 HG SER A 3 1.074 -15.284 23.745 1.00 0.00 H ATOM 31 H SER A 3 0.305 -14.823 20.185 1.00 0.00 H ATOM 32 N LEU A 4 3.291 -14.713 19.277 1.00 22.44 N ATOM 33 CA LEU A 4 4.450 -14.810 18.394 1.00 20.38 C ATOM 34 C LEU A 4 4.554 -13.553 17.526 1.00 23.02 C ATOM 35 O LEU A 4 5.646 -12.984 17.317 1.00 20.09 O ATOM 36 CB LEU A 4 4.364 -16.057 17.515 1.00 21.56 C ATOM 37 CG LEU A 4 5.573 -16.283 16.643 1.00 21.82 C ATOM 38 CD1 LEU A 4 6.869 -16.298 17.452 1.00 21.07 C ATOM 39 CD2 LEU A 4 5.425 -17.566 15.812 1.00 23.76 C ATOM 40 H LEU A 4 2.498 -15.376 19.162 1.00 0.00 H ATOM 41 N ASP A 5 3.411 -13.118 16.995 1.00 20.74 N ATOM 42 CA ASP A 5 3.426 -11.915 16.146 1.00 21.10 C ATOM 43 C ASP A 5 3.934 -10.674 16.935 1.00 19.05 C ATOM 44 O ASP A 5 4.725 -9.909 16.427 1.00 18.91 O ATOM 45 CB ASP A 5 2.018 -11.620 15.587 1.00 21.49 C ATOM 46 CG ASP A 5 1.981 -10.371 14.724 1.00 20.71 C ATOM 47 OD1 ASP A 5 2.393 -10.407 13.572 1.00 25.11 O ATOM 48 OD2 ASP A 5 1.521 -9.350 15.225 1.00 21.25 O ATOM 49 H ASP A 5 2.520 -13.622 17.178 1.00 0.00 H ATOM 50 N PHE A 6 3.463 -10.494 18.154 1.00 19.42 N ATOM 51 CA PHE A 6 3.902 -9.364 19.006 1.00 21.18 C ATOM 52 C PHE A 6 5.406 -9.394 19.345 1.00 20.31 C ATOM 53 O PHE A 6 6.121 -8.417 19.186 1.00 17.57 O ATOM 54 CB PHE A 6 3.110 -9.354 20.302 1.00 20.59 C ATOM 55 CG PHE A 6 3.409 -8.200 21.197 1.00 20.54 C ATOM 56 CD1 PHE A 6 2.879 -6.951 20.927 1.00 20.42 C ATOM 57 CD2 PHE A 6 4.165 -8.373 22.322 1.00 22.54 C ATOM 58 CE1 PHE A 6 3.111 -5.897 21.774 1.00 20.76 C ATOM 59 CE2 PHE A 6 4.426 -7.310 23.168 1.00 21.88 C ATOM 60 CZ PHE A 6 3.905 -6.072 22.889 1.00 19.44 C ATOM 61 H PHE A 6 2.762 -11.165 18.528 1.00 0.00 H ATOM 62 N ALA A 7 5.865 -10.573 19.748 1.00 19.00 N ATOM 63 CA ALA A 7 7.273 -10.761 20.100 1.00 17.35 C ATOM 64 C ALA A 7 8.153 -10.543 18.912 1.00 17.87 C ATOM 65 O ALA A 7 9.227 -9.906 19.012 1.00 16.67 O ATOM 66 CB ALA A 7 7.497 -12.131 20.666 1.00 17.96 C ATOM 67 H ALA A 7 5.211 -11.379 19.815 1.00 0.00 H ATOM 68 N LEU A 8 7.749 -11.073 17.774 1.00 16.62 N ATOM 69 CA LEU A 8 8.588 -10.905 16.588 1.00 17.20 C ATOM 70 C LEU A 8 8.594 -9.462 16.144 1.00 17.89 C ATOM 71 O LEU A 8 9.569 -8.948 15.662 1.00 17.83 O ATOM 72 CB LEU A 8 8.129 -11.758 15.444 1.00 18.70 C ATOM 73 CG LEU A 8 8.359 -13.259 15.567 1.00 19.44 C ATOM 74 CD1 LEU A 8 7.668 -13.920 14.391 1.00 21.49 C ATOM 75 CD2 LEU A 8 9.852 -13.567 15.578 1.00 19.96 C ATOM 76 H LEU A 8 6.853 -11.599 17.721 1.00 0.00 H ATOM 77 N SER A 9 7.453 -8.816 16.278 1.00 19.20 N ATOM 78 CA SER A 9 7.391 -7.421 15.928 1.00 21.54 C ATOM 79 C SER A 9 8.239 -6.554 16.868 1.00 21.31 C ATOM 80 O SER A 9 8.881 -5.593 16.439 1.00 20.54 O ATOM 81 CB SER A 9 5.968 -6.981 15.967 1.00 24.52 C ATOM 82 OG SER A 9 5.950 -5.651 15.584 1.00 37.52 O ATOM 83 HG SER A 9 6.500 -5.120 16.213 1.00 0.00 H ATOM 84 H SER A 9 6.608 -9.308 16.632 1.00 0.00 H ATOM 85 N LEU A 10 8.256 -6.885 18.149 1.00 20.73 N ATOM 86 CA LEU A 10 9.203 -6.219 19.040 1.00 21.99 C ATOM 87 C LEU A 10 10.666 -6.325 18.567 1.00 23.00 C ATOM 88 O LEU A 10 11.416 -5.377 18.558 1.00 19.02 O ATOM 89 CB LEU A 10 9.128 -6.790 20.453 1.00 23.39 C ATOM 90 CG LEU A 10 8.127 -6.269 21.459 1.00 26.78 C ATOM 91 CD1 LEU A 10 8.413 -6.993 22.766 1.00 26.82 C ATOM 92 CD2 LEU A 10 8.167 -4.741 21.673 1.00 26.43 C ATOM 93 H LEU A 10 7.605 -7.608 18.516 1.00 0.00 H ATOM 94 N LEU A 11 11.062 -7.523 18.193 1.00 20.79 N ATOM 95 CA LEU A 11 12.387 -7.755 17.662 1.00 19.44 C ATOM 96 C LEU A 11 12.674 -6.971 16.437 1.00 20.29 C ATOM 97 O LEU A 11 13.770 -6.433 16.241 1.00 21.75 O ATOM 98 CB LEU A 11 12.498 -9.226 17.243 1.00 18.82 C ATOM 99 CG LEU A 11 12.912 -10.195 18.321 1.00 20.05 C ATOM 100 CD1 LEU A 11 12.910 -11.593 17.665 1.00 19.84 C ATOM 101 CD2 LEU A 11 14.277 -9.817 18.890 1.00 18.17 C ATOM 102 H LEU A 11 10.405 -8.324 18.282 1.00 0.00 H ATOM 103 N ARG A 12 11.707 -6.898 15.554 1.00 18.02 N ATOM 104 CA ARG A 12 11.909 -6.166 14.342 1.00 21.43 C ATOM 105 C ARG A 12 12.030 -4.650 14.548 1.00 19.52 C ATOM 106 O ARG A 12 12.793 -3.960 13.871 1.00 20.47 O ATOM 107 CB ARG A 12 10.732 -6.429 13.396 1.00 24.38 C ATOM 108 CG ARG A 12 10.976 -5.869 11.992 1.00 27.74 C ATOM 109 CD ARG A 12 9.916 -6.298 10.975 1.00 30.98 C ATOM 110 NE ARG A 12 8.604 -5.702 11.287 1.00 33.92 N ATOM 111 CZ ARG A 12 7.638 -6.326 11.948 1.00 37.01 C ATOM 112 NH1 ARG A 12 7.776 -7.585 12.329 1.00 37.11 N ATOM 113 NH2 ARG A 12 6.511 -5.692 12.217 1.00 37.44 N ATOM 114 HE ARG A 12 8.424 -4.729 10.968 1.00 0.00 H ATOM 115 HH12 ARG A 12 7.008 -8.059 12.846 1.00 0.00 H ATOM 116 HH11 ARG A 12 8.652 -8.101 12.111 1.00 0.00 H ATOM 117 HH22 ARG A 12 5.752 -6.178 12.735 1.00 0.00 H ATOM 118 HH21 ARG A 12 6.383 -4.706 11.911 1.00 0.00 H ATOM 119 H ARG A 12 10.798 -7.370 15.734 1.00 0.00 H ATOM 120 N ARG A 13 11.188 -4.112 15.400 1.00 19.37 N ATOM 121 CA ARG A 13 10.988 -2.655 15.481 1.00 20.54 C ATOM 122 C ARG A 13 11.624 -2.020 16.732 1.00 18.48 C ATOM 123 O ARG A 13 11.856 -0.840 16.745 1.00 19.11 O ATOM 124 CB ARG A 13 9.476 -2.317 15.550 1.00 24.70 C ATOM 125 CG ARG A 13 8.614 -2.809 14.427 1.00 28.48 C ATOM 126 CD ARG A 13 8.914 -2.117 13.121 1.00 30.35 C ATOM 127 NE ARG A 13 8.534 -0.681 13.048 1.00 35.24 N ATOM 128 CZ ARG A 13 7.292 -0.228 12.837 1.00 37.60 C ATOM 129 NH1 ARG A 13 6.225 -1.027 12.809 1.00 39.34 N ATOM 130 NH2 ARG A 13 7.112 1.067 12.740 1.00 42.54 N ATOM 131 HE ARG A 13 9.289 0.024 13.170 1.00 0.00 H ATOM 132 HH12 ARG A 13 5.280 -0.627 12.641 1.00 0.00 H ATOM 133 HH11 ARG A 13 6.338 -2.051 12.955 1.00 0.00 H ATOM 134 HH22 ARG A 13 6.159 1.449 12.576 1.00 0.00 H ATOM 135 HH21 ARG A 13 7.923 1.713 12.827 1.00 0.00 H ATOM 136 H ARG A 13 10.647 -4.732 16.036 1.00 0.00 H ATOM 137 N ASN A 14 11.779 -2.783 17.818 1.00 15.60 N ATOM 138 CA ASN A 14 12.155 -2.187 19.086 1.00 13.89 C ATOM 139 C ASN A 14 13.335 -2.782 19.872 1.00 14.72 C ATOM 140 O ASN A 14 13.872 -2.118 20.772 1.00 13.74 O ATOM 141 CB ASN A 14 10.952 -2.106 20.033 1.00 14.76 C ATOM 142 CG ASN A 14 9.847 -1.237 19.512 1.00 14.12 C ATOM 143 OD1 ASN A 14 8.961 -1.726 18.781 1.00 16.14 O ATOM 144 ND2 ASN A 14 9.927 0.064 19.776 1.00 14.43 N ATOM 145 HD22 ASN A 14 10.684 0.424 20.391 1.00 0.00 H ATOM 146 HD21 ASN A 14 9.233 0.721 19.367 1.00 0.00 H ATOM 147 H ASN A 14 11.629 -3.810 17.754 1.00 0.00 H ATOM 148 N VAL A 15 13.752 -3.979 19.541 1.00 14.01 N ATOM 149 CA VAL A 15 14.742 -4.696 20.409 1.00 15.00 C ATOM 150 C VAL A 15 16.031 -4.879 19.628 1.00 14.80 C ATOM 151 O VAL A 15 16.046 -5.595 18.639 1.00 14.77 O ATOM 152 CB VAL A 15 14.214 -6.032 20.923 1.00 13.62 C ATOM 153 CG1 VAL A 15 15.235 -6.718 21.865 1.00 14.95 C ATOM 154 CG2 VAL A 15 12.907 -5.859 21.656 1.00 15.26 C ATOM 155 H VAL A 15 13.396 -4.432 18.675 1.00 0.00 H ATOM 156 N ARG A 16 17.108 -4.204 20.065 1.00 13.04 N ATOM 157 CA ARG A 16 18.346 -4.108 19.313 1.00 13.02 C ATOM 158 C ARG A 16 19.561 -4.717 19.940 1.00 11.95 C ATOM 159 O ARG A 16 19.681 -4.774 21.134 1.00 11.28 O ATOM 160 CB ARG A 16 18.689 -2.646 19.041 1.00 13.49 C ATOM 161 CG ARG A 16 17.601 -1.885 18.337 1.00 16.27 C ATOM 162 CD ARG A 16 17.585 -2.195 16.863 1.00 19.12 C ATOM 163 NE ARG A 16 16.667 -1.242 16.219 1.00 24.74 N ATOM 164 CZ ARG A 16 15.445 -1.497 15.763 1.00 25.07 C ATOM 165 NH1 ARG A 16 14.948 -2.722 15.771 1.00 27.36 N ATOM 166 NH2 ARG A 16 14.770 -0.505 15.214 1.00 31.02 N ATOM 167 HE ARG A 16 17.011 -0.267 16.109 1.00 0.00 H ATOM 168 HH12 ARG A 16 13.989 -2.896 15.409 1.00 0.00 H ATOM 169 HH11 ARG A 16 15.516 -3.511 16.140 1.00 0.00 H ATOM 170 HH22 ARG A 16 13.811 -0.669 14.847 1.00 0.00 H ATOM 171 HH21 ARG A 16 15.197 0.441 15.149 1.00 0.00 H ATOM 172 H ARG A 16 17.052 -3.727 20.987 1.00 0.00 H ATOM 173 N GLN A 17 20.461 -5.236 19.082 1.00 12.13 N ATOM 174 CA GLN A 17 21.720 -5.824 19.539 1.00 11.75 C ATOM 175 C GLN A 17 22.677 -4.673 19.795 1.00 12.62 C ATOM 176 O GLN A 17 22.873 -3.820 18.893 1.00 13.25 O ATOM 177 CB GLN A 17 22.341 -6.715 18.480 1.00 12.35 C ATOM 178 CG GLN A 17 21.402 -7.829 17.946 1.00 12.91 C ATOM 179 CD GLN A 17 21.985 -8.708 16.886 1.00 14.22 C ATOM 180 OE1 GLN A 17 23.033 -8.422 16.339 1.00 14.91 O ATOM 181 NE2 GLN A 17 21.265 -9.782 16.551 1.00 15.29 N ATOM 182 HE22 GLN A 17 20.374 -9.986 17.047 1.00 0.00 H ATOM 183 HE21 GLN A 17 21.595 -10.414 15.794 1.00 0.00 H ATOM 184 H GLN A 17 20.254 -5.218 18.063 1.00 0.00 H ATOM 185 N VAL A 18 23.277 -4.617 20.977 1.00 12.39 N ATOM 186 CA VAL A 18 24.247 -3.558 21.251 1.00 13.10 C ATOM 187 C VAL A 18 25.470 -4.120 21.940 1.00 13.32 C ATOM 188 O VAL A 18 25.479 -5.221 22.451 1.00 13.82 O ATOM 189 CB VAL A 18 23.652 -2.383 22.048 1.00 13.34 C ATOM 190 CG1 VAL A 18 22.371 -1.911 21.407 1.00 13.17 C ATOM 191 CG2 VAL A 18 23.427 -2.791 23.516 1.00 12.64 C ATOM 192 H VAL A 18 23.058 -5.325 21.707 1.00 0.00 H ATOM 193 N GLN A 19 26.519 -3.303 21.941 1.00 15.97 N ATOM 194 CA GLN A 19 27.791 -3.600 22.594 1.00 17.47 C ATOM 195 C GLN A 19 28.333 -2.337 23.251 1.00 17.36 C ATOM 196 O GLN A 19 28.387 -1.287 22.640 1.00 18.63 O ATOM 197 CB GLN A 19 28.840 -4.030 21.598 1.00 21.06 C ATOM 198 CG GLN A 19 28.654 -5.407 21.047 1.00 24.62 C ATOM 199 CD GLN A 19 29.788 -5.749 20.096 1.00 26.10 C ATOM 200 OE1 GLN A 19 30.901 -5.870 20.541 1.00 23.53 O ATOM 201 NE2 GLN A 19 29.459 -5.963 18.780 1.00 24.63 N ATOM 202 HE22 GLN A 19 28.476 -5.840 18.463 1.00 0.00 H ATOM 203 HE21 GLN A 19 30.193 -6.248 18.100 1.00 0.00 H ATOM 204 H GLN A 19 26.428 -2.394 21.445 1.00 0.00 H ATOM 205 N THR A 20 28.664 -2.446 24.516 1.00 19.22 N ATOM 206 CA THR A 20 29.363 -1.361 25.175 1.00 17.97 C ATOM 207 C THR A 20 30.728 -1.880 25.631 1.00 20.98 C ATOM 208 O THR A 20 31.049 -3.029 25.470 1.00 20.19 O ATOM 209 CB THR A 20 28.619 -0.882 26.445 1.00 17.69 C ATOM 210 OG1 THR A 20 28.683 -1.896 27.446 1.00 16.18 O ATOM 211 CG2 THR A 20 27.189 -0.536 26.162 1.00 16.12 C ATOM 212 HG1 THR A 20 28.207 -1.588 28.257 1.00 0.00 H ATOM 213 H THR A 20 28.425 -3.309 25.045 1.00 0.00 H ATOM 214 N ASP A 21 31.501 -1.045 26.311 1.00 21.21 N ATOM 215 CA ASP A 21 32.773 -1.536 26.827 1.00 24.85 C ATOM 216 C ASP A 21 32.579 -2.659 27.758 1.00 25.33 C ATOM 217 O ASP A 21 33.548 -3.380 28.055 1.00 26.90 O ATOM 218 CB ASP A 21 33.552 -0.423 27.566 1.00 26.11 C ATOM 219 CG ASP A 21 34.164 0.609 26.631 1.00 29.24 C ATOM 220 OD1 ASP A 21 34.176 0.443 25.385 1.00 30.37 O ATOM 221 OD2 ASP A 21 34.604 1.639 27.159 1.00 34.87 O ATOM 222 H ASP A 21 31.206 -0.061 26.473 1.00 0.00 H ATOM 223 N GLN A 22 31.349 -2.807 28.311 1.00 21.31 N ATOM 224 CA GLN A 22 31.083 -3.888 29.278 1.00 20.48 C ATOM 225 C GLN A 22 30.635 -5.186 28.664 1.00 19.99 C ATOM 226 O GLN A 22 30.481 -6.178 29.348 1.00 22.11 O ATOM 227 CB GLN A 22 30.023 -3.461 30.312 1.00 21.67 C ATOM 228 CG GLN A 22 30.515 -2.371 31.258 1.00 21.49 C ATOM 229 CD GLN A 22 31.736 -2.873 32.047 1.00 25.35 C ATOM 230 OE1 GLN A 22 32.805 -2.339 31.934 1.00 30.64 O ATOM 231 NE2 GLN A 22 31.574 -3.952 32.765 1.00 22.59 N ATOM 232 HE22 GLN A 22 30.634 -4.389 32.842 1.00 0.00 H ATOM 233 HE21 GLN A 22 32.385 -4.374 33.260 1.00 0.00 H ATOM 234 H GLN A 22 30.585 -2.151 28.050 1.00 0.00 H ATOM 235 N GLY A 23 30.439 -5.206 27.360 1.00 20.18 N ATOM 236 CA GLY A 23 30.076 -6.433 26.682 1.00 19.19 C ATOM 237 C GLY A 23 28.809 -6.304 25.820 1.00 16.96 C ATOM 238 O GLY A 23 28.378 -5.199 25.476 1.00 14.73 O ATOM 239 H GLY A 23 30.547 -4.329 26.811 1.00 0.00 H ATOM 240 N HIS A 24 28.182 -7.456 25.584 1.00 15.51 N ATOM 241 CA HIS A 24 26.936 -7.547 24.774 1.00 16.69 C ATOM 242 C HIS A 24 25.669 -7.454 25.603 1.00 15.70 C ATOM 243 O HIS A 24 25.504 -8.130 26.625 1.00 18.39 O ATOM 244 CB HIS A 24 26.964 -8.844 23.982 1.00 16.98 C ATOM 245 CG HIS A 24 28.016 -8.869 22.917 1.00 18.27 C ATOM 246 ND1 HIS A 24 29.361 -9.162 23.164 1.00 22.78 N ATOM 247 CD2 HIS A 24 27.929 -8.614 21.590 1.00 17.58 C ATOM 248 CE1 HIS A 24 30.032 -9.117 22.018 1.00 20.04 C ATOM 249 NE2 HIS A 24 29.194 -8.748 21.057 1.00 21.64 N ATOM 250 H HIS A 24 28.580 -8.330 25.983 1.00 0.00 H ATOM 251 N PHE A 25 24.745 -6.616 25.137 1.00 14.23 N ATOM 252 CA PHE A 25 23.421 -6.407 25.758 1.00 12.70 C ATOM 253 C PHE A 25 22.346 -6.301 24.706 1.00 12.35 C ATOM 254 O PHE A 25 22.601 -6.023 23.539 1.00 12.57 O ATOM 255 CB PHE A 25 23.412 -5.130 26.571 1.00 13.59 C ATOM 256 CG PHE A 25 24.413 -5.179 27.700 1.00 13.22 C ATOM 257 CD1 PHE A 25 24.045 -5.663 28.982 1.00 14.01 C ATOM 258 CD2 PHE A 25 25.718 -4.823 27.461 1.00 12.57 C ATOM 259 CE1 PHE A 25 25.020 -5.781 29.966 1.00 14.82 C ATOM 260 CE2 PHE A 25 26.676 -4.906 28.445 1.00 14.29 C ATOM 261 CZ PHE A 25 26.346 -5.383 29.707 1.00 14.74 C ATOM 262 H PHE A 25 24.970 -6.073 24.279 1.00 0.00 H ATOM 263 N THR A 26 21.138 -6.522 25.167 1.00 12.27 N ATOM 264 CA THR A 26 19.920 -6.236 24.456 1.00 12.02 C ATOM 265 C THR A 26 19.424 -4.826 24.850 1.00 12.88 C ATOM 266 O THR A 26 19.363 -4.493 26.021 1.00 13.91 O ATOM 267 CB THR A 26 18.832 -7.240 24.815 1.00 12.49 C ATOM 268 OG1 THR A 26 19.234 -8.567 24.467 1.00 13.46 O ATOM 269 CG2 THR A 26 17.572 -6.950 24.022 1.00 13.21 C ATOM 270 HG1 THR A 26 20.060 -8.800 24.960 1.00 0.00 H ATOM 271 H THR A 26 21.054 -6.935 26.118 1.00 0.00 H ATOM 272 N MET A 27 19.102 -3.995 23.858 1.00 12.62 N ATOM 273 CA MET A 27 18.595 -2.621 24.098 1.00 11.57 C ATOM 274 C MET A 27 17.111 -2.549 23.710 1.00 12.48 C ATOM 275 O MET A 27 16.722 -3.037 22.607 1.00 12.73 O ATOM 276 CB MET A 27 19.325 -1.619 23.262 1.00 13.37 C ATOM 277 CG MET A 27 18.943 -0.149 23.521 1.00 13.41 C ATOM 278 SD MET A 27 19.789 1.048 22.476 1.00 13.81 S ATOM 279 CE MET A 27 18.947 0.764 20.951 1.00 15.15 C ATOM 280 H MET A 27 19.210 -4.323 22.877 1.00 0.00 H ATOM 281 N LEU A 28 16.290 -1.904 24.533 1.00 11.91 N ATOM 282 CA LEU A 28 14.877 -1.655 24.184 1.00 12.20 C ATOM 283 C LEU A 28 14.679 -0.216 23.740 1.00 11.86 C ATOM 284 O LEU A 28 14.882 0.724 24.488 1.00 13.17 O ATOM 285 CB LEU A 28 13.968 -1.965 25.337 1.00 11.76 C ATOM 286 CG LEU A 28 12.488 -1.710 25.048 1.00 12.39 C ATOM 287 CD1 LEU A 28 11.891 -2.634 24.012 1.00 11.99 C ATOM 288 CD2 LEU A 28 11.708 -1.842 26.354 1.00 13.86 C ATOM 289 H LEU A 28 16.653 -1.566 25.447 1.00 0.00 H ATOM 290 N GLY A 29 14.317 -0.026 22.475 1.00 11.96 N ATOM 291 CA GLY A 29 13.931 1.298 22.020 1.00 12.84 C ATOM 292 C GLY A 29 12.458 1.499 22.300 1.00 14.45 C ATOM 293 O GLY A 29 11.634 0.653 21.959 1.00 15.42 O ATOM 294 H GLY A 29 14.310 -0.826 21.811 1.00 0.00 H ATOM 295 N VAL A 30 12.112 2.600 22.965 1.00 14.21 N ATOM 296 CA VAL A 30 10.769 2.809 23.441 1.00 15.69 C ATOM 297 C VAL A 30 9.921 3.778 22.600 1.00 14.87 C ATOM 298 O VAL A 30 8.782 3.482 22.306 1.00 17.21 O ATOM 299 CB VAL A 30 10.798 3.306 24.909 1.00 17.11 C ATOM 300 CG1 VAL A 30 9.419 3.675 25.361 1.00 18.95 C ATOM 301 CG2 VAL A 30 11.373 2.230 25.806 1.00 18.34 C ATOM 302 H VAL A 30 12.832 3.329 23.145 1.00 0.00 H ATOM 303 N ARG A 31 10.451 4.916 22.265 1.00 16.14 N ATOM 304 CA ARG A 31 9.783 5.853 21.377 1.00 15.45 C ATOM 305 C ARG A 31 10.756 6.871 20.883 1.00 15.44 C ATOM 306 O ARG A 31 11.824 7.095 21.525 1.00 14.92 O ATOM 307 CB ARG A 31 8.655 6.578 22.137 1.00 17.18 C ATOM 308 CG ARG A 31 9.197 7.485 23.265 1.00 17.22 C ATOM 309 CD ARG A 31 8.091 8.426 23.719 1.00 18.98 C ATOM 310 NE ARG A 31 8.543 9.150 24.882 1.00 21.14 N ATOM 311 CZ ARG A 31 9.416 10.154 24.854 1.00 19.80 C ATOM 312 NH1 ARG A 31 9.899 10.607 23.718 1.00 23.89 N ATOM 313 NH2 ARG A 31 9.752 10.713 25.975 1.00 21.25 N ATOM 314 HE ARG A 31 8.160 8.868 25.807 1.00 0.00 H ATOM 315 HH12 ARG A 31 10.580 11.393 23.719 1.00 0.00 H ATOM 316 HH11 ARG A 31 9.600 10.180 22.818 1.00 0.00 H ATOM 317 HH22 ARG A 31 10.432 11.500 25.980 1.00 0.00 H ATOM 318 HH21 ARG A 31 9.341 10.375 26.868 1.00 0.00 H ATOM 319 H ARG A 31 11.386 5.165 22.646 1.00 0.00 H ATOM 320 N ASP A 32 10.477 7.509 19.758 1.00 15.43 N ATOM 321 CA ASP A 32 11.345 8.580 19.318 1.00 16.61 C ATOM 322 C ASP A 32 12.814 8.125 19.336 1.00 15.21 C ATOM 323 O ASP A 32 13.148 7.086 18.750 1.00 14.77 O ATOM 324 CB ASP A 32 11.161 9.787 20.233 1.00 19.38 C ATOM 325 CG ASP A 32 9.742 10.332 20.180 1.00 21.73 C ATOM 326 OD1 ASP A 32 9.338 10.799 19.072 1.00 22.95 O ATOM 327 OD2 ASP A 32 9.036 10.265 21.217 1.00 26.35 O ATOM 328 H ASP A 32 9.643 7.244 19.196 1.00 0.00 H ATOM 329 N ARG A 33 13.674 8.921 20.007 1.00 14.34 N ATOM 330 CA ARG A 33 15.100 8.554 20.075 1.00 15.63 C ATOM 331 C ARG A 33 15.524 7.995 21.430 1.00 14.18 C ATOM 332 O ARG A 33 16.694 8.003 21.769 1.00 13.91 O ATOM 333 CB ARG A 33 16.022 9.708 19.658 1.00 18.35 C ATOM 334 CG ARG A 33 15.854 10.163 18.200 1.00 22.80 C ATOM 335 CD ARG A 33 16.477 11.500 17.988 1.00 28.37 C ATOM 336 NE ARG A 33 16.062 12.435 19.038 1.00 35.06 N ATOM 337 CZ ARG A 33 16.810 13.405 19.529 1.00 38.95 C ATOM 338 NH1 ARG A 33 18.041 13.597 19.073 1.00 41.60 N ATOM 339 NH2 ARG A 33 16.307 14.224 20.457 1.00 38.05 N ATOM 340 HE ARG A 33 15.103 12.325 19.426 1.00 0.00 H ATOM 341 HH12 ARG A 33 18.627 14.363 19.463 1.00 0.00 H ATOM 342 HH11 ARG A 33 18.420 12.982 18.325 1.00 0.00 H ATOM 343 HH22 ARG A 33 16.893 14.990 20.847 1.00 0.00 H ATOM 344 HH21 ARG A 33 15.330 14.096 20.789 1.00 0.00 H ATOM 345 H ARG A 33 13.333 9.786 20.472 1.00 0.00 H ATOM 346 N LEU A 34 14.539 7.517 22.190 1.00 12.69 N ATOM 347 CA LEU A 34 14.705 7.144 23.555 1.00 14.17 C ATOM 348 C LEU A 34 14.715 5.643 23.719 1.00 12.99 C ATOM 349 O LEU A 34 13.802 4.973 23.275 1.00 11.13 O ATOM 350 CB LEU A 34 13.566 7.741 24.427 1.00 15.37 C ATOM 351 CG LEU A 34 13.616 7.382 25.914 1.00 15.70 C ATOM 352 CD1 LEU A 34 14.766 8.039 26.576 1.00 17.93 C ATOM 353 CD2 LEU A 34 12.363 7.920 26.571 1.00 18.43 C ATOM 354 H LEU A 34 13.597 7.410 21.763 1.00 0.00 H ATOM 355 N ALA A 35 15.781 5.138 24.380 1.00 11.74 N ATOM 356 CA ALA A 35 15.941 3.726 24.613 1.00 11.42 C ATOM 357 C ALA A 35 16.360 3.479 26.031 1.00 13.16 C ATOM 358 O ALA A 35 16.753 4.391 26.711 1.00 14.63 O ATOM 359 CB ALA A 35 16.999 3.116 23.706 1.00 11.62 C ATOM 360 H ALA A 35 16.510 5.791 24.732 1.00 0.00 H ATOM 361 N VAL A 36 16.329 2.228 26.439 1.00 13.28 N ATOM 362 CA VAL A 36 16.716 1.893 27.769 1.00 14.46 C ATOM 363 C VAL A 36 17.643 0.695 27.782 1.00 15.35 C ATOM 364 O VAL A 36 17.502 -0.254 26.975 1.00 14.79 O ATOM 365 CB VAL A 36 15.467 1.703 28.654 1.00 14.56 C ATOM 366 CG1 VAL A 36 14.634 0.517 28.194 1.00 17.19 C ATOM 367 CG2 VAL A 36 15.801 1.591 30.175 1.00 14.83 C ATOM 368 H VAL A 36 16.020 1.479 25.787 1.00 0.00 H ATOM 369 N LEU A 37 18.553 0.716 28.758 1.00 14.89 N ATOM 370 CA LEU A 37 19.519 -0.361 28.967 1.00 15.73 C ATOM 371 C LEU A 37 19.669 -0.646 30.470 1.00 15.02 C ATOM 372 O LEU A 37 19.408 0.253 31.274 1.00 13.70 O ATOM 373 CB LEU A 37 20.943 0.087 28.502 1.00 16.65 C ATOM 374 CG LEU A 37 21.228 0.168 26.983 1.00 17.21 C ATOM 375 CD1 LEU A 37 22.482 1.011 26.783 1.00 18.81 C ATOM 376 CD2 LEU A 37 21.350 -1.145 26.323 1.00 18.55 C ATOM 377 H LEU A 37 18.576 1.535 29.398 1.00 0.00 H ATOM 378 N PRO A 38 20.154 -1.826 30.831 1.00 15.28 N ATOM 379 CA PRO A 38 20.592 -2.005 32.225 1.00 15.46 C ATOM 380 C PRO A 38 21.740 -1.062 32.592 1.00 15.01 C ATOM 381 O PRO A 38 22.686 -0.830 31.803 1.00 15.12 O ATOM 382 CB PRO A 38 21.070 -3.444 32.284 1.00 16.26 C ATOM 383 CG PRO A 38 20.812 -4.045 30.977 1.00 18.16 C ATOM 384 CD PRO A 38 20.556 -2.944 29.980 1.00 16.38 C ATOM 385 N ARG A 39 21.653 -0.491 33.772 1.00 14.86 N ATOM 386 CA ARG A 39 22.643 0.465 34.216 1.00 15.78 C ATOM 387 C ARG A 39 24.040 -0.095 34.095 1.00 14.35 C ATOM 388 O ARG A 39 24.966 0.588 33.635 1.00 13.72 O ATOM 389 CB ARG A 39 22.364 0.928 35.650 1.00 16.76 C ATOM 390 CG ARG A 39 23.254 2.112 36.063 1.00 19.98 C ATOM 391 CD ARG A 39 23.379 2.234 37.572 1.00 20.30 C ATOM 392 NE ARG A 39 23.629 0.887 38.103 1.00 20.14 N ATOM 393 CZ ARG A 39 24.820 0.319 38.194 1.00 22.04 C ATOM 394 NH1 ARG A 39 25.909 0.995 37.818 1.00 21.78 N ATOM 395 NH2 ARG A 39 24.928 -0.919 38.601 1.00 22.52 N ATOM 396 HE ARG A 39 22.808 0.339 38.432 1.00 0.00 H ATOM 397 HH12 ARG A 39 26.847 0.551 37.888 1.00 0.00 H ATOM 398 HH11 ARG A 39 25.819 1.965 37.455 1.00 0.00 H ATOM 399 HH22 ARG A 39 25.866 -1.363 38.672 1.00 0.00 H ATOM 400 HH21 ARG A 39 24.076 -1.459 38.854 1.00 0.00 H ATOM 401 H ARG A 39 20.858 -0.731 34.398 1.00 0.00 H ATOM 402 N HIS A 40 24.223 -1.342 34.487 1.00 15.55 N ATOM 403 CA HIS A 40 25.617 -1.889 34.538 1.00 17.05 C ATOM 404 C HIS A 40 26.280 -2.052 33.175 1.00 16.12 C ATOM 405 O HIS A 40 27.451 -2.421 33.084 1.00 16.27 O ATOM 406 CB HIS A 40 25.687 -3.217 35.297 1.00 17.08 C ATOM 407 CG HIS A 40 24.941 -4.372 34.681 1.00 16.52 C ATOM 408 ND1 HIS A 40 23.640 -4.684 35.020 1.00 16.22 N ATOM 409 CD2 HIS A 40 25.372 -5.380 33.880 1.00 16.46 C ATOM 410 CE1 HIS A 40 23.276 -5.790 34.392 1.00 18.68 C ATOM 411 NE2 HIS A 40 24.310 -6.231 33.686 1.00 17.61 N ATOM 412 H HIS A 40 23.412 -1.935 34.756 1.00 0.00 H ATOM 413 N SER A 41 25.507 -1.835 32.112 1.00 15.91 N ATOM 414 CA SER A 41 26.074 -1.831 30.763 1.00 15.31 C ATOM 415 C SER A 41 27.005 -0.629 30.600 1.00 17.11 C ATOM 416 O SER A 41 27.866 -0.623 29.724 1.00 17.15 O ATOM 417 CB SER A 41 24.956 -1.850 29.723 1.00 16.14 C ATOM 418 OG SER A 41 24.283 -0.648 29.577 1.00 16.21 O ATOM 419 HG SER A 41 23.868 -0.396 30.440 1.00 0.00 H ATOM 420 H SER A 41 24.489 -1.667 32.242 1.00 0.00 H ATOM 421 N GLN A 42 26.798 0.409 31.418 1.00 18.84 N ATOM 422 CA GLN A 42 27.691 1.551 31.448 1.00 20.22 C ATOM 423 C GLN A 42 27.925 2.120 30.058 1.00 19.18 C ATOM 424 O GLN A 42 29.051 2.273 29.639 1.00 19.27 O ATOM 425 CB GLN A 42 29.039 1.210 32.091 1.00 23.07 C ATOM 426 CG GLN A 42 28.909 0.988 33.595 1.00 30.85 C ATOM 427 CD GLN A 42 29.977 0.069 34.158 1.00 40.84 C ATOM 428 OE1 GLN A 42 31.181 0.347 34.059 1.00 41.83 O ATOM 429 NE2 GLN A 42 29.537 -1.055 34.747 1.00 49.59 N ATOM 430 HE22 GLN A 42 28.516 -1.246 34.807 1.00 0.00 H ATOM 431 HE21 GLN A 42 30.217 -1.735 35.144 1.00 0.00 H ATOM 432 H GLN A 42 25.973 0.397 32.051 1.00 0.00 H ATOM 433 N PRO A 43 26.845 2.466 29.376 1.00 18.43 N ATOM 434 CA PRO A 43 27.010 3.067 28.042 1.00 20.26 C ATOM 435 C PRO A 43 27.835 4.339 28.163 1.00 23.40 C ATOM 436 O PRO A 43 27.653 5.094 29.091 1.00 18.67 O ATOM 437 CB PRO A 43 25.588 3.379 27.619 1.00 19.47 C ATOM 438 CG PRO A 43 24.799 3.458 28.862 1.00 19.26 C ATOM 439 CD PRO A 43 25.447 2.488 29.803 1.00 19.81 C ATOM 440 N GLY A 44 28.708 4.563 27.189 1.00 23.99 N ATOM 441 CA GLY A 44 29.593 5.748 27.143 1.00 22.41 C ATOM 442 C GLY A 44 29.043 6.791 26.167 1.00 23.15 C ATOM 443 O GLY A 44 27.851 6.988 26.066 1.00 19.83 O ATOM 444 H GLY A 44 28.774 3.869 26.417 1.00 0.00 H ATOM 445 N LYS A 45 29.932 7.504 25.479 1.00 19.20 N ATOM 446 CA LYS A 45 29.501 8.634 24.608 1.00 21.10 C ATOM 447 C LYS A 45 29.000 8.101 23.305 1.00 18.30 C ATOM 448 O LYS A 45 28.307 8.766 22.551 1.00 19.23 O ATOM 449 CB LYS A 45 30.630 9.592 24.299 1.00 24.69 C ATOM 450 CG LYS A 45 31.289 10.237 25.519 1.00 29.71 C ATOM 451 CD LYS A 45 30.284 10.887 26.468 1.00 32.19 C ATOM 452 CE LYS A 45 30.998 11.436 27.691 1.00 36.84 C ATOM 453 NZ LYS A 45 30.036 11.790 28.761 1.00 39.13 N ATOM 454 HZ1 LYS A 45 29.378 12.514 28.408 1.00 0.00 H ATOM 455 HZ2 LYS A 45 29.503 10.942 29.041 1.00 0.00 H ATOM 456 HZ3 LYS A 45 30.554 12.162 29.582 1.00 0.00 H ATOM 457 H LYS A 45 30.943 7.269 25.550 1.00 0.00 H ATOM 458 N THR A 46 29.450 6.907 22.990 1.00 17.49 N ATOM 459 CA THR A 46 28.972 6.185 21.861 1.00 17.17 C ATOM 460 C THR A 46 28.671 4.742 22.237 1.00 17.01 C ATOM 461 O THR A 46 29.127 4.233 23.242 1.00 18.24 O ATOM 462 CB THR A 46 30.019 6.125 20.731 1.00 17.49 C ATOM 463 OG1 THR A 46 31.161 5.365 21.134 1.00 15.56 O ATOM 464 CG2 THR A 46 30.422 7.509 20.264 1.00 18.92 C ATOM 465 HG1 THR A 46 31.818 5.341 20.394 1.00 0.00 H ATOM 466 H THR A 46 30.182 6.474 23.588 1.00 0.00 H ATOM 467 N ILE A 47 27.847 4.123 21.419 1.00 14.39 N ATOM 468 CA ILE A 47 27.419 2.767 21.571 1.00 14.70 C ATOM 469 C ILE A 47 27.283 2.117 20.208 1.00 14.18 C ATOM 470 O ILE A 47 26.729 2.681 19.257 1.00 15.13 O ATOM 471 CB ILE A 47 26.066 2.652 22.378 1.00 12.83 C ATOM 472 CG1 ILE A 47 25.694 1.199 22.730 1.00 13.92 C ATOM 473 CG2 ILE A 47 24.887 3.226 21.604 1.00 13.41 C ATOM 474 CD1 ILE A 47 24.609 1.046 23.782 1.00 13.31 C ATOM 475 H ILE A 47 27.481 4.657 20.605 1.00 0.00 H ATOM 476 N TRP A 48 27.712 0.890 20.136 1.00 14.41 N ATOM 477 CA TRP A 48 27.513 0.067 18.949 1.00 15.49 C ATOM 478 C TRP A 48 26.090 -0.520 18.920 1.00 16.13 C ATOM 479 O TRP A 48 25.714 -1.288 19.763 1.00 16.30 O ATOM 480 CB TRP A 48 28.556 -1.042 18.916 1.00 18.28 C ATOM 481 CG TRP A 48 28.488 -1.856 17.640 1.00 18.29 C ATOM 482 CD1 TRP A 48 27.862 -3.043 17.466 1.00 19.23 C ATOM 483 CD2 TRP A 48 29.013 -1.482 16.355 1.00 17.73 C ATOM 484 NE1 TRP A 48 27.951 -3.437 16.146 1.00 21.36 N ATOM 485 CE2 TRP A 48 28.665 -2.503 15.455 1.00 20.73 C ATOM 486 CE3 TRP A 48 29.745 -0.362 15.868 1.00 19.79 C ATOM 487 CZ2 TRP A 48 29.049 -2.474 14.102 1.00 19.47 C ATOM 488 CZ3 TRP A 48 30.113 -0.331 14.521 1.00 17.91 C ATOM 489 CH2 TRP A 48 29.767 -1.384 13.664 1.00 17.46 C ATOM 490 HE1 TRP A 48 27.541 -4.304 15.744 1.00 0.00 H ATOM 491 H TRP A 48 28.213 0.484 20.952 1.00 0.00 H ATOM 492 N ILE A 49 25.336 -0.180 17.893 1.00 14.60 N ATOM 493 CA ILE A 49 23.956 -0.643 17.745 1.00 16.50 C ATOM 494 C ILE A 49 23.811 -1.304 16.396 1.00 17.56 C ATOM 495 O ILE A 49 23.873 -0.649 15.360 1.00 18.03 O ATOM 496 CB ILE A 49 22.908 0.458 17.854 1.00 15.67 C ATOM 497 CG1 ILE A 49 23.059 1.212 19.160 1.00 16.19 C ATOM 498 CG2 ILE A 49 21.511 -0.117 17.724 1.00 17.20 C ATOM 499 CD1 ILE A 49 22.106 2.411 19.244 1.00 16.98 C ATOM 500 H ILE A 49 25.737 0.440 17.161 1.00 0.00 H ATOM 501 N GLU A 50 23.672 -2.627 16.448 1.00 19.08 N ATOM 502 CA GLU A 50 23.470 -3.458 15.241 1.00 23.13 C ATOM 503 C GLU A 50 24.717 -3.400 14.351 1.00 26.67 C ATOM 504 O GLU A 50 25.653 -4.137 14.611 1.00 30.44 O ATOM 505 CB GLU A 50 22.223 -3.064 14.502 1.00 24.08 C ATOM 506 CG GLU A 50 20.930 -3.246 15.255 1.00 25.20 C ATOM 507 CD GLU A 50 20.525 -4.707 15.390 1.00 25.58 C ATOM 508 OE1 GLU A 50 21.092 -5.543 14.673 1.00 32.73 O ATOM 509 OE2 GLU A 50 19.675 -5.054 16.212 1.00 18.07 O ATOM 510 H GLU A 50 23.707 -3.096 17.376 1.00 0.00 H ATOM 511 N HIS A 51 24.718 -2.594 13.294 1.00 27.68 N ATOM 512 CA HIS A 51 25.852 -2.532 12.404 1.00 31.98 C ATOM 513 C HIS A 51 26.625 -1.215 12.443 1.00 32.10 C ATOM 514 O HIS A 51 27.481 -0.975 11.571 1.00 29.31 O ATOM 515 CB HIS A 51 25.409 -2.819 10.962 1.00 35.76 C ATOM 516 CG HIS A 51 24.411 -3.917 10.872 1.00 42.50 C ATOM 517 ND1 HIS A 51 24.738 -5.229 11.143 1.00 46.87 N ATOM 518 CD2 HIS A 51 23.091 -3.911 10.578 1.00 49.84 C ATOM 519 CE1 HIS A 51 23.670 -5.990 11.012 1.00 45.38 C ATOM 520 NE2 HIS A 51 22.655 -5.216 10.671 1.00 52.37 N ATOM 521 H HIS A 51 23.887 -1.998 13.105 1.00 0.00 H ATOM 522 N LYS A 52 26.355 -0.342 13.412 1.00 26.52 N ATOM 523 CA LYS A 52 27.068 0.925 13.441 1.00 24.73 C ATOM 524 C LYS A 52 27.191 1.601 14.780 1.00 21.31 C ATOM 525 O LYS A 52 26.509 1.240 15.744 1.00 19.64 O ATOM 526 CB LYS A 52 26.474 1.874 12.411 1.00 29.05 C ATOM 527 CG LYS A 52 25.060 2.301 12.625 1.00 30.94 C ATOM 528 CD LYS A 52 24.773 3.418 11.623 1.00 35.89 C ATOM 529 CE LYS A 52 23.504 4.158 12.015 1.00 38.49 C ATOM 530 NZ LYS A 52 22.768 4.623 10.797 1.00 40.52 N ATOM 531 HZ1 LYS A 52 23.377 5.264 10.249 1.00 0.00 H ATOM 532 HZ2 LYS A 52 22.513 3.801 10.213 1.00 0.00 H ATOM 533 HZ3 LYS A 52 21.905 5.126 11.086 1.00 0.00 H ATOM 534 H LYS A 52 25.644 -0.563 14.138 1.00 0.00 H ATOM 535 N LEU A 53 28.094 2.565 14.837 1.00 17.97 N ATOM 536 CA LEU A 53 28.378 3.314 16.052 1.00 18.55 C ATOM 537 C LEU A 53 27.490 4.499 16.103 1.00 16.74 C ATOM 538 O LEU A 53 27.395 5.264 15.136 1.00 16.80 O ATOM 539 CB LEU A 53 29.820 3.813 16.055 1.00 17.77 C ATOM 540 CG LEU A 53 30.386 4.115 17.411 1.00 18.77 C ATOM 541 CD1 LEU A 53 30.343 2.861 18.287 1.00 18.71 C ATOM 542 CD2 LEU A 53 31.801 4.643 17.261 1.00 22.83 C ATOM 543 H LEU A 53 28.626 2.799 13.974 1.00 0.00 H ATOM 544 N VAL A 54 26.779 4.621 17.225 1.00 14.55 N ATOM 545 CA VAL A 54 25.742 5.601 17.412 1.00 14.77 C ATOM 546 C VAL A 54 26.116 6.466 18.618 1.00 15.24 C ATOM 547 O VAL A 54 26.506 5.975 19.687 1.00 17.60 O ATOM 548 CB VAL A 54 24.324 4.962 17.574 1.00 15.87 C ATOM 549 CG1 VAL A 54 23.265 6.047 17.762 1.00 15.88 C ATOM 550 CG2 VAL A 54 23.962 4.109 16.357 1.00 15.23 C ATOM 551 H VAL A 54 26.986 3.971 18.010 1.00 0.00 H ATOM 552 N ASN A 55 26.007 7.774 18.425 1.00 15.26 N ATOM 553 CA ASN A 55 26.339 8.736 19.484 1.00 16.06 C ATOM 554 C ASN A 55 25.212 8.840 20.465 1.00 14.02 C ATOM 555 O ASN A 55 24.084 8.871 20.093 1.00 13.11 O ATOM 556 CB ASN A 55 26.618 10.110 18.901 1.00 17.74 C ATOM 557 CG ASN A 55 27.819 10.096 18.043 1.00 20.08 C ATOM 558 OD1 ASN A 55 28.632 9.160 18.106 1.00 26.72 O ATOM 559 ND2 ASN A 55 27.942 11.072 17.191 1.00 23.36 N ATOM 560 HD22 ASN A 55 27.238 11.837 17.172 1.00 0.00 H ATOM 561 HD21 ASN A 55 28.744 11.087 16.530 1.00 0.00 H ATOM 562 H ASN A 55 25.679 8.126 17.503 1.00 0.00 H ATOM 563 N ILE A 56 25.536 8.914 21.759 1.00 13.69 N ATOM 564 CA ILE A 56 24.541 9.055 22.775 1.00 13.81 C ATOM 565 C ILE A 56 24.537 10.496 23.268 1.00 15.62 C ATOM 566 O ILE A 56 25.561 10.995 23.742 1.00 17.84 O ATOM 567 CB ILE A 56 24.831 8.108 23.957 1.00 14.35 C ATOM 568 CG1 ILE A 56 24.608 6.667 23.510 1.00 15.61 C ATOM 569 CG2 ILE A 56 23.975 8.456 25.169 1.00 15.39 C ATOM 570 CD1 ILE A 56 24.996 5.631 24.544 1.00 15.12 C ATOM 571 H ILE A 56 26.538 8.868 22.034 1.00 0.00 H ATOM 572 N LEU A 57 23.387 11.150 23.186 1.00 14.82 N ATOM 573 CA LEU A 57 23.280 12.564 23.490 1.00 15.65 C ATOM 574 C LEU A 57 23.055 12.837 25.003 1.00 18.95 C ATOM 575 O LEU A 57 23.380 13.872 25.503 1.00 17.47 O ATOM 576 CB LEU A 57 22.127 13.186 22.697 1.00 17.17 C ATOM 577 CG LEU A 57 22.189 13.131 21.171 1.00 15.64 C ATOM 578 CD1 LEU A 57 20.898 13.668 20.568 1.00 18.62 C ATOM 579 CD2 LEU A 57 23.411 13.925 20.690 1.00 17.23 C ATOM 580 H LEU A 57 22.534 10.632 22.894 1.00 0.00 H ATOM 581 N ASP A 58 22.467 11.889 25.684 1.00 18.36 N ATOM 582 CA ASP A 58 22.098 12.049 27.097 1.00 19.99 C ATOM 583 C ASP A 58 21.865 10.671 27.651 1.00 19.20 C ATOM 584 O ASP A 58 21.349 9.785 26.955 1.00 17.47 O ATOM 585 CB ASP A 58 20.828 12.826 27.172 1.00 22.64 C ATOM 586 CG ASP A 58 20.448 13.174 28.556 1.00 32.18 C ATOM 587 OD1 ASP A 58 21.305 13.736 29.305 1.00 35.28 O ATOM 588 OD2 ASP A 58 19.258 12.879 28.884 1.00 39.05 O ATOM 589 H ASP A 58 22.253 10.989 25.209 1.00 0.00 H ATOM 590 N ALA A 59 22.247 10.495 28.912 1.00 17.79 N ATOM 591 CA ALA A 59 22.068 9.254 29.659 1.00 19.01 C ATOM 592 C ALA A 59 21.537 9.621 31.040 1.00 19.84 C ATOM 593 O ALA A 59 22.091 10.525 31.715 1.00 20.71 O ATOM 594 CB ALA A 59 23.348 8.465 29.789 1.00 18.41 C ATOM 595 H ALA A 59 22.703 11.293 29.398 1.00 0.00 H ATOM 596 N VAL A 60 20.458 8.950 31.442 1.00 18.66 N ATOM 597 CA VAL A 60 19.894 9.196 32.777 1.00 19.15 C ATOM 598 C VAL A 60 19.817 7.858 33.505 1.00 18.85 C ATOM 599 O VAL A 60 19.094 6.954 33.091 1.00 16.51 O ATOM 600 CB VAL A 60 18.495 9.829 32.673 1.00 21.66 C ATOM 601 CG1 VAL A 60 17.823 9.884 34.042 1.00 21.67 C ATOM 602 CG2 VAL A 60 18.595 11.224 32.058 1.00 22.29 C ATOM 603 H VAL A 60 20.015 8.252 30.811 1.00 0.00 H ATOM 604 N GLU A 61 20.518 7.724 34.626 1.00 16.78 N ATOM 605 CA GLU A 61 20.429 6.532 35.437 1.00 19.61 C ATOM 606 C GLU A 61 19.312 6.731 36.427 1.00 23.50 C ATOM 607 O GLU A 61 19.293 7.725 37.186 1.00 21.04 O ATOM 608 CB GLU A 61 21.756 6.234 36.127 1.00 24.57 C ATOM 609 CG GLU A 61 22.892 5.993 35.119 1.00 23.61 C ATOM 610 CD GLU A 61 24.231 5.686 35.759 1.00 26.94 C ATOM 611 OE1 GLU A 61 24.319 5.732 36.992 1.00 30.65 O ATOM 612 OE2 GLU A 61 25.167 5.390 35.006 1.00 26.79 O ATOM 613 H GLU A 61 21.146 8.496 34.927 1.00 0.00 H ATOM 614 N LEU A 62 18.314 5.857 36.379 1.00 20.51 N ATOM 615 CA LEU A 62 17.098 6.073 37.199 1.00 17.59 C ATOM 616 C LEU A 62 17.330 5.586 38.637 1.00 21.06 C ATOM 617 O LEU A 62 17.933 4.530 38.870 1.00 18.27 O ATOM 618 CB LEU A 62 15.922 5.353 36.605 1.00 17.99 C ATOM 619 CG LEU A 62 15.537 5.806 35.215 1.00 18.30 C ATOM 620 CD1 LEU A 62 14.421 4.956 34.632 1.00 20.39 C ATOM 621 CD2 LEU A 62 15.217 7.319 35.179 1.00 18.22 C ATOM 622 H LEU A 62 18.385 5.020 35.766 1.00 0.00 H ATOM 623 N VAL A 63 16.820 6.384 39.585 1.00 18.34 N ATOM 624 CA VAL A 63 16.808 6.008 40.986 1.00 18.94 C ATOM 625 C VAL A 63 15.428 6.284 41.529 1.00 18.75 C ATOM 626 O VAL A 63 14.689 7.110 40.974 1.00 20.74 O ATOM 627 CB VAL A 63 17.850 6.796 41.778 1.00 18.22 C ATOM 628 CG1 VAL A 63 19.251 6.504 41.204 1.00 19.90 C ATOM 629 CG2 VAL A 63 17.524 8.291 41.801 1.00 19.23 C ATOM 630 H VAL A 63 16.420 7.303 39.307 1.00 0.00 H ATOM 631 N ASP A 64 15.075 5.605 42.610 1.00 18.75 N ATOM 632 CA ASP A 64 13.764 5.888 43.240 1.00 21.51 C ATOM 633 C ASP A 64 13.836 7.098 44.167 1.00 21.72 C ATOM 634 O ASP A 64 14.860 7.786 44.212 1.00 19.35 O ATOM 635 CB ASP A 64 13.212 4.648 43.946 1.00 19.77 C ATOM 636 CG ASP A 64 13.886 4.340 45.239 1.00 20.31 C ATOM 637 OD1 ASP A 64 14.749 5.099 45.672 1.00 20.07 O ATOM 638 OD2 ASP A 64 13.549 3.290 45.800 1.00 23.33 O ATOM 639 H ASP A 64 15.708 4.884 43.011 1.00 0.00 H ATOM 640 N GLU A 65 12.746 7.342 44.880 1.00 24.43 N ATOM 641 CA GLU A 65 12.556 8.541 45.704 1.00 26.74 C ATOM 642 C GLU A 65 13.504 8.602 46.886 1.00 29.41 C ATOM 643 O GLU A 65 13.695 9.651 47.479 1.00 27.06 O ATOM 644 CB GLU A 65 11.112 8.632 46.174 1.00 28.72 C ATOM 645 CG GLU A 65 10.135 8.796 45.043 1.00 36.14 C ATOM 646 CD GLU A 65 9.277 10.043 45.193 1.00 44.95 C ATOM 647 OE1 GLU A 65 8.064 9.878 45.439 1.00 45.74 O ATOM 648 OE2 GLU A 65 9.821 11.190 45.113 1.00 61.77 O ATOM 649 H GLU A 65 11.978 6.641 44.854 1.00 0.00 H ATOM 650 N GLN A 66 14.070 7.465 47.236 1.00 27.52 N ATOM 651 CA GLN A 66 15.023 7.379 48.333 1.00 30.60 C ATOM 652 C GLN A 66 16.460 7.293 47.825 1.00 26.83 C ATOM 653 O GLN A 66 17.376 7.036 48.575 1.00 27.66 O ATOM 654 CB GLN A 66 14.718 6.111 49.141 1.00 35.37 C ATOM 655 CG GLN A 66 13.244 5.777 49.446 1.00 42.75 C ATOM 656 CD GLN A 66 12.951 4.253 49.154 1.00 54.07 C ATOM 657 OE1 GLN A 66 13.883 3.440 49.156 1.00 54.21 O ATOM 658 NE2 GLN A 66 11.689 3.891 48.867 1.00 51.22 N ATOM 659 HE22 GLN A 66 10.930 4.602 48.875 1.00 0.00 H ATOM 660 HE21 GLN A 66 11.472 2.900 48.637 1.00 0.00 H ATOM 661 H GLN A 66 13.828 6.600 46.711 1.00 0.00 H ATOM 662 N GLY A 67 16.662 7.501 46.525 1.00 24.73 N ATOM 663 CA GLY A 67 18.002 7.516 45.955 1.00 23.32 C ATOM 664 C GLY A 67 18.560 6.126 45.668 1.00 22.91 C ATOM 665 O GLY A 67 19.747 5.982 45.358 1.00 25.46 O ATOM 666 H GLY A 67 15.844 7.656 45.902 1.00 0.00 H ATOM 667 N VAL A 68 17.695 5.129 45.747 1.00 23.15 N ATOM 668 CA VAL A 68 18.095 3.751 45.499 1.00 21.72 C ATOM 669 C VAL A 68 18.079 3.403 43.972 1.00 20.62 C ATOM 670 O VAL A 68 17.185 3.709 43.244 1.00 18.78 O ATOM 671 CB VAL A 68 17.287 2.711 46.296 1.00 22.84 C ATOM 672 CG1 VAL A 68 17.858 1.279 46.070 1.00 22.49 C ATOM 673 CG2 VAL A 68 17.313 3.035 47.794 1.00 22.37 C ATOM 674 H VAL A 68 16.705 5.334 45.992 1.00 0.00 H ATOM 675 N ASN A 69 19.133 2.739 43.588 1.00 21.37 N ATOM 676 CA ASN A 69 19.317 2.211 42.223 1.00 19.72 C ATOM 677 C ASN A 69 18.115 1.446 41.683 1.00 17.51 C ATOM 678 O ASN A 69 17.568 0.565 42.322 1.00 17.79 O ATOM 679 CB ASN A 69 20.549 1.339 42.200 1.00 20.30 C ATOM 680 CG ASN A 69 20.823 0.722 40.823 1.00 21.30 C ATOM 681 OD1 ASN A 69 20.943 1.448 39.825 1.00 20.79 O ATOM 682 ND2 ASN A 69 20.963 -0.576 40.767 1.00 20.99 N ATOM 683 HD22 ASN A 69 20.854 -1.148 41.628 1.00 0.00 H ATOM 684 HD21 ASN A 69 21.183 -1.037 39.861 1.00 0.00 H ATOM 685 H ASN A 69 19.887 2.572 44.284 1.00 0.00 H ATOM 686 N LEU A 70 17.698 1.834 40.471 1.00 16.44 N ATOM 687 CA LEU A 70 16.676 1.092 39.722 1.00 17.56 C ATOM 688 C LEU A 70 17.245 0.226 38.567 1.00 16.77 C ATOM 689 O LEU A 70 16.521 -0.623 37.966 1.00 18.57 O ATOM 690 CB LEU A 70 15.603 2.033 39.186 1.00 18.94 C ATOM 691 CG LEU A 70 14.797 2.779 40.266 1.00 17.54 C ATOM 692 CD1 LEU A 70 13.745 3.659 39.638 1.00 17.93 C ATOM 693 CD2 LEU A 70 14.131 1.793 41.173 1.00 17.64 C ATOM 694 H LEU A 70 18.111 2.689 40.046 1.00 0.00 H ATOM 695 N GLU A 71 18.534 0.431 38.314 1.00 16.64 N ATOM 696 CA GLU A 71 19.330 -0.413 37.413 1.00 16.61 C ATOM 697 C GLU A 71 18.934 -0.207 35.978 1.00 16.39 C ATOM 698 O GLU A 71 19.128 -1.090 35.116 1.00 15.37 O ATOM 699 CB GLU A 71 19.270 -1.869 37.798 1.00 17.21 C ATOM 700 CG GLU A 71 20.357 -2.740 37.133 1.00 17.74 C ATOM 701 CD GLU A 71 21.772 -2.265 37.294 1.00 18.85 C ATOM 702 OE1 GLU A 71 22.081 -1.605 38.303 1.00 19.18 O ATOM 703 OE2 GLU A 71 22.593 -2.577 36.416 1.00 17.95 O ATOM 704 H GLU A 71 19.005 1.233 38.780 1.00 0.00 H ATOM 705 N LEU A 72 18.365 0.980 35.710 1.00 15.09 N ATOM 706 CA LEU A 72 17.994 1.360 34.299 1.00 16.76 C ATOM 707 C LEU A 72 18.655 2.617 33.941 1.00 15.19 C ATOM 708 O LEU A 72 18.643 3.568 34.727 1.00 16.74 O ATOM 709 CB LEU A 72 16.472 1.576 34.151 1.00 16.05 C ATOM 710 CG LEU A 72 15.605 0.335 34.426 1.00 16.82 C ATOM 711 CD1 LEU A 72 14.141 0.751 34.621 1.00 18.03 C ATOM 712 CD2 LEU A 72 15.794 -0.736 33.348 1.00 16.75 C ATOM 713 H LEU A 72 18.178 1.646 36.487 1.00 0.00 H ATOM 714 N THR A 73 19.206 2.672 32.723 1.00 15.12 N ATOM 715 CA THR A 73 19.704 3.910 32.151 1.00 13.98 C ATOM 716 C THR A 73 18.901 4.279 30.904 1.00 14.32 C ATOM 717 O THR A 73 18.801 3.489 29.956 1.00 15.07 O ATOM 718 CB THR A 73 21.200 3.828 31.835 1.00 14.62 C ATOM 719 OG1 THR A 73 21.913 3.556 33.048 1.00 17.13 O ATOM 720 CG2 THR A 73 21.702 5.115 31.248 1.00 13.77 C ATOM 721 HG1 THR A 73 22.882 3.501 32.854 1.00 0.00 H ATOM 722 H THR A 73 19.280 1.797 32.166 1.00 0.00 H ATOM 723 N LEU A 74 18.363 5.471 30.873 1.00 14.67 N ATOM 724 CA LEU A 74 17.648 5.972 29.697 1.00 15.76 C ATOM 725 C LEU A 74 18.662 6.670 28.846 1.00 15.57 C ATOM 726 O LEU A 74 19.354 7.562 29.326 1.00 17.05 O ATOM 727 CB LEU A 74 16.537 6.953 30.074 1.00 15.72 C ATOM 728 CG LEU A 74 15.426 6.461 30.973 1.00 19.35 C ATOM 729 CD1 LEU A 74 14.428 7.542 31.321 1.00 21.08 C ATOM 730 CD2 LEU A 74 14.679 5.332 30.329 1.00 20.98 C ATOM 731 H LEU A 74 18.446 6.082 31.710 1.00 0.00 H ATOM 732 N ILE A 75 18.703 6.309 27.556 1.00 14.82 N ATOM 733 CA ILE A 75 19.623 6.950 26.651 1.00 14.49 C ATOM 734 C ILE A 75 18.906 7.596 25.501 1.00 15.27 C ATOM 735 O ILE A 75 17.961 7.042 24.937 1.00 17.59 O ATOM 736 CB ILE A 75 20.758 6.023 26.139 1.00 14.04 C ATOM 737 CG1 ILE A 75 20.225 4.896 25.290 1.00 13.39 C ATOM 738 CG2 ILE A 75 21.614 5.536 27.331 1.00 13.67 C ATOM 739 CD1 ILE A 75 21.292 3.999 24.749 1.00 13.40 C ATOM 740 H ILE A 75 18.068 5.563 27.207 1.00 0.00 H ATOM 741 N THR A 76 19.324 8.794 25.161 1.00 14.87 N ATOM 742 CA THR A 76 18.806 9.507 24.024 1.00 14.40 C ATOM 743 C THR A 76 19.808 9.401 22.910 1.00 14.12 C ATOM 744 O THR A 76 20.961 9.794 23.049 1.00 14.51 O ATOM 745 CB THR A 76 18.523 11.012 24.328 1.00 14.44 C ATOM 746 OG1 THR A 76 17.538 11.109 25.345 1.00 14.62 O ATOM 747 CG2 THR A 76 17.999 11.700 23.137 1.00 15.66 C ATOM 748 HG1 THR A 76 17.866 10.661 26.165 1.00 0.00 H ATOM 749 H THR A 76 20.061 9.246 25.739 1.00 0.00 H ATOM 750 N LEU A 77 19.377 8.872 21.767 1.00 14.75 N ATOM 751 CA LEU A 77 20.314 8.611 20.672 1.00 15.48 C ATOM 752 C LEU A 77 20.306 9.695 19.594 1.00 14.81 C ATOM 753 O LEU A 77 19.244 10.268 19.262 1.00 14.80 O ATOM 754 CB LEU A 77 19.971 7.248 20.012 1.00 17.24 C ATOM 755 CG LEU A 77 19.917 6.042 20.939 1.00 18.53 C ATOM 756 CD1 LEU A 77 19.315 4.866 20.172 1.00 19.36 C ATOM 757 CD2 LEU A 77 21.331 5.765 21.478 1.00 17.78 C ATOM 758 H LEU A 77 18.369 8.643 21.651 1.00 0.00 H ATOM 759 N ASP A 78 21.468 9.910 18.985 1.00 16.06 N ATOM 760 CA ASP A 78 21.586 10.807 17.830 1.00 16.25 C ATOM 761 C ASP A 78 21.313 9.985 16.529 1.00 20.28 C ATOM 762 O ASP A 78 22.201 9.469 15.878 1.00 19.42 O ATOM 763 CB ASP A 78 22.976 11.404 17.780 1.00 18.88 C ATOM 764 CG ASP A 78 23.174 12.390 16.624 1.00 20.05 C ATOM 765 OD1 ASP A 78 22.193 12.822 15.949 1.00 20.02 O ATOM 766 OD2 ASP A 78 24.332 12.769 16.449 1.00 20.74 O ATOM 767 H ASP A 78 22.319 9.428 19.338 1.00 0.00 H ATOM 768 N THR A 79 20.068 9.852 16.207 1.00 21.93 N ATOM 769 CA THR A 79 19.673 9.007 15.086 1.00 23.23 C ATOM 770 C THR A 79 18.572 9.717 14.365 1.00 21.15 C ATOM 771 O THR A 79 17.898 10.569 14.909 1.00 19.68 O ATOM 772 CB THR A 79 19.094 7.681 15.621 1.00 24.34 C ATOM 773 OG1 THR A 79 18.555 6.885 14.573 1.00 26.36 O ATOM 774 CG2 THR A 79 17.913 7.956 16.439 1.00 24.98 C ATOM 775 HG1 THR A 79 18.193 6.045 14.951 1.00 0.00 H ATOM 776 H THR A 79 19.339 10.354 16.754 1.00 0.00 H ATOM 777 N ASN A 80 18.360 9.322 13.118 1.00 22.56 N ATOM 778 CA ASN A 80 17.195 9.704 12.306 1.00 24.71 C ATOM 779 C ASN A 80 15.958 8.838 12.530 1.00 25.98 C ATOM 780 O ASN A 80 14.808 9.238 12.269 1.00 27.77 O ATOM 781 CB ASN A 80 17.562 9.526 10.834 1.00 25.54 C ATOM 782 CG ASN A 80 18.668 10.454 10.390 1.00 26.95 C ATOM 783 OD1 ASN A 80 19.650 10.053 9.739 1.00 36.22 O ATOM 784 ND2 ASN A 80 18.522 11.686 10.731 1.00 24.06 N ATOM 785 HD22 ASN A 80 17.686 11.979 11.275 1.00 0.00 H ATOM 786 HD21 ASN A 80 19.240 12.389 10.462 1.00 0.00 H ATOM 787 H ASN A 80 19.068 8.697 12.682 1.00 0.00 H ATOM 788 N GLU A 81 16.169 7.648 13.023 1.00 25.69 N ATOM 789 CA GLU A 81 15.043 6.762 13.373 1.00 27.23 C ATOM 790 C GLU A 81 14.260 7.264 14.595 1.00 26.10 C ATOM 791 O GLU A 81 14.858 7.726 15.564 1.00 29.54 O ATOM 792 CB GLU A 81 15.544 5.360 13.635 1.00 28.73 C ATOM 793 CG GLU A 81 14.597 4.507 14.449 1.00 31.05 C ATOM 794 CD GLU A 81 14.845 3.023 14.254 1.00 33.58 C ATOM 795 OE1 GLU A 81 16.012 2.641 14.182 1.00 33.39 O ATOM 796 OE2 GLU A 81 13.858 2.257 14.137 1.00 34.72 O ATOM 797 H GLU A 81 17.145 7.320 13.171 1.00 0.00 H ATOM 798 N LYS A 82 12.935 7.195 14.527 1.00 22.77 N ATOM 799 CA LYS A 82 12.083 7.250 15.700 1.00 22.65 C ATOM 800 C LYS A 82 11.554 5.860 15.956 1.00 22.91 C ATOM 801 O LYS A 82 10.939 5.230 15.083 1.00 22.79 O ATOM 802 CB LYS A 82 10.911 8.178 15.518 1.00 24.83 C ATOM 803 CG LYS A 82 11.303 9.651 15.417 1.00 29.72 C ATOM 804 CD LYS A 82 10.098 10.561 15.347 1.00 30.81 C ATOM 805 CE LYS A 82 10.452 12.004 15.795 1.00 37.27 C ATOM 806 NZ LYS A 82 10.768 12.333 17.250 1.00 39.24 N ATOM 807 HZ1 LYS A 82 9.948 12.095 17.844 1.00 0.00 H ATOM 808 HZ2 LYS A 82 11.593 11.780 17.558 1.00 0.00 H ATOM 809 HZ3 LYS A 82 10.977 13.348 17.337 1.00 0.00 H ATOM 810 H LYS A 82 12.489 7.097 13.592 1.00 0.00 H ATOM 811 N PHE A 83 11.858 5.314 17.113 1.00 17.77 N ATOM 812 CA PHE A 83 11.382 3.980 17.421 1.00 16.51 C ATOM 813 C PHE A 83 9.870 3.959 17.373 1.00 16.86 C ATOM 814 O PHE A 83 9.192 4.904 17.790 1.00 15.39 O ATOM 815 CB PHE A 83 11.794 3.514 18.810 1.00 15.65 C ATOM 816 CG PHE A 83 13.272 3.379 19.007 1.00 16.34 C ATOM 817 CD1 PHE A 83 13.955 2.391 18.368 1.00 15.69 C ATOM 818 CD2 PHE A 83 13.964 4.215 19.907 1.00 16.72 C ATOM 819 CE1 PHE A 83 15.337 2.232 18.556 1.00 15.57 C ATOM 820 CE2 PHE A 83 15.326 4.059 20.076 1.00 15.26 C ATOM 821 CZ PHE A 83 15.993 3.048 19.399 1.00 15.17 C ATOM 822 H PHE A 83 12.436 5.836 17.802 1.00 0.00 H ATOM 823 N ARG A 84 9.328 2.829 16.901 1.00 15.45 N ATOM 824 CA ARG A 84 7.901 2.630 17.007 1.00 17.35 C ATOM 825 C ARG A 84 7.525 2.794 18.481 1.00 17.78 C ATOM 826 O ARG A 84 8.165 2.238 19.354 1.00 16.87 O ATOM 827 CB ARG A 84 7.440 1.265 16.549 1.00 18.71 C ATOM 828 CG ARG A 84 6.014 1.050 17.003 1.00 20.27 C ATOM 829 CD ARG A 84 5.538 -0.305 16.842 1.00 22.58 C ATOM 830 NE ARG A 84 6.319 -1.294 17.593 1.00 21.03 N ATOM 831 CZ ARG A 84 5.923 -2.542 17.746 1.00 22.08 C ATOM 832 NH1 ARG A 84 4.753 -2.903 17.281 1.00 23.92 N ATOM 833 NH2 ARG A 84 6.672 -3.441 18.386 1.00 22.33 N ATOM 834 HE ARG A 84 7.220 -0.999 18.021 1.00 0.00 H ATOM 835 HH12 ARG A 84 4.428 -3.884 17.395 1.00 0.00 H ATOM 836 HH11 ARG A 84 4.149 -2.208 16.798 1.00 0.00 H ATOM 837 HH22 ARG A 84 6.334 -4.419 18.492 1.00 0.00 H ATOM 838 HH21 ARG A 84 7.594 -3.164 18.779 1.00 0.00 H ATOM 839 H ARG A 84 9.928 2.102 16.462 1.00 0.00 H ATOM 840 N ASP A 85 6.578 3.688 18.767 1.00 16.96 N ATOM 841 CA ASP A 85 6.257 4.018 20.139 1.00 17.30 C ATOM 842 C ASP A 85 5.521 2.893 20.791 1.00 18.63 C ATOM 843 O ASP A 85 4.374 2.606 20.443 1.00 20.51 O ATOM 844 CB ASP A 85 5.441 5.332 20.163 1.00 18.38 C ATOM 845 CG ASP A 85 5.088 5.809 21.546 1.00 20.98 C ATOM 846 OD1 ASP A 85 5.120 5.038 22.509 1.00 19.53 O ATOM 847 OD2 ASP A 85 4.750 7.024 21.667 1.00 20.21 O ATOM 848 H ASP A 85 6.063 4.155 17.993 1.00 0.00 H ATOM 849 N ILE A 86 6.176 2.254 21.762 1.00 18.32 N ATOM 850 CA ILE A 86 5.569 1.138 22.508 1.00 16.69 C ATOM 851 C ILE A 86 5.189 1.489 23.937 1.00 15.94 C ATOM 852 O ILE A 86 4.950 0.596 24.735 1.00 15.68 O ATOM 853 CB ILE A 86 6.470 -0.118 22.548 1.00 18.02 C ATOM 854 CG1 ILE A 86 7.832 0.233 23.103 1.00 18.84 C ATOM 855 CG2 ILE A 86 6.626 -0.687 21.149 1.00 18.57 C ATOM 856 CD1 ILE A 86 8.651 -0.939 23.540 1.00 20.64 C ATOM 857 H ILE A 86 7.144 2.553 21.999 1.00 0.00 H ATOM 858 N THR A 87 5.114 2.782 24.270 1.00 15.79 N ATOM 859 CA THR A 87 4.767 3.193 25.636 1.00 16.82 C ATOM 860 C THR A 87 3.390 2.658 26.112 1.00 16.80 C ATOM 861 O THR A 87 3.194 2.355 27.275 1.00 15.95 O ATOM 862 CB THR A 87 4.819 4.734 25.809 1.00 19.33 C ATOM 863 OG1 THR A 87 3.986 5.380 24.863 1.00 18.09 O ATOM 864 CG2 THR A 87 6.250 5.214 25.608 1.00 22.66 C ATOM 865 HG1 THR A 87 4.289 5.152 23.948 1.00 0.00 H ATOM 866 H THR A 87 5.304 3.508 23.550 1.00 0.00 H ATOM 867 N LYS A 88 2.445 2.543 25.189 1.00 18.75 N ATOM 868 CA LYS A 88 1.110 2.041 25.549 1.00 18.67 C ATOM 869 C LYS A 88 1.146 0.610 26.069 1.00 20.11 C ATOM 870 O LYS A 88 0.263 0.193 26.804 1.00 20.33 O ATOM 871 CB LYS A 88 0.188 2.143 24.343 1.00 20.32 C ATOM 872 CG LYS A 88 0.552 1.244 23.167 1.00 23.12 C ATOM 873 CD LYS A 88 -0.620 1.120 22.187 1.00 25.80 C ATOM 874 CE LYS A 88 -0.707 2.281 21.199 1.00 29.67 C ATOM 875 NZ LYS A 88 0.071 2.022 19.978 1.00 30.13 N ATOM 876 HZ1 LYS A 88 1.070 1.881 20.229 1.00 0.00 H ATOM 877 HZ2 LYS A 88 -0.294 1.168 19.510 1.00 0.00 H ATOM 878 HZ3 LYS A 88 -0.015 2.835 19.335 1.00 0.00 H ATOM 879 H LYS A 88 2.649 2.809 24.205 1.00 0.00 H ATOM 880 N PHE A 89 2.127 -0.171 25.598 1.00 17.26 N ATOM 881 CA PHE A 89 2.341 -1.552 26.044 1.00 19.62 C ATOM 882 C PHE A 89 3.009 -1.693 27.411 1.00 18.74 C ATOM 883 O PHE A 89 3.018 -2.793 28.006 1.00 19.75 O ATOM 884 CB PHE A 89 3.151 -2.340 25.025 1.00 20.39 C ATOM 885 CG PHE A 89 2.510 -2.410 23.675 1.00 20.14 C ATOM 886 CD1 PHE A 89 1.176 -2.702 23.544 1.00 22.63 C ATOM 887 CD2 PHE A 89 3.263 -2.209 22.536 1.00 22.32 C ATOM 888 CE1 PHE A 89 0.589 -2.770 22.295 1.00 22.56 C ATOM 889 CE2 PHE A 89 2.708 -2.261 21.286 1.00 21.77 C ATOM 890 CZ PHE A 89 1.347 -2.527 21.159 1.00 24.32 C ATOM 891 H PHE A 89 2.769 0.221 24.880 1.00 0.00 H ATOM 892 N ILE A 90 3.541 -0.607 27.925 1.00 16.58 N ATOM 893 CA ILE A 90 4.203 -0.568 29.206 1.00 18.23 C ATOM 894 C ILE A 90 3.166 -0.139 30.285 1.00 19.37 C ATOM 895 O ILE A 90 2.526 0.921 30.153 1.00 20.47 O ATOM 896 CB ILE A 90 5.379 0.429 29.142 1.00 17.18 C ATOM 897 CG1 ILE A 90 6.361 -0.006 28.057 1.00 17.48 C ATOM 898 CG2 ILE A 90 6.108 0.508 30.476 1.00 17.54 C ATOM 899 CD1 ILE A 90 7.606 0.883 27.884 1.00 18.14 C ATOM 900 H ILE A 90 3.481 0.275 27.377 1.00 0.00 H ATOM 901 N PRO A 91 3.020 -0.938 31.327 1.00 21.84 N ATOM 902 CA PRO A 91 2.020 -0.654 32.327 1.00 22.67 C ATOM 903 C PRO A 91 2.374 0.622 33.099 1.00 25.82 C ATOM 904 O PRO A 91 3.542 0.978 33.234 1.00 22.29 O ATOM 905 CB PRO A 91 2.026 -1.910 33.226 1.00 24.77 C ATOM 906 CG PRO A 91 3.348 -2.557 32.998 1.00 23.99 C ATOM 907 CD PRO A 91 3.807 -2.164 31.628 1.00 22.47 C ATOM 908 N GLU A 92 1.347 1.296 33.594 1.00 25.87 N ATOM 909 CA GLU A 92 1.491 2.463 34.432 1.00 32.55 C ATOM 910 C GLU A 92 2.215 2.156 35.731 1.00 31.56 C ATOM 911 O GLU A 92 2.853 3.023 36.307 1.00 32.33 O ATOM 912 CB GLU A 92 0.113 3.055 34.717 1.00 33.65 C ATOM 913 CG GLU A 92 -0.479 3.687 33.488 1.00 40.10 C ATOM 914 CD GLU A 92 -0.705 5.178 33.620 1.00 45.48 C ATOM 915 OE1 GLU A 92 0.291 5.953 33.574 1.00 49.29 O ATOM 916 OE2 GLU A 92 -1.893 5.564 33.684 1.00 51.77 O ATOM 917 H GLU A 92 0.387 0.968 33.367 1.00 0.00 H ATOM 918 N ASN A 93 2.117 0.905 36.181 1.00 31.57 N ATOM 919 CA ASN A 93 2.857 0.470 37.338 1.00 29.99 C ATOM 920 C ASN A 93 3.465 -0.861 37.134 1.00 27.31 C ATOM 921 O ASN A 93 2.964 -1.666 36.383 1.00 24.73 O ATOM 922 CB ASN A 93 1.965 0.321 38.599 1.00 31.49 C ATOM 923 CG ASN A 93 1.445 1.632 39.110 1.00 33.59 C ATOM 924 OD1 ASN A 93 0.235 1.803 39.248 1.00 43.11 O ATOM 925 ND2 ASN A 93 2.331 2.526 39.480 1.00 31.17 N ATOM 926 HD22 ASN A 93 3.345 2.340 39.345 1.00 0.00 H ATOM 927 HD21 ASN A 93 2.019 3.421 39.909 1.00 0.00 H ATOM 928 H ASN A 93 1.496 0.232 35.689 1.00 0.00 H ATOM 929 N ILE A 94 4.531 -1.100 37.876 1.00 29.84 N ATOM 930 CA ILE A 94 5.218 -2.335 37.771 1.00 28.68 C ATOM 931 C ILE A 94 4.244 -3.427 38.059 1.00 31.48 C ATOM 932 O ILE A 94 3.606 -3.468 39.114 1.00 36.57 O ATOM 933 CB ILE A 94 6.422 -2.354 38.682 1.00 31.28 C ATOM 934 CG1 ILE A 94 7.288 -1.180 38.241 1.00 30.37 C ATOM 935 CG2 ILE A 94 7.179 -3.663 38.555 1.00 33.17 C ATOM 936 CD1 ILE A 94 8.592 -1.066 38.919 1.00 31.36 C ATOM 937 H ILE A 94 4.869 -0.376 38.542 1.00 0.00 H ATOM 938 N SER A 95 4.155 -4.317 37.082 1.00 27.58 N ATOM 939 CA SER A 95 3.177 -5.348 37.047 1.00 28.43 C ATOM 940 C SER A 95 3.803 -6.717 36.860 1.00 29.03 C ATOM 941 O SER A 95 4.667 -6.925 35.980 1.00 25.96 O ATOM 942 CB SER A 95 2.264 -5.123 35.866 1.00 27.05 C ATOM 943 OG SER A 95 1.677 -3.841 35.948 1.00 31.97 O ATOM 944 HG SER A 95 2.389 -3.153 35.947 1.00 0.00 H ATOM 945 H SER A 95 4.837 -4.258 36.299 1.00 0.00 H ATOM 946 N THR A 96 3.306 -7.649 37.646 1.00 26.45 N ATOM 947 CA THR A 96 3.551 -9.072 37.506 1.00 26.47 C ATOM 948 C THR A 96 2.929 -9.686 36.256 1.00 26.54 C ATOM 949 O THR A 96 2.128 -9.053 35.586 1.00 26.24 O ATOM 950 CB THR A 96 3.002 -9.845 38.729 1.00 25.16 C ATOM 951 OG1 THR A 96 1.603 -9.622 38.824 1.00 26.96 O ATOM 952 CG2 THR A 96 3.637 -9.370 39.971 1.00 25.28 C ATOM 953 HG1 THR A 96 1.244 -10.114 39.605 1.00 0.00 H ATOM 954 H THR A 96 2.691 -7.342 38.426 1.00 0.00 H ATOM 955 N ALA A 97 3.283 -10.944 35.973 1.00 25.62 N ATOM 956 CA ALA A 97 2.680 -11.666 34.838 1.00 26.00 C ATOM 957 C ALA A 97 2.713 -13.157 34.948 1.00 25.89 C ATOM 958 O ALA A 97 3.508 -13.739 35.698 1.00 28.44 O ATOM 959 CB ALA A 97 3.375 -11.274 33.539 1.00 27.07 C ATOM 960 H ALA A 97 3.995 -11.420 36.563 1.00 0.00 H ATOM 961 N SER A 98 1.895 -13.817 34.150 1.00 25.63 N ATOM 962 CA SER A 98 1.937 -15.264 34.057 1.00 25.77 C ATOM 963 C SER A 98 2.641 -15.687 32.768 1.00 23.69 C ATOM 964 O SER A 98 2.337 -15.183 31.718 1.00 28.20 O ATOM 965 CB SER A 98 0.505 -15.850 34.062 1.00 25.95 C ATOM 966 OG SER A 98 -0.085 -15.738 35.319 1.00 26.87 O ATOM 967 HG SER A 98 -0.998 -16.121 35.289 1.00 0.00 H ATOM 968 H SER A 98 1.207 -13.289 33.576 1.00 0.00 H ATOM 969 N ASP A 99 3.516 -16.670 32.853 1.00 25.22 N ATOM 970 CA ASP A 99 4.034 -17.293 31.663 1.00 25.50 C ATOM 971 C ASP A 99 4.626 -16.271 30.683 1.00 21.05 C ATOM 972 O ASP A 99 4.254 -16.223 29.505 1.00 20.30 O ATOM 973 CB ASP A 99 2.903 -18.049 31.004 1.00 27.44 C ATOM 974 CG ASP A 99 3.301 -19.442 30.624 1.00 34.47 C ATOM 975 OD1 ASP A 99 4.380 -19.656 30.006 1.00 39.26 O ATOM 976 OD2 ASP A 99 2.562 -20.337 31.025 1.00 41.61 O ATOM 977 H ASP A 99 3.834 -16.998 33.787 1.00 0.00 H ATOM 978 N ALA A 100 5.541 -15.502 31.208 1.00 17.87 N ATOM 979 CA ALA A 100 6.254 -14.492 30.414 1.00 17.67 C ATOM 980 C ALA A 100 7.322 -15.117 29.557 1.00 17.23 C ATOM 981 O ALA A 100 7.783 -16.225 29.796 1.00 20.69 O ATOM 982 CB ALA A 100 6.840 -13.432 31.340 1.00 17.19 C ATOM 983 H ALA A 100 5.772 -15.607 32.217 1.00 0.00 H ATOM 984 N THR A 101 7.711 -14.368 28.513 1.00 17.88 N ATOM 985 CA THR A 101 8.741 -14.719 27.608 1.00 18.76 C ATOM 986 C THR A 101 9.761 -13.584 27.711 1.00 19.22 C ATOM 987 O THR A 101 9.427 -12.398 27.649 1.00 21.49 O ATOM 988 CB THR A 101 8.236 -14.914 26.149 1.00 20.97 C ATOM 989 OG1 THR A 101 7.259 -15.940 26.084 1.00 22.24 O ATOM 990 CG2 THR A 101 9.370 -15.309 25.214 1.00 21.28 C ATOM 991 HG1 THR A 101 6.489 -15.698 26.658 1.00 0.00 H ATOM 992 H THR A 101 7.220 -13.464 28.358 1.00 0.00 H ATOM 993 N LEU A 102 11.009 -13.975 27.841 1.00 16.01 N ATOM 994 CA LEU A 102 12.151 -13.074 27.822 1.00 16.23 C ATOM 995 C LEU A 102 12.654 -13.040 26.395 1.00 16.92 C ATOM 996 O LEU A 102 12.981 -14.062 25.770 1.00 16.36 O ATOM 997 CB LEU A 102 13.235 -13.559 28.773 1.00 14.59 C ATOM 998 CG LEU A 102 14.517 -12.816 28.901 1.00 17.28 C ATOM 999 CD1 LEU A 102 14.268 -11.390 29.380 1.00 20.35 C ATOM 1000 CD2 LEU A 102 15.391 -13.546 29.875 1.00 16.33 C ATOM 1001 H LEU A 102 11.191 -14.991 27.965 1.00 0.00 H ATOM 1002 N VAL A 103 12.678 -11.830 25.853 1.00 16.22 N ATOM 1003 CA VAL A 103 13.141 -11.638 24.483 1.00 17.06 C ATOM 1004 C VAL A 103 14.508 -11.011 24.458 1.00 15.73 C ATOM 1005 O VAL A 103 14.709 -9.848 24.816 1.00 16.34 O ATOM 1006 CB VAL A 103 12.205 -10.749 23.692 1.00 16.79 C ATOM 1007 CG1 VAL A 103 12.744 -10.540 22.284 1.00 18.11 C ATOM 1008 CG2 VAL A 103 10.818 -11.372 23.648 1.00 19.98 C ATOM 1009 H VAL A 103 12.364 -11.010 26.410 1.00 0.00 H ATOM 1010 N ILE A 104 15.448 -11.765 23.914 1.00 14.97 N ATOM 1011 CA ILE A 104 16.864 -11.384 23.888 1.00 15.42 C ATOM 1012 C ILE A 104 17.347 -11.176 22.461 1.00 13.60 C ATOM 1013 O ILE A 104 16.977 -11.911 21.561 1.00 13.96 O ATOM 1014 CB ILE A 104 17.706 -12.445 24.574 1.00 16.06 C ATOM 1015 CG1 ILE A 104 17.337 -12.514 26.075 1.00 16.88 C ATOM 1016 CG2 ILE A 104 19.202 -12.170 24.428 1.00 17.29 C ATOM 1017 CD1 ILE A 104 17.438 -13.885 26.634 1.00 17.56 C ATOM 1018 H ILE A 104 15.170 -12.671 23.484 1.00 0.00 H ATOM 1019 N ASN A 105 18.164 -10.136 22.254 1.00 13.04 N ATOM 1020 CA ASN A 105 18.712 -9.834 20.969 1.00 12.18 C ATOM 1021 C ASN A 105 20.112 -9.242 21.084 1.00 12.88 C ATOM 1022 O ASN A 105 20.290 -8.063 21.232 1.00 11.95 O ATOM 1023 CB ASN A 105 17.776 -8.975 20.118 1.00 11.38 C ATOM 1024 CG ASN A 105 18.109 -9.026 18.655 1.00 12.79 C ATOM 1025 OD1 ASN A 105 18.693 -9.981 18.152 1.00 12.84 O ATOM 1026 ND2 ASN A 105 17.758 -7.950 17.941 1.00 13.04 N ATOM 1027 HD22 ASN A 105 17.264 -7.159 18.401 1.00 0.00 H ATOM 1028 HD21 ASN A 105 17.979 -7.905 16.926 1.00 0.00 H ATOM 1029 H ASN A 105 18.409 -9.525 23.059 1.00 0.00 H ATOM 1030 N THR A 106 21.089 -10.116 20.926 1.00 14.04 N ATOM 1031 CA THR A 106 22.505 -9.805 20.980 1.00 15.60 C ATOM 1032 C THR A 106 23.225 -10.494 19.817 1.00 14.47 C ATOM 1033 O THR A 106 22.718 -11.428 19.254 1.00 12.92 O ATOM 1034 CB THR A 106 22.864 -10.452 22.305 1.00 18.18 C ATOM 1035 OG1 THR A 106 22.599 -9.555 23.416 1.00 20.16 O ATOM 1036 CG2 THR A 106 24.044 -11.213 22.311 1.00 14.78 C ATOM 1037 HG1 THR A 106 22.842 -10.002 24.265 1.00 0.00 H ATOM 1038 H THR A 106 20.822 -11.106 20.749 1.00 0.00 H ATOM 1039 N GLU A 107 24.446 -10.040 19.519 1.00 14.43 N ATOM 1040 CA GLU A 107 25.257 -10.688 18.485 1.00 15.52 C ATOM 1041 C GLU A 107 25.473 -12.150 18.826 1.00 15.05 C ATOM 1042 O GLU A 107 25.435 -12.997 17.969 1.00 16.45 O ATOM 1043 CB GLU A 107 26.593 -9.976 18.285 1.00 16.33 C ATOM 1044 CG GLU A 107 27.536 -10.731 17.348 1.00 19.44 C ATOM 1045 CD GLU A 107 28.904 -10.124 17.253 1.00 21.70 C ATOM 1046 OE1 GLU A 107 29.053 -8.932 17.444 1.00 25.92 O ATOM 1047 OE2 GLU A 107 29.867 -10.887 17.028 1.00 27.49 O ATOM 1048 H GLU A 107 24.826 -9.216 20.028 1.00 0.00 H ATOM 1049 N HIS A 108 25.557 -12.449 20.095 1.00 17.22 N ATOM 1050 CA HIS A 108 25.769 -13.833 20.546 1.00 16.70 C ATOM 1051 C HIS A 108 24.530 -14.665 20.698 1.00 15.89 C ATOM 1052 O HIS A 108 24.556 -15.894 20.547 1.00 16.36 O ATOM 1053 CB HIS A 108 26.545 -13.848 21.842 1.00 20.03 C ATOM 1054 CG HIS A 108 27.945 -13.299 21.725 1.00 22.20 C ATOM 1055 ND1 HIS A 108 28.679 -13.382 20.558 1.00 26.88 N ATOM 1056 CD2 HIS A 108 28.756 -12.697 22.639 1.00 22.64 C ATOM 1057 CE1 HIS A 108 29.855 -12.792 20.736 1.00 26.76 C ATOM 1058 NE2 HIS A 108 29.934 -12.396 21.995 1.00 26.31 N ATOM 1059 H HIS A 108 25.472 -11.691 20.802 1.00 0.00 H ATOM 1060 N MET A 109 23.455 -13.980 21.033 1.00 14.89 N ATOM 1061 CA MET A 109 22.121 -14.497 21.278 1.00 15.53 C ATOM 1062 C MET A 109 21.093 -13.724 20.492 1.00 15.32 C ATOM 1063 O MET A 109 20.274 -12.983 21.029 1.00 14.00 O ATOM 1064 CB MET A 109 21.771 -14.553 22.792 1.00 14.64 C ATOM 1065 CG MET A 109 22.527 -15.704 23.505 1.00 17.08 C ATOM 1066 SD MET A 109 22.241 -15.853 25.316 1.00 20.30 S ATOM 1067 CE MET A 109 23.695 -15.020 25.870 1.00 21.11 C ATOM 1068 H MET A 109 23.576 -12.952 21.133 1.00 0.00 H ATOM 1069 N PRO A 110 21.152 -13.869 19.190 1.00 13.89 N ATOM 1070 CA PRO A 110 20.253 -13.122 18.327 1.00 15.19 C ATOM 1071 C PRO A 110 18.842 -13.705 18.323 1.00 13.88 C ATOM 1072 O PRO A 110 18.672 -14.918 18.314 1.00 14.91 O ATOM 1073 CB PRO A 110 20.922 -13.266 16.951 1.00 14.67 C ATOM 1074 CG PRO A 110 21.585 -14.559 16.999 1.00 14.94 C ATOM 1075 CD PRO A 110 22.144 -14.610 18.402 1.00 15.39 C ATOM 1076 N SER A 111 17.846 -12.836 18.357 1.00 15.16 N ATOM 1077 CA SER A 111 16.426 -13.229 18.196 1.00 14.14 C ATOM 1078 C SER A 111 16.046 -14.433 19.050 1.00 15.04 C ATOM 1079 O SER A 111 15.418 -15.384 18.580 1.00 15.13 O ATOM 1080 CB SER A 111 16.132 -13.480 16.745 1.00 14.83 C ATOM 1081 OG SER A 111 16.207 -12.262 16.043 1.00 14.83 O ATOM 1082 HG SER A 111 16.014 -12.422 15.085 1.00 0.00 H ATOM 1083 H SER A 111 18.069 -11.831 18.503 1.00 0.00 H ATOM 1084 N MET A 112 16.416 -14.360 20.323 1.00 14.92 N ATOM 1085 CA MET A 112 16.269 -15.481 21.239 1.00 15.07 C ATOM 1086 C MET A 112 15.055 -15.296 22.146 1.00 16.99 C ATOM 1087 O MET A 112 14.898 -14.273 22.796 1.00 15.73 O ATOM 1088 CB MET A 112 17.520 -15.615 22.058 1.00 15.09 C ATOM 1089 CG MET A 112 17.548 -16.836 22.981 1.00 15.14 C ATOM 1090 SD MET A 112 18.962 -16.803 24.043 1.00 16.21 S ATOM 1091 CE MET A 112 18.913 -18.441 24.719 1.00 16.61 C ATOM 1092 H MET A 112 16.825 -13.472 20.677 1.00 0.00 H ATOM 1093 N PHE A 113 14.219 -16.311 22.206 1.00 18.69 N ATOM 1094 CA PHE A 113 13.003 -16.346 23.023 1.00 19.23 C ATOM 1095 C PHE A 113 13.166 -17.351 24.137 1.00 19.18 C ATOM 1096 O PHE A 113 13.490 -18.485 23.882 1.00 17.88 O ATOM 1097 CB PHE A 113 11.790 -16.749 22.175 1.00 22.12 C ATOM 1098 CG PHE A 113 11.330 -15.709 21.215 1.00 27.14 C ATOM 1099 CD1 PHE A 113 12.070 -14.566 20.970 1.00 34.88 C ATOM 1100 CD2 PHE A 113 10.171 -15.894 20.511 1.00 28.79 C ATOM 1101 CE1 PHE A 113 11.632 -13.633 20.054 1.00 34.77 C ATOM 1102 CE2 PHE A 113 9.729 -14.965 19.571 1.00 31.19 C ATOM 1103 CZ PHE A 113 10.469 -13.840 19.348 1.00 34.49 C ATOM 1104 H PHE A 113 14.438 -17.150 21.631 1.00 0.00 H ATOM 1105 N VAL A 114 12.971 -16.923 25.381 1.00 19.52 N ATOM 1106 CA VAL A 114 13.176 -17.782 26.532 1.00 19.65 C ATOM 1107 C VAL A 114 11.927 -17.773 27.403 1.00 20.36 C ATOM 1108 O VAL A 114 11.525 -16.718 27.915 1.00 17.99 O ATOM 1109 CB VAL A 114 14.356 -17.278 27.373 1.00 20.09 C ATOM 1110 CG1 VAL A 114 14.494 -18.081 28.650 1.00 20.49 C ATOM 1111 CG2 VAL A 114 15.644 -17.371 26.584 1.00 22.09 C ATOM 1112 H VAL A 114 12.662 -15.942 25.533 1.00 0.00 H ATOM 1113 N PRO A 115 11.300 -18.944 27.597 1.00 23.16 N ATOM 1114 CA PRO A 115 10.112 -18.961 28.403 1.00 24.83 C ATOM 1115 C PRO A 115 10.483 -18.935 29.839 1.00 23.94 C ATOM 1116 O PRO A 115 10.831 -19.969 30.389 1.00 33.19 O ATOM 1117 CB PRO A 115 9.524 -20.327 28.103 1.00 28.01 C ATOM 1118 CG PRO A 115 10.703 -21.180 27.954 1.00 24.92 C ATOM 1119 CD PRO A 115 11.825 -20.292 27.404 1.00 26.79 C ATOM 1120 N VAL A 116 10.385 -17.793 30.497 1.00 22.47 N ATOM 1121 CA VAL A 116 10.818 -17.702 31.923 1.00 21.35 C ATOM 1122 C VAL A 116 9.704 -18.081 32.943 1.00 21.48 C ATOM 1123 O VAL A 116 9.969 -18.202 34.134 1.00 20.07 O ATOM 1124 CB VAL A 116 11.411 -16.303 32.266 1.00 19.98 C ATOM 1125 CG1 VAL A 116 12.745 -16.066 31.542 1.00 20.04 C ATOM 1126 CG2 VAL A 116 10.422 -15.187 31.938 1.00 20.49 C ATOM 1127 H VAL A 116 10.004 -16.952 30.018 1.00 0.00 H ATOM 1128 N GLY A 117 8.476 -18.195 32.501 1.00 24.51 N ATOM 1129 CA GLY A 117 7.396 -18.551 33.438 1.00 24.41 C ATOM 1130 C GLY A 117 6.826 -17.331 34.139 1.00 28.23 C ATOM 1131 O GLY A 117 6.979 -16.187 33.657 1.00 22.73 O ATOM 1132 H GLY A 117 8.265 -18.035 31.495 1.00 0.00 H ATOM 1133 N ASP A 118 6.105 -17.549 35.243 1.00 28.07 N ATOM 1134 CA ASP A 118 5.516 -16.437 35.931 1.00 26.56 C ATOM 1135 C ASP A 118 6.562 -15.485 36.477 1.00 24.94 C ATOM 1136 O ASP A 118 7.608 -15.857 36.955 1.00 24.02 O ATOM 1137 CB ASP A 118 4.638 -16.904 37.121 1.00 29.56 C ATOM 1138 CG ASP A 118 3.475 -17.793 36.702 1.00 32.23 C ATOM 1139 OD1 ASP A 118 3.157 -17.939 35.507 1.00 26.90 O ATOM 1140 OD2 ASP A 118 2.849 -18.328 37.648 1.00 33.37 O ATOM 1141 H ASP A 118 5.972 -18.517 35.600 1.00 0.00 H ATOM 1142 N VAL A 119 6.183 -14.214 36.475 1.00 23.80 N ATOM 1143 CA VAL A 119 6.971 -13.126 36.976 1.00 22.80 C ATOM 1144 C VAL A 119 6.353 -12.487 38.190 1.00 23.67 C ATOM 1145 O VAL A 119 5.254 -11.990 38.102 1.00 28.70 O ATOM 1146 CB VAL A 119 7.127 -12.011 35.903 1.00 22.96 C ATOM 1147 CG1 VAL A 119 7.894 -10.843 36.440 1.00 23.07 C ATOM 1148 CG2 VAL A 119 7.813 -12.578 34.669 1.00 23.96 C ATOM 1149 H VAL A 119 5.247 -13.990 36.082 1.00 0.00 H ATOM 1150 N VAL A 120 7.073 -12.471 39.309 1.00 25.06 N ATOM 1151 CA VAL A 120 6.486 -12.026 40.573 1.00 24.34 C ATOM 1152 C VAL A 120 7.180 -10.839 41.211 1.00 26.25 C ATOM 1153 O VAL A 120 8.376 -10.599 40.999 1.00 24.15 O ATOM 1154 CB VAL A 120 6.444 -13.185 41.602 1.00 25.54 C ATOM 1155 CG1 VAL A 120 5.846 -14.441 41.011 1.00 26.86 C ATOM 1156 CG2 VAL A 120 7.808 -13.442 42.171 1.00 25.15 C ATOM 1157 H VAL A 120 8.066 -12.779 39.285 1.00 0.00 H ATOM 1158 N GLN A 121 6.432 -10.124 42.075 1.00 26.79 N ATOM 1159 CA GLN A 121 6.989 -8.961 42.715 1.00 28.56 C ATOM 1160 C GLN A 121 8.175 -9.351 43.579 1.00 27.55 C ATOM 1161 O GLN A 121 8.122 -10.387 44.217 1.00 29.35 O ATOM 1162 CB GLN A 121 5.936 -8.218 43.536 1.00 32.33 C ATOM 1163 CG GLN A 121 4.711 -7.796 42.731 1.00 34.85 C ATOM 1164 CD GLN A 121 4.953 -6.581 41.836 1.00 40.32 C ATOM 1165 OE1 GLN A 121 6.107 -6.281 41.449 1.00 33.65 O ATOM 1166 NE2 GLN A 121 3.861 -5.892 41.475 1.00 39.00 N ATOM 1167 HE22 GLN A 121 2.925 -6.181 41.823 1.00 0.00 H ATOM 1168 HE21 GLN A 121 3.950 -5.068 40.847 1.00 0.00 H ATOM 1169 H GLN A 121 5.454 -10.412 42.279 1.00 0.00 H ATOM 1170 N TYR A 122 9.250 -8.581 43.566 1.00 26.91 N ATOM 1171 CA TYR A 122 10.407 -8.904 44.408 1.00 30.44 C ATOM 1172 C TYR A 122 10.856 -7.721 45.212 1.00 33.67 C ATOM 1173 O TYR A 122 11.154 -7.837 46.404 1.00 40.84 O ATOM 1174 CB TYR A 122 11.583 -9.448 43.555 1.00 34.24 C ATOM 1175 CG TYR A 122 12.546 -10.294 44.363 1.00 29.45 C ATOM 1176 CD1 TYR A 122 12.329 -11.641 44.538 1.00 32.89 C ATOM 1177 CD2 TYR A 122 13.659 -9.732 44.931 1.00 30.09 C ATOM 1178 CE1 TYR A 122 13.214 -12.414 45.280 1.00 32.64 C ATOM 1179 CE2 TYR A 122 14.560 -10.496 45.650 1.00 32.20 C ATOM 1180 CZ TYR A 122 14.313 -11.824 45.833 1.00 32.40 C ATOM 1181 OH TYR A 122 15.205 -12.550 46.581 1.00 41.71 O ATOM 1182 HH TYR A 122 14.903 -13.491 46.631 1.00 0.00 H ATOM 1183 H TYR A 122 9.275 -7.740 42.954 1.00 0.00 H ATOM 1184 N GLY A 123 10.872 -6.553 44.604 1.00 31.10 N ATOM 1185 CA GLY A 123 11.328 -5.372 45.278 1.00 28.61 C ATOM 1186 C GLY A 123 12.813 -5.316 45.468 1.00 30.23 C ATOM 1187 O GLY A 123 13.569 -5.169 44.500 1.00 26.02 O ATOM 1188 H GLY A 123 10.548 -6.486 43.618 1.00 0.00 H ATOM 1189 N PHE A 124 13.249 -5.379 46.711 1.00 27.76 N ATOM 1190 CA PHE A 124 14.613 -5.131 47.008 1.00 31.89 C ATOM 1191 C PHE A 124 15.566 -6.282 46.630 1.00 33.55 C ATOM 1192 O PHE A 124 15.285 -7.439 46.840 1.00 35.53 O ATOM 1193 CB PHE A 124 14.723 -4.807 48.455 1.00 37.09 C ATOM 1194 CG PHE A 124 16.093 -4.662 48.874 1.00 37.52 C ATOM 1195 CD1 PHE A 124 16.649 -3.415 49.058 1.00 35.27 C ATOM 1196 CD2 PHE A 124 16.880 -5.796 48.994 1.00 40.53 C ATOM 1197 CE1 PHE A 124 17.961 -3.304 49.433 1.00 40.78 C ATOM 1198 CE2 PHE A 124 18.199 -5.680 49.404 1.00 46.02 C ATOM 1199 CZ PHE A 124 18.743 -4.429 49.610 1.00 44.43 C ATOM 1200 H PHE A 124 12.588 -5.612 47.479 1.00 0.00 H ATOM 1201 N LEU A 125 16.664 -5.940 45.974 1.00 36.43 N ATOM 1202 CA LEU A 125 17.663 -6.934 45.582 1.00 32.95 C ATOM 1203 C LEU A 125 19.036 -6.313 45.754 1.00 30.92 C ATOM 1204 O LEU A 125 19.250 -5.179 45.360 1.00 28.04 O ATOM 1205 CB LEU A 125 17.427 -7.377 44.157 1.00 31.91 C ATOM 1206 CG LEU A 125 18.273 -8.470 43.525 1.00 31.02 C ATOM 1207 CD1 LEU A 125 17.900 -9.891 43.968 1.00 33.99 C ATOM 1208 CD2 LEU A 125 18.192 -8.406 42.011 1.00 32.81 C ATOM 1209 H LEU A 125 16.820 -4.941 45.732 1.00 0.00 H ATOM 1210 N ASN A 126 19.978 -7.046 46.331 1.00 32.63 N ATOM 1211 CA ASN A 126 21.363 -6.542 46.317 1.00 36.47 C ATOM 1212 C ASN A 126 22.105 -7.320 45.256 1.00 33.91 C ATOM 1213 O ASN A 126 22.294 -8.515 45.401 1.00 30.39 O ATOM 1214 CB ASN A 126 22.080 -6.677 47.662 1.00 42.44 C ATOM 1215 CG ASN A 126 23.538 -6.150 47.602 1.00 46.20 C ATOM 1216 OD1 ASN A 126 24.308 -6.532 46.732 1.00 56.17 O ATOM 1217 ND2 ASN A 126 23.901 -5.278 48.505 1.00 47.53 N ATOM 1218 HD22 ASN A 126 23.225 -4.971 49.233 1.00 0.00 H ATOM 1219 HD21 ASN A 126 24.866 -4.891 48.496 1.00 0.00 H ATOM 1220 H ASN A 126 19.746 -7.954 46.782 1.00 0.00 H ATOM 1221 N LEU A 127 22.457 -6.652 44.175 1.00 33.03 N ATOM 1222 CA LEU A 127 23.081 -7.298 43.030 1.00 32.83 C ATOM 1223 C LEU A 127 24.523 -6.849 42.924 1.00 30.34 C ATOM 1224 O LEU A 127 24.790 -5.681 42.689 1.00 28.88 O ATOM 1225 CB LEU A 127 22.371 -6.857 41.734 1.00 38.14 C ATOM 1226 CG LEU A 127 21.265 -7.678 41.091 1.00 38.36 C ATOM 1227 CD1 LEU A 127 20.499 -6.910 40.054 1.00 43.03 C ATOM 1228 CD2 LEU A 127 21.885 -8.871 40.430 1.00 37.71 C ATOM 1229 H LEU A 127 22.283 -5.627 44.139 1.00 0.00 H ATOM 1230 N SER A 128 25.457 -7.779 43.062 1.00 33.08 N ATOM 1231 CA SER A 128 26.893 -7.478 42.894 1.00 34.72 C ATOM 1232 C SER A 128 27.274 -6.252 43.727 1.00 35.42 C ATOM 1233 O SER A 128 27.967 -5.343 43.270 1.00 30.84 O ATOM 1234 CB SER A 128 27.278 -7.231 41.421 1.00 39.05 C ATOM 1235 OG SER A 128 26.938 -8.313 40.564 1.00 38.58 O ATOM 1236 HG SER A 128 27.209 -8.096 39.637 1.00 0.00 H ATOM 1237 H SER A 128 25.170 -8.751 43.296 1.00 0.00 H ATOM 1238 N GLY A 129 26.751 -6.222 44.955 1.00 36.58 N ATOM 1239 CA GLY A 129 26.983 -5.139 45.907 1.00 34.89 C ATOM 1240 C GLY A 129 26.245 -3.827 45.688 1.00 39.34 C ATOM 1241 O GLY A 129 26.551 -2.814 46.351 1.00 33.16 O ATOM 1242 H GLY A 129 26.145 -7.014 45.250 1.00 0.00 H ATOM 1243 N LYS A 130 25.299 -3.820 44.741 1.00 32.35 N ATOM 1244 CA LYS A 130 24.487 -2.643 44.457 1.00 33.13 C ATOM 1245 C LYS A 130 23.065 -2.892 44.895 1.00 31.21 C ATOM 1246 O LYS A 130 22.365 -3.715 44.317 1.00 28.17 O ATOM 1247 CB LYS A 130 24.469 -2.341 42.962 1.00 33.86 C ATOM 1248 CG LYS A 130 23.939 -0.973 42.601 1.00 31.20 C ATOM 1249 CD LYS A 130 25.128 -0.031 42.503 1.00 34.86 C ATOM 1250 CE LYS A 130 24.815 1.227 41.739 1.00 38.12 C ATOM 1251 NZ LYS A 130 25.193 2.445 42.479 1.00 37.06 N ATOM 1252 HZ1 LYS A 130 24.673 2.478 43.379 1.00 0.00 H ATOM 1253 HZ2 LYS A 130 26.215 2.431 42.669 1.00 0.00 H ATOM 1254 HZ3 LYS A 130 24.957 3.283 41.910 1.00 0.00 H ATOM 1255 H LYS A 130 25.137 -4.686 44.188 1.00 0.00 H ATOM 1256 N PRO A 131 22.618 -2.203 45.936 1.00 30.50 N ATOM 1257 CA PRO A 131 21.252 -2.360 46.349 1.00 32.35 C ATOM 1258 C PRO A 131 20.388 -1.709 45.267 1.00 27.18 C ATOM 1259 O PRO A 131 20.711 -0.654 44.768 1.00 31.21 O ATOM 1260 CB PRO A 131 21.154 -1.501 47.605 1.00 34.14 C ATOM 1261 CG PRO A 131 22.314 -0.625 47.554 1.00 37.44 C ATOM 1262 CD PRO A 131 23.360 -1.259 46.757 1.00 33.66 C ATOM 1263 N THR A 132 19.312 -2.374 44.954 1.00 26.34 N ATOM 1264 CA THR A 132 18.455 -2.107 43.800 1.00 23.52 C ATOM 1265 C THR A 132 17.000 -2.343 44.228 1.00 22.36 C ATOM 1266 O THR A 132 16.681 -3.293 44.972 1.00 22.92 O ATOM 1267 CB THR A 132 18.788 -3.090 42.669 1.00 21.76 C ATOM 1268 OG1 THR A 132 20.156 -2.933 42.302 1.00 21.37 O ATOM 1269 CG2 THR A 132 17.870 -2.930 41.407 1.00 22.75 C ATOM 1270 HG1 THR A 132 20.730 -3.120 43.086 1.00 0.00 H ATOM 1271 H THR A 132 19.040 -3.161 45.577 1.00 0.00 H ATOM 1272 N HIS A 133 16.126 -1.515 43.702 1.00 20.30 N ATOM 1273 CA HIS A 133 14.712 -1.560 44.010 1.00 21.89 C ATOM 1274 C HIS A 133 13.840 -1.840 42.800 1.00 19.26 C ATOM 1275 O HIS A 133 14.310 -1.805 41.673 1.00 17.63 O ATOM 1276 CB HIS A 133 14.297 -0.211 44.598 1.00 27.80 C ATOM 1277 CG HIS A 133 13.650 -0.330 45.923 1.00 34.64 C ATOM 1278 ND1 HIS A 133 12.600 -1.198 46.150 1.00 40.82 N ATOM 1279 CD2 HIS A 133 13.881 0.313 47.089 1.00 38.36 C ATOM 1280 CE1 HIS A 133 12.240 -1.119 47.419 1.00 43.17 C ATOM 1281 NE2 HIS A 133 12.995 -0.207 48.006 1.00 45.31 N ATOM 1282 H HIS A 133 16.465 -0.794 43.034 1.00 0.00 H ATOM 1283 N ARG A 134 12.571 -2.163 43.058 1.00 17.49 N ATOM 1284 CA ARG A 134 11.539 -2.331 42.052 1.00 19.21 C ATOM 1285 C ARG A 134 11.830 -3.445 41.079 1.00 20.38 C ATOM 1286 O ARG A 134 11.385 -3.395 39.916 1.00 19.40 O ATOM 1287 CB ARG A 134 11.310 -1.017 41.306 1.00 19.01 C ATOM 1288 CG ARG A 134 10.824 0.119 42.189 1.00 18.70 C ATOM 1289 CD ARG A 134 10.245 1.284 41.439 1.00 20.81 C ATOM 1290 NE ARG A 134 10.147 2.479 42.279 1.00 19.86 N ATOM 1291 CZ ARG A 134 9.994 3.731 41.821 1.00 23.46 C ATOM 1292 NH1 ARG A 134 10.018 3.972 40.531 1.00 20.95 N ATOM 1293 NH2 ARG A 134 9.887 4.772 42.666 1.00 23.95 N ATOM 1294 HE ARG A 134 10.200 2.348 43.309 1.00 0.00 H ATOM 1295 HH12 ARG A 134 9.899 4.944 40.181 1.00 0.00 H ATOM 1296 HH11 ARG A 134 10.156 3.191 39.859 1.00 0.00 H ATOM 1297 HH22 ARG A 134 9.769 5.735 42.292 1.00 0.00 H ATOM 1298 HH21 ARG A 134 9.922 4.614 43.693 1.00 0.00 H ATOM 1299 H ARG A 134 12.302 -2.305 44.053 1.00 0.00 H ATOM 1300 N THR A 135 12.524 -4.474 41.576 1.00 20.37 N ATOM 1301 CA THR A 135 12.776 -5.694 40.808 1.00 22.97 C ATOM 1302 C THR A 135 11.627 -6.668 40.886 1.00 21.48 C ATOM 1303 O THR A 135 10.803 -6.677 41.831 1.00 20.55 O ATOM 1304 CB THR A 135 14.086 -6.393 41.257 1.00 23.20 C ATOM 1305 OG1 THR A 135 13.909 -7.090 42.539 1.00 24.35 O ATOM 1306 CG2 THR A 135 15.209 -5.413 41.373 1.00 21.89 C ATOM 1307 HG1 THR A 135 13.646 -6.437 43.235 1.00 0.00 H ATOM 1308 H THR A 135 12.898 -4.405 42.544 1.00 0.00 H ATOM 1309 N MET A 136 11.579 -7.505 39.864 1.00 21.55 N ATOM 1310 CA MET A 136 10.735 -8.668 39.840 1.00 21.30 C ATOM 1311 C MET A 136 11.553 -9.947 39.525 1.00 21.50 C ATOM 1312 O MET A 136 12.702 -9.892 39.116 1.00 22.12 O ATOM 1313 CB MET A 136 9.577 -8.518 38.839 1.00 22.94 C ATOM 1314 CG MET A 136 8.557 -7.429 39.222 1.00 23.29 C ATOM 1315 SD MET A 136 7.104 -7.401 38.150 1.00 26.31 S ATOM 1316 CE MET A 136 7.947 -6.761 36.657 1.00 27.10 C ATOM 1317 H MET A 136 12.181 -7.313 39.038 1.00 0.00 H ATOM 1318 N MET A 137 10.944 -11.094 39.749 1.00 21.61 N ATOM 1319 CA MET A 137 11.674 -12.368 39.732 1.00 21.18 C ATOM 1320 C MET A 137 10.994 -13.456 38.943 1.00 19.48 C ATOM 1321 O MET A 137 9.768 -13.599 38.938 1.00 23.98 O ATOM 1322 CB MET A 137 11.947 -12.835 41.179 1.00 23.11 C ATOM 1323 CG MET A 137 12.745 -14.118 41.303 1.00 25.56 C ATOM 1324 SD MET A 137 11.744 -15.631 41.170 1.00 32.40 S ATOM 1325 CE MET A 137 10.979 -15.623 42.827 1.00 32.04 C ATOM 1326 H MET A 137 9.922 -11.097 39.942 1.00 0.00 H ATOM 1327 N TYR A 138 11.786 -14.297 38.281 1.00 21.28 N ATOM 1328 CA TYR A 138 11.254 -15.469 37.580 1.00 19.88 C ATOM 1329 C TYR A 138 12.091 -16.686 37.904 1.00 22.63 C ATOM 1330 O TYR A 138 13.311 -16.569 38.064 1.00 22.69 O ATOM 1331 CB TYR A 138 11.187 -15.280 36.070 1.00 20.49 C ATOM 1332 CG TYR A 138 12.030 -14.132 35.554 1.00 19.45 C ATOM 1333 CD1 TYR A 138 13.250 -14.359 34.965 1.00 19.91 C ATOM 1334 CD2 TYR A 138 11.564 -12.827 35.607 1.00 20.63 C ATOM 1335 CE1 TYR A 138 14.013 -13.305 34.467 1.00 18.34 C ATOM 1336 CE2 TYR A 138 12.334 -11.782 35.113 1.00 19.35 C ATOM 1337 CZ TYR A 138 13.560 -12.044 34.546 1.00 17.11 C ATOM 1338 OH TYR A 138 14.291 -10.989 34.038 1.00 14.88 O ATOM 1339 HH TYR A 138 15.143 -11.328 33.666 1.00 0.00 H ATOM 1340 H TYR A 138 12.810 -14.117 38.261 1.00 0.00 H ATOM 1341 N ASN A 139 11.441 -17.840 38.030 1.00 24.39 N ATOM 1342 CA ASN A 139 12.176 -19.062 38.416 1.00 23.16 C ATOM 1343 C ASN A 139 12.776 -19.743 37.196 1.00 23.48 C ATOM 1344 O ASN A 139 12.311 -20.804 36.757 1.00 25.12 O ATOM 1345 CB ASN A 139 11.297 -19.988 39.226 1.00 23.10 C ATOM 1346 CG ASN A 139 11.100 -19.487 40.663 1.00 22.29 C ATOM 1347 OD1 ASN A 139 10.036 -19.625 41.263 1.00 26.47 O ATOM 1348 ND2 ASN A 139 12.113 -18.918 41.214 1.00 23.42 N ATOM 1349 HD22 ASN A 139 13.002 -18.813 40.685 1.00 0.00 H ATOM 1350 HD21 ASN A 139 12.043 -18.562 42.189 1.00 0.00 H ATOM 1351 H ASN A 139 10.416 -17.882 37.857 1.00 0.00 H ATOM 1352 N PHE A 140 13.794 -19.091 36.620 1.00 20.96 N ATOM 1353 CA PHE A 140 14.451 -19.607 35.444 1.00 21.21 C ATOM 1354 C PHE A 140 15.924 -19.303 35.553 1.00 20.55 C ATOM 1355 O PHE A 140 16.267 -18.218 35.988 1.00 24.71 O ATOM 1356 CB PHE A 140 13.868 -18.968 34.182 1.00 23.85 C ATOM 1357 CG PHE A 140 14.327 -19.616 32.916 1.00 21.75 C ATOM 1358 CD1 PHE A 140 13.615 -20.632 32.365 1.00 23.01 C ATOM 1359 CD2 PHE A 140 15.509 -19.236 32.317 1.00 23.52 C ATOM 1360 CE1 PHE A 140 14.032 -21.246 31.203 1.00 22.59 C ATOM 1361 CE2 PHE A 140 15.955 -19.872 31.172 1.00 21.98 C ATOM 1362 CZ PHE A 140 15.203 -20.854 30.601 1.00 24.26 C ATOM 1363 H PHE A 140 14.118 -18.192 37.030 1.00 0.00 H ATOM 1364 N PRO A 141 16.810 -20.216 35.133 1.00 18.28 N ATOM 1365 CA PRO A 141 18.242 -19.986 35.314 1.00 19.16 C ATOM 1366 C PRO A 141 18.853 -19.155 34.189 1.00 21.89 C ATOM 1367 O PRO A 141 19.536 -19.685 33.301 1.00 19.59 O ATOM 1368 CB PRO A 141 18.842 -21.415 35.319 1.00 18.35 C ATOM 1369 CG PRO A 141 17.905 -22.185 34.537 1.00 19.24 C ATOM 1370 CD PRO A 141 16.527 -21.578 34.701 1.00 19.28 C ATOM 1371 N THR A 142 18.591 -17.849 34.217 1.00 22.71 N ATOM 1372 CA THR A 142 19.137 -16.934 33.230 1.00 21.59 C ATOM 1373 C THR A 142 20.642 -16.888 33.313 1.00 22.89 C ATOM 1374 O THR A 142 21.241 -17.180 34.370 1.00 22.29 O ATOM 1375 CB THR A 142 18.560 -15.509 33.403 1.00 19.33 C ATOM 1376 OG1 THR A 142 18.647 -15.107 34.777 1.00 19.02 O ATOM 1377 CG2 THR A 142 17.096 -15.482 33.002 1.00 18.91 C ATOM 1378 HG1 THR A 142 19.595 -15.111 35.062 1.00 0.00 H ATOM 1379 H THR A 142 17.977 -17.474 34.968 1.00 0.00 H ATOM 1380 N LYS A 143 21.257 -16.449 32.211 1.00 21.70 N ATOM 1381 CA LYS A 143 22.729 -16.503 32.101 1.00 23.93 C ATOM 1382 C LYS A 143 23.367 -15.176 31.697 1.00 21.48 C ATOM 1383 O LYS A 143 22.699 -14.261 31.190 1.00 16.00 O ATOM 1384 CB LYS A 143 23.126 -17.634 31.146 1.00 24.81 C ATOM 1385 CG LYS A 143 23.154 -17.248 29.709 1.00 30.52 C ATOM 1386 CD LYS A 143 23.629 -18.370 28.766 1.00 36.03 C ATOM 1387 CE LYS A 143 22.717 -19.572 28.895 1.00 40.99 C ATOM 1388 NZ LYS A 143 23.384 -20.800 28.402 1.00 46.86 N ATOM 1389 HZ1 LYS A 143 23.636 -20.678 27.400 1.00 0.00 H ATOM 1390 HZ2 LYS A 143 24.245 -20.973 28.959 1.00 0.00 H ATOM 1391 HZ3 LYS A 143 22.737 -21.608 28.502 1.00 0.00 H ATOM 1392 H LYS A 143 20.695 -16.066 31.424 1.00 0.00 H ATOM 1393 N ALA A 144 24.681 -15.113 31.876 1.00 20.70 N ATOM 1394 CA ALA A 144 25.437 -13.960 31.426 1.00 22.40 C ATOM 1395 C ALA A 144 25.123 -13.773 29.933 1.00 19.47 C ATOM 1396 O ALA A 144 24.873 -14.730 29.207 1.00 19.38 O ATOM 1397 CB ALA A 144 26.934 -14.167 31.617 1.00 24.46 C ATOM 1398 H ALA A 144 25.174 -15.900 32.344 1.00 0.00 H ATOM 1399 N GLY A 145 25.064 -12.529 29.510 1.00 18.88 N ATOM 1400 CA GLY A 145 24.806 -12.198 28.101 1.00 17.39 C ATOM 1401 C GLY A 145 23.359 -11.880 27.791 1.00 16.00 C ATOM 1402 O GLY A 145 23.042 -11.473 26.695 1.00 16.25 O ATOM 1403 H GLY A 145 25.204 -11.757 30.192 1.00 0.00 H ATOM 1404 N GLN A 146 22.478 -12.110 28.755 1.00 13.99 N ATOM 1405 CA GLN A 146 21.046 -11.949 28.586 1.00 14.82 C ATOM 1406 C GLN A 146 20.506 -10.613 29.228 1.00 13.91 C ATOM 1407 O GLN A 146 19.294 -10.363 29.189 1.00 12.81 O ATOM 1408 CB GLN A 146 20.284 -13.138 29.180 1.00 15.82 C ATOM 1409 CG GLN A 146 20.468 -14.402 28.318 1.00 19.37 C ATOM 1410 CD GLN A 146 19.865 -15.701 28.815 1.00 19.87 C ATOM 1411 OE1 GLN A 146 19.579 -15.892 29.982 1.00 18.04 O ATOM 1412 NE2 GLN A 146 19.714 -16.622 27.906 1.00 21.92 N ATOM 1413 HE22 GLN A 146 19.969 -16.424 26.917 1.00 0.00 H ATOM 1414 HE21 GLN A 146 19.338 -17.556 28.169 1.00 0.00 H ATOM 1415 H GLN A 146 22.832 -12.422 29.682 1.00 0.00 H ATOM 1416 N CYS A 147 21.377 -9.792 29.779 1.00 14.67 N ATOM 1417 CA CYS A 147 20.924 -8.524 30.395 1.00 15.28 C ATOM 1418 C CYS A 147 20.433 -7.559 29.308 1.00 15.30 C ATOM 1419 O CYS A 147 20.928 -7.563 28.159 1.00 16.94 O ATOM 1420 CB CYS A 147 22.001 -7.864 31.271 1.00 16.30 C ATOM 1421 SG CYS A 147 21.995 -8.793 32.811 1.00 18.10 S ATOM 1422 H CYS A 147 22.388 -10.036 29.781 1.00 0.00 H ATOM 1423 N GLY A 148 19.360 -6.868 29.636 1.00 14.69 N ATOM 1424 CA GLY A 148 18.643 -5.995 28.700 1.00 14.42 C ATOM 1425 C GLY A 148 17.522 -6.704 27.989 1.00 14.14 C ATOM 1426 O GLY A 148 16.658 -6.067 27.342 1.00 13.03 O ATOM 1427 H GLY A 148 19.003 -6.946 30.610 1.00 0.00 H ATOM 1428 N GLY A 149 17.496 -8.029 28.114 1.00 14.29 N ATOM 1429 CA GLY A 149 16.413 -8.819 27.553 1.00 13.37 C ATOM 1430 C GLY A 149 15.079 -8.336 28.056 1.00 13.86 C ATOM 1431 O GLY A 149 14.966 -7.838 29.213 1.00 14.32 O ATOM 1432 H GLY A 149 18.266 -8.508 28.623 1.00 0.00 H ATOM 1433 N VAL A 150 14.080 -8.360 27.172 1.00 14.08 N ATOM 1434 CA VAL A 150 12.791 -7.720 27.466 1.00 15.27 C ATOM 1435 C VAL A 150 11.769 -8.734 27.949 1.00 14.37 C ATOM 1436 O VAL A 150 11.521 -9.737 27.312 1.00 15.72 O ATOM 1437 CB VAL A 150 12.228 -6.973 26.232 1.00 17.02 C ATOM 1438 CG1 VAL A 150 10.902 -6.305 26.578 1.00 18.19 C ATOM 1439 CG2 VAL A 150 13.250 -5.970 25.698 1.00 17.16 C ATOM 1440 H VAL A 150 14.216 -8.840 26.259 1.00 0.00 H ATOM 1441 N VAL A 151 11.280 -8.509 29.153 1.00 15.21 N ATOM 1442 CA VAL A 151 10.276 -9.370 29.734 1.00 16.59 C ATOM 1443 C VAL A 151 8.888 -9.005 29.176 1.00 16.38 C ATOM 1444 O VAL A 151 8.396 -7.900 29.338 1.00 17.14 O ATOM 1445 CB VAL A 151 10.315 -9.328 31.270 1.00 16.43 C ATOM 1446 CG1 VAL A 151 9.271 -10.253 31.846 1.00 16.27 C ATOM 1447 CG2 VAL A 151 11.680 -9.769 31.769 1.00 15.43 C ATOM 1448 H VAL A 151 11.625 -7.693 29.697 1.00 0.00 H ATOM 1449 N THR A 152 8.253 -9.948 28.501 1.00 17.94 N ATOM 1450 CA THR A 152 6.956 -9.670 27.851 1.00 20.70 C ATOM 1451 C THR A 152 5.895 -10.737 28.125 1.00 23.18 C ATOM 1452 O THR A 152 6.237 -11.919 28.275 1.00 23.70 O ATOM 1453 CB THR A 152 7.086 -9.547 26.339 1.00 24.90 C ATOM 1454 OG1 THR A 152 7.426 -10.827 25.777 1.00 30.35 O ATOM 1455 CG2 THR A 152 8.135 -8.590 25.965 1.00 27.97 C ATOM 1456 HG1 THR A 152 8.287 -11.135 26.157 1.00 0.00 H ATOM 1457 H THR A 152 8.672 -10.897 28.427 1.00 0.00 H ATOM 1458 N SER A 153 4.626 -10.314 28.242 1.00 23.64 N ATOM 1459 CA SER A 153 3.507 -11.258 28.364 1.00 26.66 C ATOM 1460 C SER A 153 2.201 -10.628 27.884 1.00 28.42 C ATOM 1461 O SER A 153 1.839 -9.515 28.274 1.00 29.48 O ATOM 1462 CB SER A 153 3.333 -11.712 29.827 1.00 30.84 C ATOM 1463 OG SER A 153 2.168 -12.513 29.986 1.00 30.47 O ATOM 1464 HG SER A 153 2.085 -12.788 30.933 1.00 0.00 H ATOM 1465 H SER A 153 4.430 -9.293 28.246 1.00 0.00 H ATOM 1466 N VAL A 154 1.500 -11.327 27.000 1.00 31.75 N ATOM 1467 CA VAL A 154 0.180 -10.921 26.524 1.00 31.18 C ATOM 1468 C VAL A 154 0.094 -9.464 26.039 1.00 28.36 C ATOM 1469 O VAL A 154 -0.821 -8.777 26.371 1.00 31.82 O ATOM 1470 CB VAL A 154 -0.929 -11.201 27.582 1.00 33.96 C ATOM 1471 CG1 VAL A 154 -0.800 -12.612 28.137 1.00 35.39 C ATOM 1472 CG2 VAL A 154 -0.929 -10.172 28.706 1.00 37.91 C ATOM 1473 H VAL A 154 1.911 -12.207 26.628 1.00 0.00 H ATOM 1474 N GLY A 155 1.049 -9.035 25.223 1.00 24.92 N ATOM 1475 CA GLY A 155 1.051 -7.710 24.631 1.00 24.81 C ATOM 1476 C GLY A 155 1.530 -6.610 25.562 1.00 23.29 C ATOM 1477 O GLY A 155 1.330 -5.462 25.280 1.00 27.67 O ATOM 1478 H GLY A 155 1.833 -9.679 24.997 1.00 0.00 H ATOM 1479 N LYS A 156 2.151 -6.975 26.668 1.00 21.29 N ATOM 1480 CA LYS A 156 2.737 -6.055 27.605 1.00 22.42 C ATOM 1481 C LYS A 156 4.234 -6.215 27.721 1.00 20.07 C ATOM 1482 O LYS A 156 4.797 -7.318 27.629 1.00 21.34 O ATOM 1483 CB LYS A 156 2.138 -6.260 28.998 1.00 27.26 C ATOM 1484 CG LYS A 156 0.645 -5.981 29.012 1.00 31.64 C ATOM 1485 CD LYS A 156 0.149 -5.543 30.370 1.00 37.58 C ATOM 1486 CE LYS A 156 -1.267 -6.015 30.604 1.00 42.30 C ATOM 1487 NZ LYS A 156 -1.336 -7.400 31.170 1.00 50.19 N ATOM 1488 HZ1 LYS A 156 -0.885 -8.066 30.510 1.00 0.00 H ATOM 1489 HZ2 LYS A 156 -0.839 -7.425 32.083 1.00 0.00 H ATOM 1490 HZ3 LYS A 156 -2.331 -7.667 31.308 1.00 0.00 H ATOM 1491 H LYS A 156 2.221 -7.992 26.875 1.00 0.00 H ATOM 1492 N VAL A 157 4.862 -5.098 28.021 1.00 17.20 N ATOM 1493 CA VAL A 157 6.309 -5.026 28.151 1.00 16.10 C ATOM 1494 C VAL A 157 6.605 -4.573 29.554 1.00 18.23 C ATOM 1495 O VAL A 157 6.434 -3.402 29.884 1.00 19.09 O ATOM 1496 CB VAL A 157 6.897 -4.055 27.107 1.00 16.23 C ATOM 1497 CG1 VAL A 157 8.404 -3.958 27.299 1.00 18.60 C ATOM 1498 CG2 VAL A 157 6.518 -4.527 25.711 1.00 16.42 C ATOM 1499 H VAL A 157 4.303 -4.234 28.171 1.00 0.00 H ATOM 1500 N ILE A 158 7.039 -5.503 30.398 1.00 16.74 N ATOM 1501 CA ILE A 158 6.999 -5.301 31.883 1.00 17.72 C ATOM 1502 C ILE A 158 8.338 -5.210 32.630 1.00 16.07 C ATOM 1503 O ILE A 158 8.391 -4.757 33.771 1.00 17.51 O ATOM 1504 CB ILE A 158 6.135 -6.391 32.575 1.00 18.88 C ATOM 1505 CG1 ILE A 158 6.820 -7.760 32.492 1.00 19.66 C ATOM 1506 CG2 ILE A 158 4.715 -6.423 32.005 1.00 19.14 C ATOM 1507 CD1 ILE A 158 6.007 -8.859 33.198 1.00 20.27 C ATOM 1508 H ILE A 158 7.416 -6.395 30.018 1.00 0.00 H ATOM 1509 N GLY A 159 9.427 -5.649 32.019 1.00 15.54 N ATOM 1510 CA GLY A 159 10.711 -5.492 32.648 1.00 15.69 C ATOM 1511 C GLY A 159 11.890 -5.645 31.727 1.00 14.58 C ATOM 1512 O GLY A 159 11.741 -6.025 30.553 1.00 14.54 O ATOM 1513 H GLY A 159 9.355 -6.106 31.088 1.00 0.00 H ATOM 1514 N ILE A 160 13.060 -5.338 32.274 1.00 13.62 N ATOM 1515 CA ILE A 160 14.352 -5.488 31.602 1.00 13.81 C ATOM 1516 C ILE A 160 15.284 -6.376 32.453 1.00 13.63 C ATOM 1517 O ILE A 160 15.550 -6.090 33.638 1.00 14.03 O ATOM 1518 CB ILE A 160 15.013 -4.107 31.520 1.00 14.98 C ATOM 1519 CG1 ILE A 160 14.157 -3.216 30.621 1.00 16.83 C ATOM 1520 CG2 ILE A 160 16.435 -4.145 30.986 1.00 16.78 C ATOM 1521 CD1 ILE A 160 14.111 -3.608 29.170 1.00 18.31 C ATOM 1522 H ILE A 160 13.059 -4.966 33.245 1.00 0.00 H ATOM 1523 N HIS A 161 15.784 -7.426 31.858 1.00 14.42 N ATOM 1524 CA HIS A 161 16.635 -8.359 32.558 1.00 15.50 C ATOM 1525 C HIS A 161 17.916 -7.749 33.049 1.00 15.63 C ATOM 1526 O HIS A 161 18.640 -7.095 32.298 1.00 13.01 O ATOM 1527 CB HIS A 161 16.936 -9.583 31.708 1.00 16.33 C ATOM 1528 CG HIS A 161 17.606 -10.666 32.486 1.00 17.55 C ATOM 1529 ND1 HIS A 161 16.934 -11.366 33.449 1.00 18.48 N ATOM 1530 CD2 HIS A 161 18.889 -11.096 32.530 1.00 17.98 C ATOM 1531 CE1 HIS A 161 17.762 -12.221 34.036 1.00 19.08 C ATOM 1532 NE2 HIS A 161 18.956 -12.087 33.491 1.00 18.83 N ATOM 1533 H HIS A 161 15.564 -7.594 30.856 1.00 0.00 H ATOM 1534 N ILE A 162 18.169 -7.932 34.349 1.00 15.14 N ATOM 1535 CA ILE A 162 19.307 -7.343 35.035 1.00 14.93 C ATOM 1536 C ILE A 162 20.248 -8.292 35.825 1.00 14.56 C ATOM 1537 O ILE A 162 21.330 -7.925 36.118 1.00 13.81 O ATOM 1538 CB ILE A 162 18.912 -6.208 35.976 1.00 15.68 C ATOM 1539 CG1 ILE A 162 18.079 -6.734 37.155 1.00 17.31 C ATOM 1540 CG2 ILE A 162 18.278 -5.053 35.199 1.00 16.67 C ATOM 1541 CD1 ILE A 162 17.944 -5.735 38.282 1.00 19.84 C ATOM 1542 H ILE A 162 17.517 -8.527 34.899 1.00 0.00 H ATOM 1543 N GLY A 163 19.798 -9.488 36.165 1.00 16.67 N ATOM 1544 CA GLY A 163 20.673 -10.388 36.900 1.00 17.88 C ATOM 1545 C GLY A 163 20.082 -11.704 37.190 1.00 18.91 C ATOM 1546 O GLY A 163 18.941 -11.976 36.854 1.00 19.25 O ATOM 1547 H GLY A 163 18.833 -9.781 35.911 1.00 0.00 H ATOM 1548 N GLY A 164 20.837 -12.540 37.881 1.00 22.36 N ATOM 1549 CA GLY A 164 20.366 -13.895 38.135 1.00 22.30 C ATOM 1550 C GLY A 164 21.323 -14.603 39.049 1.00 25.48 C ATOM 1551 O GLY A 164 22.514 -14.277 39.059 1.00 22.00 O ATOM 1552 H GLY A 164 21.763 -12.232 38.242 1.00 0.00 H ATOM 1553 N ASN A 165 20.828 -15.619 39.760 1.00 25.93 N ATOM 1554 CA ASN A 165 21.646 -16.267 40.806 1.00 27.81 C ATOM 1555 C ASN A 165 21.951 -17.730 40.484 1.00 30.27 C ATOM 1556 O ASN A 165 22.569 -18.453 41.275 1.00 31.88 O ATOM 1557 CB ASN A 165 20.969 -16.098 42.159 1.00 26.89 C ATOM 1558 CG ASN A 165 19.642 -16.786 42.211 1.00 25.54 C ATOM 1559 OD1 ASN A 165 19.376 -17.640 41.401 1.00 26.59 O ATOM 1560 ND2 ASN A 165 18.825 -16.470 43.196 1.00 24.51 N ATOM 1561 HD22 ASN A 165 19.091 -15.728 43.874 1.00 0.00 H ATOM 1562 HD21 ASN A 165 17.915 -16.963 43.295 1.00 0.00 H ATOM 1563 H ASN A 165 19.861 -15.956 39.577 1.00 0.00 H ATOM 1564 N GLY A 166 21.620 -18.095 39.255 1.00 27.24 N ATOM 1565 CA GLY A 166 21.906 -19.395 38.695 1.00 26.07 C ATOM 1566 C GLY A 166 20.695 -20.263 38.665 1.00 23.48 C ATOM 1567 O GLY A 166 20.677 -21.265 37.971 1.00 24.68 O ATOM 1568 H GLY A 166 21.124 -17.404 38.657 1.00 0.00 H ATOM 1569 N ARG A 167 19.687 -19.896 39.437 1.00 21.63 N ATOM 1570 CA ARG A 167 18.441 -20.639 39.542 1.00 22.18 C ATOM 1571 C ARG A 167 17.280 -19.773 39.152 1.00 21.35 C ATOM 1572 O ARG A 167 16.313 -20.257 38.598 1.00 22.96 O ATOM 1573 CB ARG A 167 18.217 -21.121 41.007 1.00 23.27 C ATOM 1574 CG ARG A 167 19.281 -22.112 41.443 1.00 27.46 C ATOM 1575 CD ARG A 167 19.133 -22.395 42.918 1.00 29.43 C ATOM 1576 NE ARG A 167 19.086 -21.150 43.699 1.00 28.34 N ATOM 1577 CZ ARG A 167 20.156 -20.463 44.083 1.00 31.72 C ATOM 1578 NH1 ARG A 167 21.379 -20.921 43.870 1.00 33.67 N ATOM 1579 NH2 ARG A 167 20.003 -19.345 44.742 1.00 34.93 N ATOM 1580 HE ARG A 167 18.151 -20.782 43.969 1.00 0.00 H ATOM 1581 HH12 ARG A 167 22.203 -20.367 44.179 1.00 0.00 H ATOM 1582 HH11 ARG A 167 21.516 -21.835 43.394 1.00 0.00 H ATOM 1583 HH22 ARG A 167 20.836 -18.802 45.046 1.00 0.00 H ATOM 1584 HH21 ARG A 167 19.048 -18.998 44.963 1.00 0.00 H ATOM 1585 H ARG A 167 19.790 -19.028 40.001 1.00 0.00 H ATOM 1586 N GLN A 168 17.386 -18.497 39.478 1.00 24.98 N ATOM 1587 CA GLN A 168 16.343 -17.530 39.256 1.00 25.36 C ATOM 1588 C GLN A 168 16.939 -16.288 38.581 1.00 24.72 C ATOM 1589 O GLN A 168 18.109 -16.031 38.696 1.00 22.30 O ATOM 1590 CB GLN A 168 15.717 -17.110 40.566 1.00 23.39 C ATOM 1591 CG GLN A 168 15.295 -18.266 41.441 1.00 25.42 C ATOM 1592 CD GLN A 168 14.904 -17.808 42.811 1.00 26.24 C ATOM 1593 OE1 GLN A 168 15.774 -17.406 43.606 1.00 25.03 O ATOM 1594 NE2 GLN A 168 13.602 -17.784 43.084 1.00 23.00 N ATOM 1595 HE22 GLN A 168 12.917 -18.133 42.383 1.00 0.00 H ATOM 1596 HE21 GLN A 168 13.269 -17.417 43.998 1.00 0.00 H ATOM 1597 H GLN A 168 18.271 -18.174 39.919 1.00 0.00 H ATOM 1598 N GLY A 169 16.071 -15.544 37.908 1.00 23.38 N ATOM 1599 CA GLY A 169 16.439 -14.307 37.219 1.00 21.55 C ATOM 1600 C GLY A 169 15.629 -13.148 37.708 1.00 20.72 C ATOM 1601 O GLY A 169 14.513 -13.315 38.251 1.00 23.52 O ATOM 1602 H GLY A 169 15.080 -15.856 37.868 1.00 0.00 H ATOM 1603 N PHE A 170 16.158 -11.944 37.509 1.00 20.44 N ATOM 1604 CA PHE A 170 15.559 -10.736 38.034 1.00 20.00 C ATOM 1605 C PHE A 170 15.554 -9.668 36.981 1.00 18.36 C ATOM 1606 O PHE A 170 16.512 -9.596 36.241 1.00 15.28 O ATOM 1607 CB PHE A 170 16.342 -10.214 39.217 1.00 20.88 C ATOM 1608 CG PHE A 170 16.433 -11.220 40.339 1.00 24.49 C ATOM 1609 CD1 PHE A 170 15.418 -11.348 41.258 1.00 27.78 C ATOM 1610 CD2 PHE A 170 17.512 -12.090 40.403 1.00 26.06 C ATOM 1611 CE1 PHE A 170 15.464 -12.315 42.260 1.00 27.57 C ATOM 1612 CE2 PHE A 170 17.571 -13.078 41.398 1.00 29.88 C ATOM 1613 CZ PHE A 170 16.545 -13.187 42.314 1.00 28.77 C ATOM 1614 H PHE A 170 17.035 -11.868 36.955 1.00 0.00 H ATOM 1615 N CYS A 171 14.470 -8.901 36.913 1.00 16.24 N ATOM 1616 CA CYS A 171 14.360 -7.754 36.022 1.00 15.53 C ATOM 1617 C CYS A 171 14.117 -6.484 36.813 1.00 17.35 C ATOM 1618 O CYS A 171 13.565 -6.512 37.916 1.00 17.15 O ATOM 1619 CB CYS A 171 13.232 -7.945 34.982 1.00 15.12 C ATOM 1620 SG CYS A 171 11.540 -8.121 35.590 1.00 16.21 S ATOM 1621 H CYS A 171 13.662 -9.131 37.526 1.00 0.00 H ATOM 1622 N ALA A 172 14.528 -5.371 36.231 1.00 15.87 N ATOM 1623 CA ALA A 172 14.088 -4.068 36.685 1.00 17.61 C ATOM 1624 C ALA A 172 12.707 -3.884 36.102 1.00 18.20 C ATOM 1625 O ALA A 172 12.476 -4.098 34.915 1.00 17.99 O ATOM 1626 CB ALA A 172 15.023 -2.996 36.209 1.00 18.40 C ATOM 1627 H ALA A 172 15.184 -5.432 35.426 1.00 0.00 H ATOM 1628 N GLY A 173 11.750 -3.539 36.948 1.00 16.58 N ATOM 1629 CA GLY A 173 10.360 -3.425 36.496 1.00 16.85 C ATOM 1630 C GLY A 173 10.216 -2.153 35.645 1.00 17.66 C ATOM 1631 O GLY A 173 10.884 -1.180 35.873 1.00 21.35 O ATOM 1632 H GLY A 173 11.986 -3.347 37.943 1.00 0.00 H ATOM 1633 N LEU A 174 9.371 -2.193 34.624 1.00 18.24 N ATOM 1634 CA LEU A 174 9.064 -1.014 33.831 1.00 17.56 C ATOM 1635 C LEU A 174 7.725 -0.369 34.162 1.00 17.02 C ATOM 1636 O LEU A 174 6.708 -1.038 34.408 1.00 21.73 O ATOM 1637 CB LEU A 174 9.089 -1.335 32.346 1.00 16.77 C ATOM 1638 CG LEU A 174 10.416 -1.722 31.743 1.00 16.93 C ATOM 1639 CD1 LEU A 174 10.192 -1.930 30.240 1.00 17.21 C ATOM 1640 CD2 LEU A 174 11.490 -0.674 31.965 1.00 17.98 C ATOM 1641 H LEU A 174 8.914 -3.096 34.383 1.00 0.00 H ATOM 1642 N LYS A 175 7.741 0.946 34.165 1.00 17.89 N ATOM 1643 CA LYS A 175 6.517 1.723 34.252 1.00 18.76 C ATOM 1644 C LYS A 175 6.531 2.848 33.251 1.00 17.47 C ATOM 1645 O LYS A 175 7.563 3.387 32.858 1.00 17.68 O ATOM 1646 CB LYS A 175 6.231 2.195 35.664 1.00 23.42 C ATOM 1647 CG LYS A 175 7.234 3.122 36.265 1.00 25.34 C ATOM 1648 CD LYS A 175 7.085 3.131 37.776 1.00 28.87 C ATOM 1649 CE LYS A 175 5.903 3.922 38.222 1.00 30.58 C ATOM 1650 NZ LYS A 175 5.964 4.123 39.678 1.00 40.01 N ATOM 1651 HZ1 LYS A 175 5.962 3.199 40.155 1.00 0.00 H ATOM 1652 HZ2 LYS A 175 6.835 4.637 39.920 1.00 0.00 H ATOM 1653 HZ3 LYS A 175 5.138 4.675 39.985 1.00 0.00 H ATOM 1654 H LYS A 175 8.653 1.442 34.104 1.00 0.00 H ATOM 1655 N ARG A 176 5.340 3.157 32.788 1.00 20.02 N ATOM 1656 CA ARG A 176 5.181 4.061 31.658 1.00 21.44 C ATOM 1657 C ARG A 176 5.795 5.400 31.952 1.00 20.55 C ATOM 1658 O ARG A 176 6.322 6.034 31.033 1.00 21.06 O ATOM 1659 CB ARG A 176 3.715 4.177 31.239 1.00 21.95 C ATOM 1660 CG ARG A 176 3.479 4.800 29.893 1.00 22.89 C ATOM 1661 CD ARG A 176 2.014 4.779 29.463 1.00 24.59 C ATOM 1662 NE ARG A 176 1.506 3.421 29.484 1.00 26.65 N ATOM 1663 CZ ARG A 176 0.250 3.075 29.705 1.00 25.58 C ATOM 1664 NH1 ARG A 176 -0.699 3.989 29.885 1.00 28.07 N ATOM 1665 NH2 ARG A 176 -0.073 1.809 29.692 1.00 27.31 N ATOM 1666 HE ARG A 176 2.188 2.655 29.311 1.00 0.00 H ATOM 1667 HH12 ARG A 176 -1.681 3.692 30.057 1.00 0.00 H ATOM 1668 HH11 ARG A 176 -0.459 5.001 29.853 1.00 0.00 H ATOM 1669 HH22 ARG A 176 -1.058 1.522 29.864 1.00 0.00 H ATOM 1670 HH21 ARG A 176 0.654 1.089 29.509 1.00 0.00 H ATOM 1671 H ARG A 176 4.496 2.748 33.237 1.00 0.00 H ATOM 1672 N SER A 177 5.714 5.884 33.189 1.00 18.77 N ATOM 1673 CA SER A 177 6.188 7.207 33.474 1.00 17.79 C ATOM 1674 C SER A 177 7.667 7.430 33.227 1.00 18.27 C ATOM 1675 O SER A 177 8.090 8.576 33.028 1.00 18.11 O ATOM 1676 CB SER A 177 5.842 7.636 34.913 1.00 18.66 C ATOM 1677 OG SER A 177 6.481 6.836 35.820 1.00 18.45 O ATOM 1678 HG SER A 177 6.197 5.897 35.687 1.00 0.00 H ATOM 1679 H SER A 177 5.307 5.303 33.949 1.00 0.00 H ATOM 1680 N TYR A 178 8.476 6.364 33.312 1.00 18.31 N ATOM 1681 CA TYR A 178 9.882 6.477 33.053 1.00 16.79 C ATOM 1682 C TYR A 178 10.181 7.077 31.717 1.00 18.81 C ATOM 1683 O TYR A 178 11.219 7.730 31.504 1.00 16.33 O ATOM 1684 CB TYR A 178 10.583 5.099 33.098 1.00 18.26 C ATOM 1685 CG TYR A 178 10.619 4.399 34.437 1.00 18.38 C ATOM 1686 CD1 TYR A 178 10.447 5.083 35.618 1.00 19.89 C ATOM 1687 CD2 TYR A 178 10.857 3.021 34.508 1.00 19.11 C ATOM 1688 CE1 TYR A 178 10.541 4.423 36.834 1.00 20.17 C ATOM 1689 CE2 TYR A 178 10.940 2.351 35.705 1.00 18.67 C ATOM 1690 CZ TYR A 178 10.778 3.052 36.862 1.00 20.13 C ATOM 1691 OH TYR A 178 10.837 2.329 38.049 1.00 22.17 O ATOM 1692 HH TYR A 178 11.721 1.890 38.123 1.00 0.00 H ATOM 1693 H TYR A 178 8.077 5.439 33.570 1.00 0.00 H ATOM 1694 N PHE A 179 9.272 6.832 30.780 1.00 18.42 N ATOM 1695 CA PHE A 179 9.416 7.224 29.379 1.00 18.13 C ATOM 1696 C PHE A 179 8.541 8.396 28.905 1.00 21.37 C ATOM 1697 O PHE A 179 8.571 8.752 27.728 1.00 21.47 O ATOM 1698 CB PHE A 179 9.112 6.024 28.483 1.00 18.59 C ATOM 1699 CG PHE A 179 9.867 4.798 28.878 1.00 17.43 C ATOM 1700 CD1 PHE A 179 11.222 4.730 28.720 1.00 18.11 C ATOM 1701 CD2 PHE A 179 9.230 3.785 29.555 1.00 18.23 C ATOM 1702 CE1 PHE A 179 11.926 3.620 29.147 1.00 17.99 C ATOM 1703 CE2 PHE A 179 9.918 2.714 30.006 1.00 16.30 C ATOM 1704 CZ PHE A 179 11.288 2.632 29.817 1.00 17.83 C ATOM 1705 H PHE A 179 8.405 6.331 31.060 1.00 0.00 H ATOM 1706 N ALA A 180 7.747 8.947 29.815 1.00 24.81 N ATOM 1707 CA ALA A 180 7.014 10.163 29.546 1.00 28.04 C ATOM 1708 C ALA A 180 8.005 11.279 29.167 1.00 30.14 C ATOM 1709 O ALA A 180 7.591 12.153 28.430 1.00 42.86 O ATOM 1710 CB ALA A 180 6.240 10.586 30.764 1.00 27.49 C ATOM 1711 H ALA A 180 7.650 8.492 30.745 1.00 0.00 H TER 1712 ALA A 180 HETATM 1713 O HOH 1 10.151 -21.683 31.645 1.00 41.52 O HETATM 1714 O HOH 2 20.526 4.872 10.127 1.00 30.69 O HETATM 1715 O HOH 3 10.789 -2.626 45.623 1.00 31.77 O HETATM 1716 O HOH 4 -0.056 -9.430 40.588 1.00 39.89 O HETATM 1717 O HOH 5 6.895 14.438 27.978 1.00 42.23 O HETATM 1718 O HOH 6 -0.526 -4.233 26.260 1.00 36.77 O HETATM 1719 O HOH 7 18.262 -11.093 15.386 1.00 32.04 O HETATM 1720 O HOH 8 19.083 7.732 9.120 1.00 28.82 O HETATM 1721 O HOH 9 33.502 6.172 21.116 1.00 38.36 O HETATM 1722 O HOH 10 9.174 -18.074 36.939 1.00 22.97 O HETATM 1723 O HOH 11 12.194 0.183 37.959 1.00 18.45 O HETATM 1724 O HOH 12 14.740 -12.902 14.065 1.00 31.03 O HETATM 1725 O HOH 13 3.917 5.070 35.209 1.00 26.42 O HETATM 1726 O HOH 14 22.289 13.625 13.524 1.00 27.97 O HETATM 1727 O HOH 15 16.752 13.224 29.267 1.00 43.90 O HETATM 1728 O HOH 16 25.951 7.525 27.697 1.00 31.51 O HETATM 1729 O HOH 17 15.718 3.146 50.923 1.00 36.51 O HETATM 1730 O HOH 18 22.094 -10.665 46.790 1.00 40.16 O HETATM 1731 O HOH 19 0.530 -12.663 31.962 1.00 42.12 O HETATM 1732 O HOH 20 4.950 -15.284 27.033 1.00 26.60 O HETATM 1733 O HOH 21 -1.753 1.588 27.617 1.00 21.29 O HETATM 1734 O HOH 22 31.075 1.409 26.995 1.00 30.41 O HETATM 1735 O HOH 23 28.843 2.429 25.077 1.00 15.94 O HETATM 1736 O HOH 24 22.101 0.880 14.225 1.00 27.85 O HETATM 1737 O HOH 25 6.037 -3.533 34.787 1.00 20.67 O HETATM 1738 O HOH 26 29.136 0.605 10.298 1.00 38.30 O HETATM 1739 O HOH 27 10.948 1.190 15.350 1.00 17.48 O HETATM 1740 O HOH 28 14.002 -20.891 24.809 1.00 35.58 O HETATM 1741 O HOH 29 6.848 -18.688 30.196 1.00 26.50 O HETATM 1742 O HOH 30 4.326 8.531 23.815 1.00 27.04 O HETATM 1743 O HOH 31 24.565 3.354 33.026 1.00 18.76 O HETATM 1744 O HOH 32 15.522 6.112 17.592 1.00 20.15 O HETATM 1745 O HOH 33 11.236 2.308 44.879 1.00 27.15 O HETATM 1746 O HOH 34 21.073 -9.530 26.349 1.00 10.08 O HETATM 1747 O HOH 35 2.778 2.940 18.306 1.00 30.14 O HETATM 1748 O HOH 36 20.776 -7.107 10.280 1.00 37.58 O HETATM 1749 O HOH 37 0.131 -0.878 36.556 1.00 38.44 O HETATM 1750 O HOH 38 7.952 7.229 18.360 1.00 19.02 O HETATM 1751 O HOH 39 5.602 -9.576 13.895 1.00 27.09 O HETATM 1752 O HOH 40 6.160 -21.576 29.345 1.00 41.12 O HETATM 1753 O HOH 41 5.441 -5.909 18.420 1.00 23.64 O HETATM 1754 O HOH 42 13.591 7.742 38.578 1.00 20.32 O HETATM 1755 O HOH 43 21.332 1.885 45.512 1.00 23.03 O HETATM 1756 O HOH 44 27.908 11.679 22.533 1.00 35.15 O HETATM 1757 O HOH 45 2.991 -12.283 11.683 1.00 30.76 O HETATM 1758 O HOH 46 25.308 14.327 14.425 1.00 25.70 O HETATM 1759 O HOH 47 1.283 -8.109 33.159 1.00 34.02 O HETATM 1760 O HOH 48 20.822 9.138 38.967 1.00 28.17 O HETATM 1761 O HOH 49 14.132 -1.636 38.857 1.00 17.41 O HETATM 1762 O HOH 50 32.649 -3.346 23.258 1.00 29.70 O HETATM 1763 O HOH 51 22.773 5.959 39.254 1.00 35.20 O HETATM 1764 O HOH 52 18.410 -7.769 15.276 1.00 31.38 O HETATM 1765 O HOH 53 24.785 -12.034 24.638 1.00 17.39 O HETATM 1766 O HOH 54 22.074 3.907 40.357 1.00 36.69 O HETATM 1767 O HOH 55 11.258 -10.332 13.972 1.00 24.04 O HETATM 1768 O HOH 56 20.214 -17.116 36.940 1.00 29.54 O HETATM 1769 O HOH 57 26.179 11.712 26.346 1.00 32.57 O HETATM 1770 O HOH 58 3.121 -13.685 38.616 1.00 38.75 O HETATM 1771 O HOH 59 19.453 12.951 16.353 1.00 26.63 O HETATM 1772 O HOH 60 -0.588 -4.128 34.366 1.00 37.75 O HETATM 1773 O HOH 61 20.170 -17.000 19.383 1.00 16.34 O HETATM 1774 O HOH 62 24.892 8.772 15.893 1.00 16.31 O HETATM 1775 O HOH 63 19.125 -19.332 28.134 1.00 23.73 O HETATM 1776 O HOH 64 26.124 3.964 38.159 1.00 40.26 O HETATM 1777 O HOH 65 24.778 -12.632 15.286 1.00 26.01 O HETATM 1778 O HOH 66 25.227 -6.699 16.170 1.00 23.95 O HETATM 1779 O HOH 67 25.403 -7.412 20.714 1.00 17.58 O HETATM 1780 O HOH 68 11.413 -5.482 48.841 1.00 31.37 O HETATM 1781 O HOH 69 22.241 -20.143 33.930 1.00 34.49 O HETATM 1782 O HOH 70 19.492 14.004 9.438 1.00 40.19 O HETATM 1783 O HOH 71 21.214 -20.686 26.586 1.00 26.00 O HETATM 1784 O HOH 72 5.557 5.235 16.614 1.00 28.22 O HETATM 1785 O HOH 73 0.262 -11.524 37.177 1.00 34.58 O HETATM 1786 O HOH 74 17.435 -3.201 27.688 1.00 21.46 O HETATM 1787 O HOH 75 31.234 -7.150 16.858 1.00 36.61 O HETATM 1788 O HOH 76 10.203 5.463 45.444 1.00 32.26 O HETATM 1789 O HOH 77 14.850 11.394 24.330 1.00 27.15 O HETATM 1790 O HOH 78 31.700 2.619 21.867 1.00 30.91 O HETATM 1791 O HOH 79 32.596 7.212 26.605 1.00 31.46 O HETATM 1792 O HOH 80 24.375 9.609 33.279 1.00 24.91 O HETATM 1793 O HOH 81 26.298 -10.154 30.675 1.00 29.37 O HETATM 1794 O HOH 82 3.348 -1.776 41.490 1.00 36.81 O HETATM 1795 O HOH 83 14.824 -22.754 38.130 1.00 23.20 O HETATM 1796 O HOH 84 23.828 -18.248 35.307 1.00 29.59 O HETATM 1797 O HOH 85 16.711 -5.357 15.770 1.00 29.22 O HETATM 1798 O HOH 86 28.982 -10.000 26.867 1.00 32.34 O HETATM 1799 O HOH 87 21.752 5.211 43.310 1.00 37.28 O HETATM 1800 O HOH 88 19.691 -24.037 38.406 1.00 27.65 O HETATM 1801 O HOH 89 24.289 -9.209 29.116 1.00 23.15 O HETATM 1802 O HOH 90 -0.575 -2.384 28.076 1.00 27.57 O HETATM 1803 O HOH 91 24.493 12.303 29.767 1.00 27.76 O HETATM 1804 O HOH 92 29.549 3.463 12.351 1.00 29.88 O HETATM 1805 O HOH 93 18.002 10.110 28.155 1.00 22.04 O HETATM 1806 O HOH 94 26.071 -17.137 33.637 1.00 26.15 O HETATM 1807 O HOH 95 3.356 -7.513 13.382 1.00 42.21 O HETATM 1808 O HOH 96 24.111 14.633 28.458 1.00 50.23 O HETATM 1809 O HOH 97 13.806 11.403 21.829 1.00 14.38 O HETATM 1810 O HOH 98 -1.521 0.291 32.998 1.00 30.71 O HETATM 1811 O HOH 99 9.178 7.771 42.290 1.00 35.45 O HETATM 1812 O HOH 100 2.136 3.709 22.304 1.00 18.36 O HETATM 1813 O HOH 101 27.729 -1.482 37.313 1.00 31.22 O HETATM 1814 O HOH 102 26.341 -5.957 18.568 1.00 18.81 O HETATM 1815 O HOH 103 7.723 -3.004 9.945 1.00 29.39 O HETATM 1816 O HOH 104 2.566 -13.989 25.715 1.00 15.59 O HETATM 1817 O HOH 105 -0.778 -11.973 34.537 1.00 37.25 O HETATM 1818 O HOH 106 5.117 1.007 40.342 1.00 21.54 O HETATM 1819 O HOH 107 7.186 -20.001 37.450 1.00 42.40 O HETATM 1820 O HOH 108 10.233 -2.910 9.758 1.00 25.97 O HETATM 1821 O HOH 109 6.779 6.589 43.796 1.00 44.03 O HETATM 1822 O HOH 110 5.397 -9.127 9.665 1.00 30.89 O HETATM 1823 O HOH 111 15.909 10.995 29.533 1.00 21.13 O HETATM 1824 O HOH 112 15.667 16.945 17.479 1.00 32.62 O HETATM 1825 O HOH 113 27.445 -12.578 25.408 1.00 23.88 O HETATM 1826 O HOH 114 -1.818 -14.219 31.334 1.00 45.79 O HETATM 1827 O HOH 115 25.356 -20.941 39.102 1.00 37.90 O HETATM 1828 O HOH 116 7.120 7.554 13.519 1.00 42.85 O HETATM 1829 O HOH 117 -3.602 -12.953 29.646 1.00 37.17 O HETATM 1830 O1 GHX A 118 21.061 -13.438 34.787 1.00 -0.40 O HETATM 1831 C34 GHX A 118 22.230 -13.657 35.068 1.00 0.18 C HETATM 1832 N33 GHX A 118 22.764 -14.795 35.333 1.00 -0.29 N HETATM 1833 C32 GHX A 118 24.193 -14.745 35.608 1.00 0.03 C HETATM 1834 C31 GHX A 118 24.544 -13.280 35.222 1.00 -0.01 C HETATM 1835 C30 GHX A 118 23.204 -12.540 35.178 1.00 0.05 C HETATM 1836 C29 GHX A 118 22.984 -11.596 33.975 1.00 -0.01 C HETATM 1837 C26 GHX A 118 23.886 -10.392 33.911 1.00 0.07 C HETATM 1838 C27 GHX A 118 23.592 -9.488 32.689 1.00 0.07 C HETATM 1839 O28 GHX A 118 24.611 -8.550 32.884 1.00 -0.39 O HETATM 1840 H12 GHX A 118 24.495 -8.129 33.728 1.00 0.21 H HETATM 1841 H10 GHX A 118 22.592 -9.032 32.740 1.00 0.06 H HETATM 1842 H11 GHX A 118 23.701 -10.028 31.737 1.00 0.06 H HETATM 1843 N24 GHX A 118 23.781 -9.574 35.130 1.00 -0.28 N HETATM 1844 C23 GHX A 118 24.749 -9.636 36.074 1.00 0.20 C HETATM 1845 O25 GHX A 118 25.717 -10.372 36.004 1.00 -0.39 O HETATM 1846 C15 GHX A 118 24.572 -8.736 37.239 1.00 0.14 C HETATM 1847 C16 GHX A 118 25.413 -7.476 36.964 1.00 0.02 C HETATM 1848 C17 GHX A 118 25.223 -6.274 37.866 1.00 -0.04 C HETATM 1849 C22 GHX A 118 26.340 -5.657 38.405 1.00 -0.06 C HETATM 1850 C21 GHX A 118 26.217 -4.547 39.218 1.00 -0.07 C HETATM 1851 C20 GHX A 118 24.966 -4.027 39.519 1.00 -0.07 C HETATM 1852 C19 GHX A 118 23.842 -4.618 38.968 1.00 -0.07 C HETATM 1853 C18 GHX A 118 23.977 -5.739 38.116 1.00 -0.06 C HETATM 1854 H21 GHX A 118 23.098 -6.179 37.658 1.00 0.06 H HETATM 1855 H20 GHX A 118 22.858 -4.221 39.190 1.00 0.06 H HETATM 1856 H19 GHX A 118 24.870 -3.170 40.176 1.00 0.06 H HETATM 1857 H18 GHX A 118 27.106 -4.078 39.624 1.00 0.06 H HETATM 1858 H17 GHX A 118 27.326 -6.051 38.185 1.00 0.06 H HETATM 1859 H15 GHX A 118 25.187 -7.152 35.938 1.00 0.05 H HETATM 1860 H16 GHX A 118 26.471 -7.770 37.032 1.00 0.05 H HETATM 1861 N13 GHX A 118 25.004 -9.324 38.503 1.00 -0.24 N HETATM 1862 C12 GHX A 118 24.431 -10.429 38.940 1.00 0.32 C HETATM 1863 O14 GHX A 118 23.554 -11.044 38.330 1.00 -0.38 O HETATM 1864 O11 GHX A 118 24.902 -10.976 40.228 1.00 -0.25 O HETATM 1865 C10 GHX A 118 24.435 -12.288 40.615 1.00 0.11 C HETATM 1866 C1 GHX A 118 23.246 -12.207 41.586 1.00 -0.01 C HETATM 1867 C6 GHX A 118 22.038 -11.637 41.213 1.00 -0.06 C HETATM 1868 C5 GHX A 118 20.949 -11.555 42.092 1.00 -0.07 C HETATM 1869 C4 GHX A 118 21.049 -12.045 43.389 1.00 -0.07 C HETATM 1870 C3 GHX A 118 22.249 -12.645 43.769 1.00 -0.07 C HETATM 1871 C2 GHX A 118 23.336 -12.719 42.885 1.00 -0.06 C HETATM 1872 H29 GHX A 118 24.260 -13.180 43.214 1.00 0.06 H HETATM 1873 H28 GHX A 118 22.344 -13.062 44.765 1.00 0.06 H HETATM 1874 H27 GHX A 118 20.220 -11.963 44.083 1.00 0.06 H HETATM 1875 H26 GHX A 118 20.021 -11.106 41.757 1.00 0.06 H HETATM 1876 H25 GHX A 118 21.932 -11.242 40.209 1.00 0.06 H HETATM 1877 H23 GHX A 118 25.258 -12.829 41.105 1.00 0.08 H HETATM 1878 H24 GHX A 118 24.122 -12.835 39.713 1.00 0.08 H HETATM 1879 H22 GHX A 118 25.731 -8.891 39.036 1.00 0.19 H HETATM 1880 H14 GHX A 118 23.509 -8.466 37.323 1.00 0.08 H HETATM 1881 H13 GHX A 118 22.994 -8.972 35.261 1.00 0.19 H HETATM 1882 H9 GHX A 118 24.920 -10.757 33.826 1.00 0.06 H HETATM 1883 H7 GHX A 118 21.945 -11.237 34.014 1.00 0.03 H HETATM 1884 H8 GHX A 118 23.136 -12.180 33.056 1.00 0.03 H HETATM 1885 H6 GHX A 118 23.062 -11.969 36.107 1.00 0.05 H HETATM 1886 H4 GHX A 118 25.034 -13.248 34.238 1.00 0.03 H HETATM 1887 H5 GHX A 118 25.207 -12.831 35.976 1.00 0.03 H HETATM 1888 H2 GHX A 118 24.745 -15.466 34.987 1.00 0.05 H HETATM 1889 H3 GHX A 118 24.403 -14.940 36.670 1.00 0.05 H HETATM 1890 H1 GHX A 118 22.240 -15.647 35.349 1.00 0.19 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1830 1831 CONECT 1831 1830 1832 1835 CONECT 1832 1831 1833 1890 CONECT 1833 1832 1834 1888 1889 CONECT 1834 1833 1835 1886 1887 CONECT 1835 1831 1834 1836 1885 CONECT 1836 1835 1837 1883 1884 CONECT 1837 1836 1838 1843 1882 CONECT 1838 1837 1839 1841 1842 CONECT 1839 1838 1840 CONECT 1840 1839 CONECT 1841 1838 CONECT 1842 1838 CONECT 1843 1837 1844 1881 CONECT 1844 1843 1845 1846 CONECT 1845 1844 CONECT 1846 1844 1847 1861 1880 CONECT 1847 1846 1848 1859 1860 CONECT 1848 1847 1849 1853 CONECT 1849 1848 1850 1858 CONECT 1850 1849 1851 1857 CONECT 1851 1850 1852 1856 CONECT 1852 1851 1853 1855 CONECT 1853 1848 1852 1854 CONECT 1854 1853 CONECT 1855 1852 CONECT 1856 1851 CONECT 1857 1850 CONECT 1858 1849 CONECT 1859 1847 CONECT 1860 1847 CONECT 1861 1846 1862 1879 CONECT 1862 1861 1863 1864 CONECT 1863 1862 CONECT 1864 1862 1865 CONECT 1865 1864 1866 1877 1878 CONECT 1866 1865 1867 1871 CONECT 1867 1866 1868 1876 CONECT 1868 1867 1869 1875 CONECT 1869 1868 1870 1874 CONECT 1870 1869 1871 1873 CONECT 1871 1866 1870 1872 CONECT 1872 1871 CONECT 1873 1870 CONECT 1874 1869 CONECT 1875 1868 CONECT 1876 1867 CONECT 1877 1865 CONECT 1878 1865 CONECT 1879 1861 CONECT 1880 1846 CONECT 1881 1843 CONECT 1882 1837 CONECT 1883 1836 CONECT 1884 1836 CONECT 1885 1835 CONECT 1886 1834 CONECT 1887 1834 CONECT 1888 1833 CONECT 1889 1833 CONECT 1890 1832 MASTER 0 0 0 0 0 0 0 0 1889 1 65 14 END
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Pocket-Ligand
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Related entries of code: 5c1x
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3qzq
RCSB PDB
PDBbind
187aa, >3QZQ_1|Chains... at 99%
3sji
RCSB PDB
PDBbind
190aa, >3SJI_1|Chain... at 91%
3sjo
RCSB PDB
PDBbind
190aa, >3SJO_1|Chains... at 95%
4ght
RCSB PDB
PDBbind
192aa, >4GHT_1|Chains... at 94%
5c1y
RCSB PDB
PDBbind
192aa, >5C1Y_1|Chain... at 94%
5c20
RCSB PDB
PDBbind
192aa, >5C20_1|Chain... at 94%
5dp4
RCSB PDB
PDBbind
192aa, >5DP4_1|Chains... at 94%
5dp5
RCSB PDB
PDBbind
181aa, >5DP5_1|Chain... at 98%
5dp6
RCSB PDB
PDBbind
192aa, >5DP6_1|Chains... at 94%
5dp7
RCSB PDB
PDBbind
192aa, >5DP7_1|Chain... at 94%
5dp8
RCSB PDB
PDBbind
192aa, >5DP8_1|Chain... at 94%
5dp9
RCSB PDB
PDBbind
192aa, >5DP9_1|Chain... at 94%
5dpa
RCSB PDB
PDBbind
192aa, >5DPA_1|Chain... at 94%
5gso
RCSB PDB
PDBbind
204aa, >5GSO_1|Chains... *
5gsw
RCSB PDB
PDBbind
183aa, >5GSW_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5c1x
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
EV71 3C Proteinase
Ligand Name
GHX
EC.Number
E.C.3.4.22.28
Resolution
1.86(Å)
Affinity (Kd/Ki/IC50)
IC50=1.767uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J.Mol.Recognit. Vol. 29: pp. 520-527
Ligand Properties
Formula
C
2
4
H
2
9
N
3
O
5
Molecular Weight
439.504
Exact Mass
439.211
No. of atoms
61
No. of bonds
63
Polar Surface Area
116.76
LOGP Value
1.93 (
Computed with XLOGP3
)
2.64 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 3
Canonical SMILES
OC[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C[C@@H]1CCNC1=O
InChI String
InChI=1S/C24H29N3O5/c28-15-20(14-19-11-12-25-22(19)29)26-23(30)21(13-17-7-3-1-4-8-17)27-24(31)32-16-18-9-5-2-6-10-18/h1-10,19-21,28H,11-16H2,(H,25,29)(H,26,30)(H,27,31)/t19-,20-,21-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A9XG43
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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