Browse entries in the PDBbind-CN Database
HEADER 1GYX_COMPLEX COMPND 1GYX_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 76 PRO HIS ILE ASP ILE LYS CYS PHE PRO ARG GLU LEU ASP SEQRES 2 A 76 GLU GLN GLN LYS ALA ALA LEU ALA ALA ASP ILE THR ASP SEQRES 3 A 76 VAL ILE ILE ARG HIS LEU ASN SER LYS ASP SER SER ILE SEQRES 4 A 76 SER ILE ALA LEU GLN GLN ILE GLN PRO GLU SER TRP GLN SEQRES 5 A 76 ALA ILE TRP ASP ALA GLU ILE ALA PRO GLN MET GLU ALA SEQRES 6 A 76 LEU ILE LYS LYS PRO GLY TYR SER MET ASN ALA SEQRES 1 B 76 PRO HIS ILE ASP ILE LYS CYS PHE PRO ARG GLU LEU ASP SEQRES 2 B 76 GLU GLN GLN LYS ALA ALA LEU ALA ALA ASP ILE THR ASP SEQRES 3 B 76 VAL ILE ILE ARG HIS LEU ASN SER LYS ASP SER SER ILE SEQRES 4 B 76 SER ILE ALA LEU GLN GLN ILE GLN PRO GLU SER TRP GLN SEQRES 5 B 76 ALA ILE TRP ASP ALA GLU ILE ALA PRO GLN MET GLU ALA SEQRES 6 B 76 LEU ILE LYS LYS PRO GLY TYR SER MET ASN ALA HET BEZ A 457 14 ATOM 1 N PRO A 1 13.031 4.103 -0.578 1.00 3.50 N ATOM 2 CA PRO A 1 13.133 3.453 0.732 1.00 3.17 C ATOM 3 C PRO A 1 11.886 3.658 1.565 1.00 2.73 C ATOM 4 O PRO A 1 11.289 4.739 1.476 1.00 3.02 O ATOM 5 CB PRO A 1 14.366 4.059 1.402 1.00 3.25 C ATOM 6 CG PRO A 1 15.191 4.494 0.221 1.00 3.14 C ATOM 7 CD PRO A 1 14.151 5.074 -0.694 1.00 4.12 C ATOM 8 HA PRO A 1 13.229 2.372 0.627 1.00 0.00 H ATOM 9 HD3 PRO A 1 13.846 6.067 -0.363 1.00 0.00 H ATOM 10 HD2 PRO A 1 14.517 5.131 -1.719 1.00 0.00 H ATOM 11 HG3 PRO A 1 15.697 3.647 -0.242 1.00 0.00 H ATOM 12 HG2 PRO A 1 15.928 5.244 0.508 1.00 0.00 H ATOM 13 HB2 PRO A 1 14.097 4.908 2.030 1.00 0.00 H ATOM 14 HB3 PRO A 1 14.894 3.318 2.002 1.00 0.00 H ATOM 15 N HIS A 2 11.541 2.692 2.403 1.00 2.50 N ATOM 16 CA HIS A 2 10.449 2.810 3.350 1.00 2.42 C ATOM 17 C HIS A 2 11.007 2.729 4.772 1.00 2.53 C ATOM 18 O HIS A 2 11.730 1.768 5.103 1.00 3.07 O ATOM 19 CB HIS A 2 9.407 1.704 3.168 1.00 2.67 C ATOM 20 CG HIS A 2 8.281 1.872 4.149 1.00 3.02 C ATOM 21 ND1 HIS A 2 7.412 2.929 4.133 1.00 3.11 N ATOM 22 CD2 HIS A 2 7.974 1.100 5.225 1.00 2.67 C ATOM 23 CE1 HIS A 2 6.588 2.804 5.150 1.00 3.49 C ATOM 24 NE2 HIS A 2 6.891 1.689 5.809 1.00 2.72 N ATOM 25 HA HIS A 2 9.960 3.768 3.174 1.00 0.00 H ATOM 26 HB2 HIS A 2 9.009 1.749 2.154 1.00 0.00 H ATOM 27 HB3 HIS A 2 9.881 0.735 3.328 1.00 0.00 H ATOM 28 HD2 HIS A 2 8.487 0.196 5.553 1.00 0.00 H ATOM 29 HE1 HIS A 2 5.789 3.499 5.410 1.00 0.00 H ATOM 30 H HIS A 2 12.081 1.803 2.381 1.00 0.00 H ATOM 31 N ILE A 3 10.754 3.757 5.572 1.00 2.82 N ATOM 32 CA ILE A 3 11.296 3.851 6.924 1.00 2.85 C ATOM 33 C ILE A 3 10.151 3.704 7.919 1.00 3.20 C ATOM 34 O ILE A 3 9.158 4.439 7.820 1.00 3.29 O ATOM 35 CB ILE A 3 12.038 5.180 7.121 1.00 3.39 C ATOM 36 CG1 ILE A 3 13.224 5.336 6.168 1.00 4.91 C ATOM 37 CG2 ILE A 3 12.581 5.310 8.548 1.00 3.32 C ATOM 38 CD1 ILE A 3 12.975 5.954 4.829 1.00 6.42 C ATOM 39 HA ILE A 3 12.020 3.053 7.088 1.00 0.00 H ATOM 40 HB ILE A 3 11.300 5.955 6.916 1.00 0.00 H ATOM 41 HG12 ILE A 3 13.968 5.950 6.675 1.00 0.00 H ATOM 42 HG13 ILE A 3 13.633 4.341 5.994 1.00 0.00 H ATOM 43 HD11 ILE A 3 12.249 5.352 4.282 1.00 0.00 H ATOM 44 HD12 ILE A 3 12.585 6.963 4.963 1.00 0.00 H ATOM 45 HD13 ILE A 3 13.910 5.996 4.270 1.00 0.00 H ATOM 46 HG21 ILE A 3 11.753 5.267 9.256 1.00 0.00 H ATOM 47 HG22 ILE A 3 13.274 4.493 8.747 1.00 0.00 H ATOM 48 HG23 ILE A 3 13.100 6.263 8.652 1.00 0.00 H ATOM 49 H ILE A 3 10.146 4.525 5.222 1.00 0.00 H ATOM 50 N ASP A 4 10.324 2.797 8.874 1.00 2.84 N ATOM 51 CA ASP A 4 9.326 2.587 9.920 1.00 2.59 C ATOM 52 C ASP A 4 9.948 2.985 11.254 1.00 2.77 C ATOM 53 O ASP A 4 11.022 2.480 11.595 1.00 2.88 O ATOM 54 CB ASP A 4 8.838 1.136 9.932 1.00 2.48 C ATOM 55 CG ASP A 4 7.731 0.907 10.938 1.00 3.50 C ATOM 56 OD1 ASP A 4 8.063 0.699 12.121 1.00 3.21 O ATOM 57 OD2 ASP A 4 6.536 0.999 10.596 1.00 6.11 O ATOM 58 HA ASP A 4 8.448 3.204 9.730 1.00 0.00 H ATOM 59 HB2 ASP A 4 8.466 0.883 8.939 1.00 0.00 H ATOM 60 HB3 ASP A 4 9.677 0.486 10.181 1.00 0.00 H ATOM 61 H ASP A 4 11.191 2.222 8.877 1.00 0.00 H ATOM 62 N ILE A 5 9.308 3.893 11.978 1.00 2.67 N ATOM 63 CA ILE A 5 9.822 4.329 13.276 1.00 2.64 C ATOM 64 C ILE A 5 8.837 3.916 14.359 1.00 2.72 C ATOM 65 O ILE A 5 7.663 4.294 14.290 1.00 3.14 O ATOM 66 CB ILE A 5 9.986 5.850 13.319 1.00 2.93 C ATOM 67 CG1 ILE A 5 10.921 6.349 12.205 1.00 2.82 C ATOM 68 CG2 ILE A 5 10.414 6.302 14.712 1.00 2.60 C ATOM 69 CD1 ILE A 5 10.863 7.839 11.957 1.00 3.80 C ATOM 70 HA ILE A 5 10.796 3.866 13.437 1.00 0.00 H ATOM 71 HB ILE A 5 9.019 6.312 13.120 1.00 0.00 H ATOM 72 HG12 ILE A 5 11.944 6.089 12.477 1.00 0.00 H ATOM 73 HG13 ILE A 5 10.651 5.839 11.280 1.00 0.00 H ATOM 74 HD11 ILE A 5 9.850 8.119 11.670 1.00 0.00 H ATOM 75 HD12 ILE A 5 11.143 8.369 12.867 1.00 0.00 H ATOM 76 HD13 ILE A 5 11.554 8.100 11.156 1.00 0.00 H ATOM 77 HG21 ILE A 5 9.656 6.006 15.437 1.00 0.00 H ATOM 78 HG22 ILE A 5 11.365 5.835 14.968 1.00 0.00 H ATOM 79 HG23 ILE A 5 10.525 7.386 14.723 1.00 0.00 H ATOM 80 H ILE A 5 8.423 4.303 11.616 1.00 0.00 H ATOM 81 N LYS A 6 9.306 3.077 15.291 1.00 2.68 N ATOM 82 CA LYS A 6 8.486 2.664 16.417 1.00 2.74 C ATOM 83 C LYS A 6 9.023 3.318 17.689 1.00 2.52 C ATOM 84 O LYS A 6 10.247 3.308 17.892 1.00 3.24 O ATOM 85 CB LYS A 6 8.459 1.149 16.571 1.00 3.45 C ATOM 86 CG LYS A 6 7.589 0.459 15.519 1.00 4.22 C ATOM 87 CD LYS A 6 7.609 -1.048 15.641 1.00 5.53 C ATOM 88 CE LYS A 6 6.699 -1.792 14.681 1.00 7.53 C ATOM 89 NZ LYS A 6 7.145 -1.694 13.278 1.00 7.82 N ATOM 90 HA LYS A 6 7.461 2.986 16.236 1.00 0.00 H ATOM 91 HB2 LYS A 6 9.478 0.772 16.482 1.00 0.00 H ATOM 92 HB3 LYS A 6 8.068 0.907 17.559 1.00 0.00 H ATOM 93 HG2 LYS A 6 6.562 0.805 15.635 1.00 0.00 H ATOM 94 HG3 LYS A 6 7.954 0.734 14.529 1.00 0.00 H ATOM 95 HD2 LYS A 6 8.630 -1.386 15.467 1.00 0.00 H ATOM 96 HD3 LYS A 6 7.310 -1.307 16.657 1.00 0.00 H ATOM 97 HE2 LYS A 6 5.695 -1.374 14.758 1.00 0.00 H ATOM 98 HE3 LYS A 6 6.676 -2.844 14.967 1.00 0.00 H ATOM 99 HZ1 LYS A 6 7.162 -0.695 12.990 1.00 0.00 H ATOM 100 HZ2 LYS A 6 8.099 -2.098 13.190 1.00 0.00 H ATOM 101 HZ3 LYS A 6 6.487 -2.220 12.669 1.00 0.00 H ATOM 102 H LYS A 6 10.277 2.714 15.207 1.00 0.00 H ATOM 103 N CYS A 7 8.158 3.838 18.554 1.00 2.74 N ATOM 104 CA CYS A 7 8.616 4.459 19.774 1.00 2.77 C ATOM 105 C CYS A 7 7.521 4.420 20.832 1.00 2.63 C ATOM 106 O CYS A 7 6.354 4.249 20.506 1.00 2.81 O ATOM 107 CB CYS A 7 9.026 5.923 19.513 1.00 2.81 C ATOM 108 SG CYS A 7 7.697 6.981 18.898 1.00 4.06 S ATOM 109 HA CYS A 7 9.483 3.904 20.134 1.00 0.00 H ATOM 110 HB2 CYS A 7 9.830 5.925 18.777 1.00 0.00 H ATOM 111 HB3 CYS A 7 9.391 6.346 20.449 1.00 0.00 H ATOM 112 HG CYS A 7 6.671 7.012 19.821 1.00 0.00 H ATOM 113 H CYS A 7 7.139 3.797 18.349 1.00 0.00 H ATOM 114 N PHE A 8 7.937 4.678 22.068 1.00 3.82 N ATOM 115 CA PHE A 8 6.948 4.804 23.154 1.00 4.67 C ATOM 116 C PHE A 8 6.160 6.075 22.868 1.00 5.71 C ATOM 117 O PHE A 8 6.612 6.978 22.156 1.00 6.70 O ATOM 118 CB PHE A 8 7.597 4.891 24.518 1.00 5.04 C ATOM 119 CG PHE A 8 8.227 3.643 25.067 1.00 5.81 C ATOM 120 CD1 PHE A 8 8.370 2.478 24.353 1.00 6.82 C ATOM 121 CD2 PHE A 8 8.761 3.692 26.351 1.00 7.88 C ATOM 122 CE1 PHE A 8 8.973 1.372 24.905 1.00 6.94 C ATOM 123 CE2 PHE A 8 9.371 2.593 26.908 1.00 8.15 C ATOM 124 CZ PHE A 8 9.495 1.426 26.187 1.00 7.26 C ATOM 125 HA PHE A 8 6.310 3.920 23.179 1.00 0.00 H ATOM 126 HB2 PHE A 8 8.375 5.652 24.462 1.00 0.00 H ATOM 127 HB3 PHE A 8 6.830 5.208 25.225 1.00 0.00 H ATOM 128 HD2 PHE A 8 8.695 4.617 26.924 1.00 0.00 H ATOM 129 HE2 PHE A 8 9.758 2.645 27.925 1.00 0.00 H ATOM 130 HZ PHE A 8 9.996 0.559 26.618 1.00 0.00 H ATOM 131 HE1 PHE A 8 9.041 0.448 24.331 1.00 0.00 H ATOM 132 HD1 PHE A 8 7.998 2.429 23.329 1.00 0.00 H ATOM 133 H PHE A 8 8.952 4.790 22.267 1.00 0.00 H ATOM 134 N PRO A 9 4.947 6.181 23.398 1.00 6.95 N ATOM 135 CA PRO A 9 4.098 7.303 23.063 1.00 8.46 C ATOM 136 C PRO A 9 4.673 8.647 23.457 1.00 11.54 C ATOM 137 O PRO A 9 5.410 8.862 24.414 1.00 11.66 O ATOM 138 CB PRO A 9 2.824 7.022 23.853 1.00 9.55 C ATOM 139 CG PRO A 9 2.801 5.536 23.984 1.00 8.80 C ATOM 140 CD PRO A 9 4.248 5.160 24.226 1.00 7.73 C ATOM 141 HA PRO A 9 3.958 7.380 21.985 1.00 0.00 H ATOM 142 HD3 PRO A 9 4.514 5.247 25.279 1.00 0.00 H ATOM 143 HD2 PRO A 9 4.463 4.149 23.881 1.00 0.00 H ATOM 144 HG3 PRO A 9 2.429 5.073 23.070 1.00 0.00 H ATOM 145 HG2 PRO A 9 2.177 5.232 24.824 1.00 0.00 H ATOM 146 HB2 PRO A 9 2.863 7.497 24.833 1.00 0.00 H ATOM 147 HB3 PRO A 9 1.946 7.377 23.313 1.00 0.00 H ATOM 148 N ARG A 10 4.300 9.621 22.623 1.00 14.48 N ATOM 149 CA ARG A 10 4.594 11.013 22.915 1.00 17.13 C ATOM 150 C ARG A 10 3.634 11.896 22.105 1.00 18.72 C ATOM 151 O ARG A 10 3.122 11.490 21.081 1.00 19.51 O ATOM 152 CB ARG A 10 6.012 11.446 22.661 1.00 17.85 C ATOM 153 CG ARG A 10 6.534 11.145 21.280 1.00 17.81 C ATOM 154 CD ARG A 10 7.352 9.867 21.288 1.00 18.96 C ATOM 155 NE ARG A 10 8.509 9.969 22.133 1.00 19.08 N ATOM 156 CZ ARG A 10 9.311 9.057 22.642 1.00 19.36 C ATOM 157 NH1 ARG A 10 9.267 7.736 22.498 1.00 15.88 N ATOM 158 NH2 ARG A 10 10.311 9.520 23.415 1.00 21.31 N ATOM 159 HA ARG A 10 4.456 11.127 23.990 1.00 0.00 H ATOM 160 HB2 ARG A 10 6.070 12.523 22.817 1.00 0.00 H ATOM 161 HB3 ARG A 10 6.654 10.941 23.383 1.00 0.00 H ATOM 162 HG2 ARG A 10 5.693 11.029 20.596 1.00 0.00 H ATOM 163 HG3 ARG A 10 7.162 11.971 20.946 1.00 0.00 H ATOM 164 HD2 ARG A 10 7.678 9.652 20.270 1.00 0.00 H ATOM 165 HD3 ARG A 10 6.725 9.051 21.647 1.00 0.00 H ATOM 166 HE ARG A 10 8.760 10.945 22.391 1.00 0.00 H ATOM 167 HH12 ARG A 10 9.977 7.138 22.966 1.00 0.00 H ATOM 168 HH11 ARG A 10 8.522 7.301 21.917 1.00 0.00 H ATOM 169 HH22 ARG A 10 10.983 8.855 23.850 1.00 0.00 H ATOM 170 HH21 ARG A 10 10.412 10.542 23.577 1.00 0.00 H ATOM 171 H ARG A 10 3.790 9.379 21.749 1.00 0.00 H ATOM 172 N GLU A 11 3.455 13.085 22.655 1.00 19.15 N ATOM 173 CA GLU A 11 2.572 14.075 22.046 1.00 18.22 C ATOM 174 C GLU A 11 3.305 14.714 20.883 1.00 16.98 C ATOM 175 O GLU A 11 4.316 15.400 21.063 1.00 18.11 O ATOM 176 CB GLU A 11 2.195 15.109 23.094 1.00 18.87 C ATOM 177 HA GLU A 11 1.656 13.613 21.676 1.00 0.00 H ATOM 178 HB2 GLU A 11 1.683 14.617 23.921 1.00 0.00 H ATOM 179 HB3 GLU A 11 3.097 15.597 23.463 1.00 0.00 H ATOM 180 H GLU A 11 3.952 13.319 23.538 1.00 0.00 H ATOM 181 N LEU A 12 2.871 14.422 19.676 1.00 15.31 N ATOM 182 CA LEU A 12 3.445 14.963 18.457 1.00 14.53 C ATOM 183 C LEU A 12 2.324 15.485 17.554 1.00 12.83 C ATOM 184 O LEU A 12 1.482 14.696 17.134 1.00 13.69 O ATOM 185 CB LEU A 12 4.233 13.900 17.699 1.00 15.75 C ATOM 186 CG LEU A 12 5.446 13.291 18.426 1.00 16.48 C ATOM 187 CD1 LEU A 12 5.831 11.994 17.742 1.00 16.99 C ATOM 188 CD2 LEU A 12 6.574 14.303 18.423 1.00 17.21 C ATOM 189 HA LEU A 12 4.123 15.772 18.731 1.00 0.00 H ATOM 190 HB2 LEU A 12 3.547 13.087 17.461 1.00 0.00 H ATOM 191 HB3 LEU A 12 4.594 14.352 16.775 1.00 0.00 H ATOM 192 HG LEU A 12 5.210 13.058 19.464 1.00 0.00 H ATOM 193 HD21 LEU A 12 6.841 14.544 17.394 1.00 0.00 H ATOM 194 HD22 LEU A 12 6.250 15.208 18.937 1.00 0.00 H ATOM 195 HD23 LEU A 12 7.439 13.882 18.936 1.00 0.00 H ATOM 196 HD11 LEU A 12 4.991 11.300 17.782 1.00 0.00 H ATOM 197 HD12 LEU A 12 6.088 12.196 16.702 1.00 0.00 H ATOM 198 HD13 LEU A 12 6.690 11.557 18.252 1.00 0.00 H ATOM 199 H LEU A 12 2.069 13.765 19.590 1.00 0.00 H ATOM 200 N ASP A 13 2.344 16.784 17.272 1.00 9.94 N ATOM 201 CA ASP A 13 1.320 17.338 16.377 1.00 9.47 C ATOM 202 C ASP A 13 1.728 17.168 14.922 1.00 8.24 C ATOM 203 O ASP A 13 2.822 16.625 14.621 1.00 8.72 O ATOM 204 CB ASP A 13 0.967 18.772 16.762 1.00 10.30 C ATOM 205 CG ASP A 13 2.053 19.789 16.556 1.00 11.42 C ATOM 206 OD1 ASP A 13 2.938 19.561 15.691 1.00 10.67 O ATOM 207 OD2 ASP A 13 2.090 20.837 17.242 1.00 12.97 O ATOM 208 HA ASP A 13 0.397 16.771 16.497 1.00 0.00 H ATOM 209 HB2 ASP A 13 0.106 19.076 16.167 1.00 0.00 H ATOM 210 HB3 ASP A 13 0.698 18.779 17.818 1.00 0.00 H ATOM 211 H ASP A 13 3.076 17.400 17.680 1.00 0.00 H ATOM 212 N GLU A 14 0.903 17.568 13.964 1.00 8.33 N ATOM 213 CA GLU A 14 1.232 17.350 12.556 1.00 8.86 C ATOM 214 C GLU A 14 2.455 18.111 12.091 1.00 8.07 C ATOM 215 O GLU A 14 3.253 17.579 11.304 1.00 8.90 O ATOM 216 CB GLU A 14 0.010 17.655 11.687 1.00 10.84 C ATOM 217 CG GLU A 14 -1.181 16.745 11.993 1.00 14.23 C ATOM 218 CD GLU A 14 -0.789 15.277 11.906 1.00 16.46 C ATOM 219 OE1 GLU A 14 -0.271 14.941 10.815 1.00 18.97 O ATOM 220 OE2 GLU A 14 -0.948 14.532 12.889 1.00 17.75 O ATOM 221 HA GLU A 14 1.498 16.299 12.448 1.00 0.00 H ATOM 222 HB2 GLU A 14 -0.289 18.689 11.858 1.00 0.00 H ATOM 223 HB3 GLU A 14 0.286 17.526 10.640 1.00 0.00 H ATOM 224 HG2 GLU A 14 -1.542 16.958 12.999 1.00 0.00 H ATOM 225 HG3 GLU A 14 -1.975 16.944 11.274 1.00 0.00 H ATOM 226 H GLU A 14 0.012 18.042 14.217 1.00 0.00 H ATOM 227 N GLN A 15 2.689 19.323 12.587 1.00 8.32 N ATOM 228 CA GLN A 15 3.888 20.068 12.211 1.00 8.93 C ATOM 229 C GLN A 15 5.119 19.322 12.718 1.00 7.40 C ATOM 230 O GLN A 15 6.122 19.239 11.998 1.00 7.95 O ATOM 231 CB GLN A 15 3.845 21.472 12.817 1.00 10.90 C ATOM 232 CG GLN A 15 5.028 22.349 12.442 1.00 15.71 C ATOM 233 CD GLN A 15 4.837 23.798 12.833 1.00 19.31 C ATOM 234 OE1 GLN A 15 4.056 24.087 13.743 1.00 20.95 O ATOM 235 NE2 GLN A 15 5.544 24.701 12.160 1.00 21.52 N ATOM 236 HA GLN A 15 3.935 20.157 11.126 1.00 0.00 H ATOM 237 HB2 GLN A 15 2.933 21.964 12.477 1.00 0.00 H ATOM 238 HB3 GLN A 15 3.821 21.376 13.902 1.00 0.00 H ATOM 239 HG2 GLN A 15 5.917 21.968 12.945 1.00 0.00 H ATOM 240 HG3 GLN A 15 5.172 22.296 11.363 1.00 0.00 H ATOM 241 HE22 GLN A 15 6.188 24.398 11.402 1.00 0.00 H ATOM 242 HE21 GLN A 15 5.453 25.711 12.392 1.00 0.00 H ATOM 243 H GLN A 15 2.009 19.746 13.251 1.00 0.00 H ATOM 244 N GLN A 16 5.060 18.802 13.932 1.00 6.81 N ATOM 245 CA GLN A 16 6.185 18.040 14.485 1.00 6.63 C ATOM 246 C GLN A 16 6.433 16.764 13.699 1.00 6.11 C ATOM 247 O GLN A 16 7.605 16.407 13.474 1.00 5.97 O ATOM 248 CB GLN A 16 5.939 17.733 15.967 1.00 7.67 C ATOM 249 CG GLN A 16 5.962 19.018 16.797 1.00 10.12 C ATOM 250 CD GLN A 16 5.507 18.770 18.223 1.00 12.00 C ATOM 251 OE1 GLN A 16 4.493 18.120 18.452 1.00 11.57 O ATOM 252 NE2 GLN A 16 6.240 19.300 19.196 1.00 15.31 N ATOM 253 HA GLN A 16 7.083 18.652 14.400 1.00 0.00 H ATOM 254 HB2 GLN A 16 4.966 17.253 16.077 1.00 0.00 H ATOM 255 HB3 GLN A 16 6.717 17.060 16.327 1.00 0.00 H ATOM 256 HG2 GLN A 16 6.979 19.411 16.813 1.00 0.00 H ATOM 257 HG3 GLN A 16 5.298 19.749 16.336 1.00 0.00 H ATOM 258 HE22 GLN A 16 7.095 19.846 18.965 1.00 0.00 H ATOM 259 HE21 GLN A 16 5.959 19.169 20.189 1.00 0.00 H ATOM 260 H GLN A 16 4.202 18.935 14.504 1.00 0.00 H ATOM 261 N LYS A 17 5.405 16.035 13.301 1.00 5.76 N ATOM 262 CA LYS A 17 5.572 14.836 12.494 1.00 6.70 C ATOM 263 C LYS A 17 6.144 15.176 11.131 1.00 5.75 C ATOM 264 O LYS A 17 7.046 14.474 10.648 1.00 5.57 O ATOM 265 CB LYS A 17 4.240 14.108 12.362 1.00 8.18 C ATOM 266 CG LYS A 17 3.781 13.469 13.653 1.00 10.52 C ATOM 267 CD LYS A 17 2.302 13.219 13.675 1.00 14.48 C ATOM 268 CE LYS A 17 1.781 11.986 13.011 1.00 16.94 C ATOM 269 NZ LYS A 17 0.309 11.845 13.299 1.00 18.43 N ATOM 270 HA LYS A 17 6.281 14.175 12.993 1.00 0.00 H ATOM 271 HB2 LYS A 17 3.484 14.824 12.041 1.00 0.00 H ATOM 272 HB3 LYS A 17 4.344 13.329 11.607 1.00 0.00 H ATOM 273 HG2 LYS A 17 4.299 12.518 13.776 1.00 0.00 H ATOM 274 HG3 LYS A 17 4.037 14.130 14.481 1.00 0.00 H ATOM 275 HD2 LYS A 17 1.997 13.176 14.721 1.00 0.00 H ATOM 276 HD3 LYS A 17 1.823 14.072 13.194 1.00 0.00 H ATOM 277 HE2 LYS A 17 2.312 11.115 13.394 1.00 0.00 H ATOM 278 HE3 LYS A 17 1.936 12.060 11.935 1.00 0.00 H ATOM 279 HZ1 LYS A 17 0.163 11.774 14.326 1.00 0.00 H ATOM 280 HZ2 LYS A 17 -0.196 12.677 12.932 1.00 0.00 H ATOM 281 HZ3 LYS A 17 -0.053 10.987 12.837 1.00 0.00 H ATOM 282 H LYS A 17 4.445 16.328 13.574 1.00 0.00 H ATOM 283 N ALA A 18 5.728 16.272 10.503 1.00 6.29 N ATOM 284 CA ALA A 18 6.290 16.662 9.221 1.00 5.99 C ATOM 285 C ALA A 18 7.765 17.048 9.343 1.00 5.30 C ATOM 286 O ALA A 18 8.555 16.774 8.436 1.00 5.56 O ATOM 287 CB ALA A 18 5.495 17.812 8.612 1.00 7.48 C ATOM 288 HA ALA A 18 6.224 15.797 8.561 1.00 0.00 H ATOM 289 HB1 ALA A 18 4.461 17.499 8.464 1.00 0.00 H ATOM 290 HB2 ALA A 18 5.524 18.669 9.285 1.00 0.00 H ATOM 291 HB3 ALA A 18 5.934 18.087 7.653 1.00 0.00 H ATOM 292 H ALA A 18 4.988 16.860 10.937 1.00 0.00 H ATOM 293 N ALA A 19 8.166 17.684 10.433 1.00 5.00 N ATOM 294 CA ALA A 19 9.547 18.094 10.632 1.00 4.81 C ATOM 295 C ALA A 19 10.442 16.873 10.811 1.00 4.09 C ATOM 296 O ALA A 19 11.563 16.833 10.283 1.00 4.56 O ATOM 297 CB ALA A 19 9.686 19.022 11.829 1.00 5.37 C ATOM 298 HA ALA A 19 9.861 18.641 9.743 1.00 0.00 H ATOM 299 HB1 ALA A 19 9.080 19.914 11.668 1.00 0.00 H ATOM 300 HB2 ALA A 19 9.345 18.507 12.728 1.00 0.00 H ATOM 301 HB3 ALA A 19 10.731 19.307 11.946 1.00 0.00 H ATOM 302 H ALA A 19 7.468 17.898 11.174 1.00 0.00 H ATOM 303 N LEU A 20 9.978 15.888 11.578 1.00 3.16 N ATOM 304 CA LEU A 20 10.697 14.617 11.708 1.00 3.12 C ATOM 305 C LEU A 20 10.824 13.974 10.329 1.00 3.42 C ATOM 306 O LEU A 20 11.913 13.559 9.956 1.00 3.13 O ATOM 307 CB LEU A 20 9.926 13.716 12.674 1.00 3.25 C ATOM 308 CG LEU A 20 10.339 12.245 12.707 1.00 3.43 C ATOM 309 CD1 LEU A 20 11.789 12.041 13.093 1.00 3.36 C ATOM 310 CD2 LEU A 20 9.437 11.450 13.641 1.00 4.73 C ATOM 311 HA LEU A 20 11.700 14.775 12.105 1.00 0.00 H ATOM 312 HB2 LEU A 20 10.054 14.119 13.678 1.00 0.00 H ATOM 313 HB3 LEU A 20 8.872 13.759 12.399 1.00 0.00 H ATOM 314 HG LEU A 20 10.225 11.877 11.687 1.00 0.00 H ATOM 315 HD21 LEU A 20 9.510 11.858 14.649 1.00 0.00 H ATOM 316 HD22 LEU A 20 8.406 11.518 13.294 1.00 0.00 H ATOM 317 HD23 LEU A 20 9.752 10.406 13.647 1.00 0.00 H ATOM 318 HD11 LEU A 20 12.430 12.548 12.372 1.00 0.00 H ATOM 319 HD12 LEU A 20 11.961 12.454 14.087 1.00 0.00 H ATOM 320 HD13 LEU A 20 12.016 10.975 13.097 1.00 0.00 H ATOM 321 H LEU A 20 9.086 16.023 12.096 1.00 0.00 H ATOM 322 N ALA A 21 9.717 13.905 9.575 1.00 3.44 N ATOM 323 CA ALA A 21 9.797 13.304 8.251 1.00 2.91 C ATOM 324 C ALA A 21 10.802 14.002 7.354 1.00 3.09 C ATOM 325 O ALA A 21 11.509 13.322 6.604 1.00 3.69 O ATOM 326 CB ALA A 21 8.408 13.285 7.635 1.00 3.41 C ATOM 327 HA ALA A 21 10.161 12.282 8.355 1.00 0.00 H ATOM 328 HB1 ALA A 21 7.740 12.700 8.267 1.00 0.00 H ATOM 329 HB2 ALA A 21 8.033 14.305 7.555 1.00 0.00 H ATOM 330 HB3 ALA A 21 8.458 12.836 6.643 1.00 0.00 H ATOM 331 H ALA A 21 8.813 14.276 9.931 1.00 0.00 H ATOM 332 N ALA A 22 10.843 15.327 7.354 1.00 3.04 N ATOM 333 CA ALA A 22 11.756 16.078 6.501 1.00 2.81 C ATOM 334 C ALA A 22 13.209 15.764 6.857 1.00 3.00 C ATOM 335 O ALA A 22 14.021 15.574 5.955 1.00 2.81 O ATOM 336 CB ALA A 22 11.453 17.566 6.622 1.00 4.28 C ATOM 337 HA ALA A 22 11.611 15.781 5.462 1.00 0.00 H ATOM 338 HB1 ALA A 22 10.426 17.753 6.310 1.00 0.00 H ATOM 339 HB2 ALA A 22 11.582 17.879 7.658 1.00 0.00 H ATOM 340 HB3 ALA A 22 12.136 18.128 5.984 1.00 0.00 H ATOM 341 H ALA A 22 10.201 15.849 7.985 1.00 0.00 H ATOM 342 N ASP A 23 13.517 15.683 8.150 1.00 2.80 N ATOM 343 CA ASP A 23 14.902 15.403 8.528 1.00 2.89 C ATOM 344 C ASP A 23 15.308 13.979 8.190 1.00 3.01 C ATOM 345 O ASP A 23 16.438 13.731 7.728 1.00 2.84 O ATOM 346 CB ASP A 23 15.090 15.703 10.007 1.00 3.70 C ATOM 347 CG ASP A 23 15.242 17.165 10.337 1.00 5.41 C ATOM 348 OD1 ASP A 23 15.197 18.022 9.432 1.00 8.11 O ATOM 349 OD2 ASP A 23 15.422 17.433 11.542 1.00 7.15 O ATOM 350 HA ASP A 23 15.559 16.051 7.948 1.00 0.00 H ATOM 351 HB2 ASP A 23 14.222 15.322 10.544 1.00 0.00 H ATOM 352 HB3 ASP A 23 15.985 15.182 10.349 1.00 0.00 H ATOM 353 H ASP A 23 12.786 15.816 8.878 1.00 0.00 H ATOM 354 N ILE A 24 14.409 13.015 8.390 1.00 3.25 N ATOM 355 CA ILE A 24 14.701 11.642 7.982 1.00 2.95 C ATOM 356 C ILE A 24 14.931 11.573 6.479 1.00 3.50 C ATOM 357 O ILE A 24 15.864 10.949 5.983 1.00 2.81 O ATOM 358 CB ILE A 24 13.555 10.690 8.381 1.00 3.07 C ATOM 359 CG1 ILE A 24 13.481 10.533 9.896 1.00 2.69 C ATOM 360 CG2 ILE A 24 13.719 9.342 7.707 1.00 3.08 C ATOM 361 CD1 ILE A 24 14.602 9.738 10.555 1.00 3.55 C ATOM 362 HA ILE A 24 15.608 11.325 8.497 1.00 0.00 H ATOM 363 HB ILE A 24 12.616 11.128 8.042 1.00 0.00 H ATOM 364 HG12 ILE A 24 13.482 11.532 10.333 1.00 0.00 H ATOM 365 HG13 ILE A 24 12.540 10.036 10.132 1.00 0.00 H ATOM 366 HD11 ILE A 24 14.614 8.726 10.151 1.00 0.00 H ATOM 367 HD12 ILE A 24 15.557 10.223 10.352 1.00 0.00 H ATOM 368 HD13 ILE A 24 14.434 9.699 11.631 1.00 0.00 H ATOM 369 HG21 ILE A 24 13.707 9.474 6.625 1.00 0.00 H ATOM 370 HG22 ILE A 24 14.668 8.899 8.010 1.00 0.00 H ATOM 371 HG23 ILE A 24 12.900 8.687 8.003 1.00 0.00 H ATOM 372 H ILE A 24 13.498 13.240 8.837 1.00 0.00 H ATOM 373 N THR A 25 14.094 12.286 5.707 1.00 2.79 N ATOM 374 CA THR A 25 14.192 12.294 4.257 1.00 2.82 C ATOM 375 C THR A 25 15.559 12.798 3.823 1.00 3.13 C ATOM 376 O THR A 25 16.177 12.167 2.969 1.00 3.78 O ATOM 377 CB THR A 25 13.076 13.170 3.661 1.00 3.63 C ATOM 378 OG1 THR A 25 11.836 12.486 3.923 1.00 3.96 O ATOM 379 CG2 THR A 25 13.233 13.407 2.175 1.00 5.34 C ATOM 380 HA THR A 25 14.071 11.276 3.887 1.00 0.00 H ATOM 381 HB THR A 25 13.112 14.158 4.121 1.00 0.00 H ATOM 382 HG1 THR A 25 11.719 12.380 4.900 1.00 0.00 H ATOM 383 HG23 THR A 25 14.174 13.925 1.988 1.00 0.00 H ATOM 384 HG21 THR A 25 13.234 12.450 1.654 1.00 0.00 H ATOM 385 HG22 THR A 25 12.404 14.017 1.816 1.00 0.00 H ATOM 386 H THR A 25 13.350 12.852 6.163 1.00 0.00 H ATOM 387 N ASP A 26 16.041 13.908 4.392 1.00 2.87 N ATOM 388 CA ASP A 26 17.355 14.412 4.004 1.00 2.71 C ATOM 389 C ASP A 26 18.416 13.344 4.239 1.00 2.53 C ATOM 390 O ASP A 26 19.243 13.096 3.365 1.00 2.54 O ATOM 391 CB ASP A 26 17.711 15.708 4.734 1.00 3.05 C ATOM 392 CG ASP A 26 19.196 16.056 4.594 1.00 3.18 C ATOM 393 OD1 ASP A 26 19.553 16.547 3.509 1.00 2.72 O ATOM 394 OD2 ASP A 26 19.935 15.793 5.559 1.00 3.77 O ATOM 395 HA ASP A 26 17.321 14.648 2.940 1.00 0.00 H ATOM 396 HB2 ASP A 26 17.118 16.522 4.317 1.00 0.00 H ATOM 397 HB3 ASP A 26 17.474 15.593 5.792 1.00 0.00 H ATOM 398 H ASP A 26 15.481 14.411 5.109 1.00 0.00 H ATOM 399 N VAL A 27 18.398 12.773 5.444 1.00 2.58 N ATOM 400 CA VAL A 27 19.406 11.752 5.748 1.00 2.32 C ATOM 401 C VAL A 27 19.404 10.607 4.752 1.00 2.57 C ATOM 402 O VAL A 27 20.462 10.197 4.257 1.00 3.85 O ATOM 403 CB VAL A 27 19.199 11.245 7.191 1.00 3.02 C ATOM 404 CG1 VAL A 27 20.096 10.038 7.446 1.00 2.69 C ATOM 405 CG2 VAL A 27 19.499 12.364 8.168 1.00 2.55 C ATOM 406 HA VAL A 27 20.389 12.214 5.663 1.00 0.00 H ATOM 407 HB VAL A 27 18.163 10.935 7.330 1.00 0.00 H ATOM 408 HG11 VAL A 27 19.843 9.244 6.744 1.00 0.00 H ATOM 409 HG12 VAL A 27 21.138 10.326 7.310 1.00 0.00 H ATOM 410 HG13 VAL A 27 19.946 9.684 8.466 1.00 0.00 H ATOM 411 HG21 VAL A 27 20.532 12.688 8.041 1.00 0.00 H ATOM 412 HG22 VAL A 27 18.828 13.201 7.977 1.00 0.00 H ATOM 413 HG23 VAL A 27 19.352 12.004 9.186 1.00 0.00 H ATOM 414 H VAL A 27 17.686 13.045 6.151 1.00 0.00 H ATOM 415 N ILE A 28 18.215 10.112 4.422 1.00 2.30 N ATOM 416 CA ILE A 28 18.102 9.013 3.466 1.00 2.68 C ATOM 417 C ILE A 28 18.583 9.421 2.083 1.00 3.07 C ATOM 418 O ILE A 28 19.270 8.653 1.405 1.00 2.66 O ATOM 419 CB ILE A 28 16.657 8.486 3.478 1.00 2.68 C ATOM 420 CG1 ILE A 28 16.350 7.887 4.848 1.00 3.38 C ATOM 421 CG2 ILE A 28 16.431 7.476 2.361 1.00 3.54 C ATOM 422 CD1 ILE A 28 17.091 6.647 5.266 1.00 4.36 C ATOM 423 HA ILE A 28 18.759 8.196 3.764 1.00 0.00 H ATOM 424 HB ILE A 28 15.972 9.314 3.297 1.00 0.00 H ATOM 425 HG12 ILE A 28 16.561 8.656 5.591 1.00 0.00 H ATOM 426 HG13 ILE A 28 15.286 7.649 4.866 1.00 0.00 H ATOM 427 HD11 ILE A 28 16.885 5.846 4.556 1.00 0.00 H ATOM 428 HD12 ILE A 28 18.161 6.853 5.283 1.00 0.00 H ATOM 429 HD13 ILE A 28 16.762 6.347 6.261 1.00 0.00 H ATOM 430 HG21 ILE A 28 16.621 7.952 1.399 1.00 0.00 H ATOM 431 HG22 ILE A 28 17.110 6.634 2.492 1.00 0.00 H ATOM 432 HG23 ILE A 28 15.401 7.122 2.396 1.00 0.00 H ATOM 433 H ILE A 28 17.355 10.512 4.849 1.00 0.00 H ATOM 434 N ILE A 29 18.242 10.605 1.598 1.00 2.88 N ATOM 435 CA ILE A 29 18.722 11.069 0.301 1.00 2.84 C ATOM 436 C ILE A 29 20.243 11.053 0.298 1.00 2.72 C ATOM 437 O ILE A 29 20.855 10.551 -0.642 1.00 2.94 O ATOM 438 CB ILE A 29 18.187 12.474 -0.009 1.00 3.13 C ATOM 439 CG1 ILE A 29 16.675 12.416 -0.279 1.00 3.27 C ATOM 440 CG2 ILE A 29 18.915 13.147 -1.158 1.00 3.68 C ATOM 441 CD1 ILE A 29 16.024 13.772 -0.462 1.00 3.79 C ATOM 442 HA ILE A 29 18.355 10.401 -0.479 1.00 0.00 H ATOM 443 HB ILE A 29 18.374 13.088 0.872 1.00 0.00 H ATOM 444 HG12 ILE A 29 16.511 11.833 -1.185 1.00 0.00 H ATOM 445 HG13 ILE A 29 16.196 11.917 0.564 1.00 0.00 H ATOM 446 HD11 ILE A 29 16.166 14.366 0.441 1.00 0.00 H ATOM 447 HD12 ILE A 29 16.482 14.282 -1.310 1.00 0.00 H ATOM 448 HD13 ILE A 29 14.958 13.640 -0.648 1.00 0.00 H ATOM 449 HG21 ILE A 29 19.972 13.242 -0.911 1.00 0.00 H ATOM 450 HG22 ILE A 29 18.804 12.544 -2.059 1.00 0.00 H ATOM 451 HG23 ILE A 29 18.489 14.136 -1.326 1.00 0.00 H ATOM 452 H ILE A 29 17.616 11.220 2.156 1.00 0.00 H ATOM 453 N ARG A 30 20.873 11.611 1.358 1.00 3.06 N ATOM 454 CA ARG A 30 22.317 11.743 1.355 1.00 3.13 C ATOM 455 C ARG A 30 23.063 10.437 1.542 1.00 3.33 C ATOM 456 O ARG A 30 24.149 10.289 0.966 1.00 5.57 O ATOM 457 CB ARG A 30 22.813 12.759 2.384 1.00 2.94 C ATOM 458 CG ARG A 30 22.352 14.195 2.138 1.00 2.60 C ATOM 459 CD ARG A 30 22.939 15.173 3.130 1.00 2.87 C ATOM 460 NE ARG A 30 22.529 14.927 4.507 1.00 2.58 N ATOM 461 CZ ARG A 30 23.186 14.259 5.446 1.00 3.48 C ATOM 462 NH1 ARG A 30 24.384 13.752 5.241 1.00 3.11 N ATOM 463 NH2 ARG A 30 22.579 14.157 6.635 1.00 3.81 N ATOM 464 HA ARG A 30 22.542 12.105 0.352 1.00 0.00 H ATOM 465 HB2 ARG A 30 22.454 12.451 3.366 1.00 0.00 H ATOM 466 HB3 ARG A 30 23.903 12.746 2.376 1.00 0.00 H ATOM 467 HG2 ARG A 30 22.655 14.492 1.134 1.00 0.00 H ATOM 468 HG3 ARG A 30 21.265 14.231 2.214 1.00 0.00 H ATOM 469 HD2 ARG A 30 22.623 16.178 2.851 1.00 0.00 H ATOM 470 HD3 ARG A 30 24.026 15.107 3.077 1.00 0.00 H ATOM 471 HE ARG A 30 21.609 15.324 4.787 1.00 0.00 H ATOM 472 HH12 ARG A 30 24.867 13.234 6.003 1.00 0.00 H ATOM 473 HH11 ARG A 30 24.847 13.869 4.317 1.00 0.00 H ATOM 474 HH22 ARG A 30 23.042 13.645 7.413 1.00 0.00 H ATOM 475 HH21 ARG A 30 21.644 14.589 6.780 1.00 0.00 H ATOM 476 H ARG A 30 20.322 11.945 2.174 1.00 0.00 H ATOM 477 N HIS A 31 22.513 9.484 2.290 1.00 2.98 N ATOM 478 CA HIS A 31 23.219 8.229 2.548 1.00 3.43 C ATOM 479 C HIS A 31 22.882 7.124 1.585 1.00 3.56 C ATOM 480 O HIS A 31 23.714 6.243 1.382 1.00 5.26 O ATOM 481 CB HIS A 31 22.918 7.784 3.992 1.00 2.66 C ATOM 482 CG HIS A 31 23.627 8.645 4.988 1.00 2.62 C ATOM 483 ND1 HIS A 31 24.893 8.324 5.432 1.00 2.79 N ATOM 484 CD2 HIS A 31 23.275 9.800 5.592 1.00 2.83 C ATOM 485 CE1 HIS A 31 25.276 9.262 6.276 1.00 2.48 C ATOM 486 NE2 HIS A 31 24.329 10.166 6.395 1.00 2.64 N ATOM 487 HA HIS A 31 24.282 8.424 2.406 1.00 0.00 H ATOM 488 HB2 HIS A 31 21.844 7.850 4.167 1.00 0.00 H ATOM 489 HB3 HIS A 31 23.243 6.752 4.120 1.00 0.00 H ATOM 490 HD2 HIS A 31 22.336 10.339 5.467 1.00 0.00 H ATOM 491 HE1 HIS A 31 26.233 9.284 6.797 1.00 0.00 H ATOM 492 H HIS A 31 21.568 9.633 2.697 1.00 0.00 H ATOM 493 N LEU A 32 21.657 7.101 1.050 1.00 3.28 N ATOM 494 CA LEU A 32 21.279 5.990 0.152 1.00 3.88 C ATOM 495 C LEU A 32 21.183 6.433 -1.287 1.00 4.99 C ATOM 496 O LEU A 32 20.694 5.706 -2.147 1.00 6.05 O ATOM 497 CB LEU A 32 19.976 5.349 0.644 1.00 5.05 C ATOM 498 CG LEU A 32 20.037 4.721 2.044 1.00 5.46 C ATOM 499 CD1 LEU A 32 18.743 4.006 2.382 1.00 5.84 C ATOM 500 CD2 LEU A 32 21.210 3.754 2.156 1.00 6.87 C ATOM 501 HA LEU A 32 22.067 5.238 0.182 1.00 0.00 H ATOM 502 HB2 LEU A 32 19.205 6.120 0.654 1.00 0.00 H ATOM 503 HB3 LEU A 32 19.698 4.568 -0.063 1.00 0.00 H ATOM 504 HG LEU A 32 20.180 5.531 2.759 1.00 0.00 H ATOM 505 HD21 LEU A 32 21.095 2.959 1.419 1.00 0.00 H ATOM 506 HD22 LEU A 32 22.141 4.291 1.971 1.00 0.00 H ATOM 507 HD23 LEU A 32 21.230 3.323 3.157 1.00 0.00 H ATOM 508 HD11 LEU A 32 17.918 4.718 2.356 1.00 0.00 H ATOM 509 HD12 LEU A 32 18.565 3.215 1.653 1.00 0.00 H ATOM 510 HD13 LEU A 32 18.819 3.573 3.379 1.00 0.00 H ATOM 511 H LEU A 32 20.977 7.858 1.264 1.00 0.00 H ATOM 512 N ASN A 33 21.617 7.648 -1.604 1.00 4.23 N ATOM 513 CA ASN A 33 21.576 8.202 -2.953 1.00 4.63 C ATOM 514 C ASN A 33 20.147 8.106 -3.473 1.00 4.54 C ATOM 515 O ASN A 33 19.880 7.668 -4.591 1.00 7.16 O ATOM 516 CB ASN A 33 22.581 7.504 -3.904 1.00 8.15 C ATOM 517 CG ASN A 33 23.156 8.696 -4.690 1.00 12.37 C ATOM 518 OD1 ASN A 33 22.590 9.044 -5.704 1.00 14.26 O ATOM 519 ND2 ASN A 33 24.163 9.327 -4.092 1.00 12.16 N ATOM 520 HA ASN A 33 21.882 9.248 -2.918 1.00 0.00 H ATOM 521 HB2 ASN A 33 23.360 6.984 -3.346 1.00 0.00 H ATOM 522 HB3 ASN A 33 22.077 6.799 -4.565 1.00 0.00 H ATOM 523 HD22 ASN A 33 24.577 8.938 -3.221 1.00 0.00 H ATOM 524 HD21 ASN A 33 24.537 10.210 -4.496 1.00 0.00 H ATOM 525 H ASN A 33 22.010 8.240 -0.844 1.00 0.00 H ATOM 526 N SER A 34 19.232 8.587 -2.647 1.00 4.10 N ATOM 527 CA SER A 34 17.818 8.441 -2.905 1.00 3.93 C ATOM 528 C SER A 34 17.187 9.753 -3.301 1.00 4.69 C ATOM 529 O SER A 34 17.839 10.786 -3.458 1.00 5.19 O ATOM 530 CB SER A 34 17.194 7.784 -1.666 1.00 4.05 C ATOM 531 OG SER A 34 15.871 7.403 -1.959 1.00 3.10 O ATOM 532 HA SER A 34 17.635 7.796 -3.765 1.00 0.00 H ATOM 533 HB2 SER A 34 17.194 8.493 -0.838 1.00 0.00 H ATOM 534 HB3 SER A 34 17.774 6.904 -1.389 1.00 0.00 H ATOM 535 HG SER A 34 15.873 6.759 -2.711 1.00 0.00 H ATOM 536 H SER A 34 19.540 9.085 -1.787 1.00 0.00 H ATOM 537 N LYS A 35 15.899 9.695 -3.563 1.00 7.22 N ATOM 538 CA LYS A 35 15.162 10.865 -4.015 1.00 7.77 C ATOM 539 C LYS A 35 13.970 11.029 -3.096 1.00 6.79 C ATOM 540 O LYS A 35 13.479 10.074 -2.503 1.00 5.92 O ATOM 541 CB LYS A 35 14.677 10.708 -5.452 1.00 9.84 C ATOM 542 CG LYS A 35 15.788 10.660 -6.487 1.00 11.59 C ATOM 543 CD LYS A 35 15.213 10.577 -7.894 1.00 13.31 C ATOM 544 CE LYS A 35 14.521 9.250 -8.125 1.00 14.72 C ATOM 545 NZ LYS A 35 15.413 8.114 -7.756 1.00 15.83 N ATOM 546 HA LYS A 35 15.816 11.737 -3.988 1.00 0.00 H ATOM 547 HB2 LYS A 35 14.107 9.782 -5.520 1.00 0.00 H ATOM 548 HB3 LYS A 35 14.028 11.551 -5.687 1.00 0.00 H ATOM 549 HG2 LYS A 35 16.396 11.561 -6.402 1.00 0.00 H ATOM 550 HG3 LYS A 35 16.411 9.785 -6.303 1.00 0.00 H ATOM 551 HD2 LYS A 35 14.492 11.383 -8.032 1.00 0.00 H ATOM 552 HD3 LYS A 35 16.022 10.687 -8.616 1.00 0.00 H ATOM 553 HE2 LYS A 35 14.252 9.166 -9.178 1.00 0.00 H ATOM 554 HE3 LYS A 35 13.618 9.207 -7.516 1.00 0.00 H ATOM 555 HZ1 LYS A 35 16.275 8.148 -8.337 1.00 0.00 H ATOM 556 HZ2 LYS A 35 15.669 8.188 -6.751 1.00 0.00 H ATOM 557 HZ3 LYS A 35 14.916 7.216 -7.923 1.00 0.00 H ATOM 558 H LYS A 35 15.396 8.792 -3.444 1.00 0.00 H ATOM 559 N ASP A 36 13.478 12.255 -3.053 1.00 6.26 N ATOM 560 CA ASP A 36 12.325 12.533 -2.220 1.00 5.28 C ATOM 561 C ASP A 36 11.156 11.630 -2.582 1.00 3.81 C ATOM 562 O ASP A 36 10.507 11.039 -1.703 1.00 3.71 O ATOM 563 CB ASP A 36 11.941 14.004 -2.370 1.00 5.58 C ATOM 564 CG ASP A 36 10.854 14.340 -1.377 1.00 7.39 C ATOM 565 OD1 ASP A 36 9.677 14.088 -1.658 1.00 10.90 O ATOM 566 OD2 ASP A 36 11.145 14.834 -0.292 1.00 10.82 O ATOM 567 HA ASP A 36 12.581 12.331 -1.180 1.00 0.00 H ATOM 568 HB2 ASP A 36 12.813 14.629 -2.181 1.00 0.00 H ATOM 569 HB3 ASP A 36 11.579 14.185 -3.382 1.00 0.00 H ATOM 570 H ASP A 36 13.915 13.015 -3.613 1.00 0.00 H ATOM 571 N SER A 37 10.881 11.470 -3.880 1.00 3.17 N ATOM 572 CA SER A 37 9.761 10.677 -4.372 1.00 3.49 C ATOM 573 C SER A 37 9.786 9.209 -4.010 1.00 3.25 C ATOM 574 O SER A 37 8.722 8.574 -3.951 1.00 3.66 O ATOM 575 CB SER A 37 9.618 10.844 -5.895 1.00 3.86 C ATOM 576 OG SER A 37 10.826 10.469 -6.533 1.00 5.31 O ATOM 577 HA SER A 37 8.890 11.078 -3.853 1.00 0.00 H ATOM 578 HB2 SER A 37 9.394 11.885 -6.126 1.00 0.00 H ATOM 579 HB3 SER A 37 8.807 10.211 -6.254 1.00 0.00 H ATOM 580 HG SER A 37 10.728 10.578 -7.512 1.00 0.00 H ATOM 581 H SER A 37 11.498 11.936 -4.576 1.00 0.00 H ATOM 582 N SER A 38 10.945 8.652 -3.702 1.00 3.08 N ATOM 583 CA SER A 38 11.095 7.250 -3.381 1.00 3.33 C ATOM 584 C SER A 38 10.926 6.944 -1.897 1.00 2.61 C ATOM 585 O SER A 38 10.963 5.770 -1.535 1.00 2.57 O ATOM 586 CB SER A 38 12.528 6.792 -3.718 1.00 4.16 C ATOM 587 OG SER A 38 12.813 6.967 -5.093 1.00 6.86 O ATOM 588 HA SER A 38 10.322 6.740 -3.957 1.00 0.00 H ATOM 589 HB2 SER A 38 12.633 5.737 -3.465 1.00 0.00 H ATOM 590 HB3 SER A 38 13.236 7.377 -3.131 1.00 0.00 H ATOM 591 HG SER A 38 12.176 6.433 -5.631 1.00 0.00 H ATOM 592 H SER A 38 11.793 9.254 -3.690 1.00 0.00 H ATOM 593 N ILE A 39 10.810 7.988 -1.083 1.00 2.53 N ATOM 594 CA ILE A 39 10.807 7.777 0.366 1.00 2.61 C ATOM 595 C ILE A 39 9.439 7.849 1.009 1.00 2.48 C ATOM 596 O ILE A 39 8.649 8.777 0.832 1.00 3.34 O ATOM 597 CB ILE A 39 11.763 8.827 0.995 1.00 2.55 C ATOM 598 CG1 ILE A 39 13.200 8.628 0.479 1.00 2.69 C ATOM 599 CG2 ILE A 39 11.741 8.762 2.519 1.00 3.79 C ATOM 600 CD1 ILE A 39 14.119 9.827 0.680 1.00 3.04 C ATOM 601 HA ILE A 39 11.144 6.757 0.554 1.00 0.00 H ATOM 602 HB ILE A 39 11.410 9.813 0.694 1.00 0.00 H ATOM 603 HG12 ILE A 39 13.634 7.775 1.001 1.00 0.00 H ATOM 604 HG13 ILE A 39 13.151 8.412 -0.588 1.00 0.00 H ATOM 605 HD11 ILE A 39 13.710 10.689 0.153 1.00 0.00 H ATOM 606 HD12 ILE A 39 14.193 10.052 1.744 1.00 0.00 H ATOM 607 HD13 ILE A 39 15.109 9.595 0.287 1.00 0.00 H ATOM 608 HG21 ILE A 39 10.730 8.958 2.875 1.00 0.00 H ATOM 609 HG22 ILE A 39 12.056 7.770 2.844 1.00 0.00 H ATOM 610 HG23 ILE A 39 12.422 9.511 2.923 1.00 0.00 H ATOM 611 H ILE A 39 10.722 8.948 -1.472 1.00 0.00 H ATOM 612 N SER A 40 9.120 6.814 1.799 1.00 2.71 N ATOM 613 CA SER A 40 7.902 6.778 2.598 1.00 2.63 C ATOM 614 C SER A 40 8.287 6.512 4.042 1.00 2.82 C ATOM 615 O SER A 40 9.307 5.842 4.309 1.00 2.50 O ATOM 616 CB SER A 40 6.904 5.780 2.051 1.00 3.18 C ATOM 617 OG SER A 40 7.498 4.486 1.976 1.00 3.27 O ATOM 618 HA SER A 40 7.391 7.740 2.549 1.00 0.00 H ATOM 619 HB2 SER A 40 6.591 6.092 1.055 1.00 0.00 H ATOM 620 HB3 SER A 40 6.035 5.741 2.708 1.00 0.00 H ATOM 621 HG SER A 40 7.781 4.201 2.881 1.00 0.00 H ATOM 622 H SER A 40 9.769 6.003 1.843 1.00 0.00 H ATOM 623 N ILE A 41 7.560 7.106 4.986 1.00 2.30 N ATOM 624 CA ILE A 41 7.903 7.014 6.406 1.00 2.87 C ATOM 625 C ILE A 41 6.655 6.818 7.256 1.00 2.60 C ATOM 626 O ILE A 41 5.709 7.591 7.128 1.00 2.54 O ATOM 627 CB ILE A 41 8.646 8.271 6.913 1.00 2.48 C ATOM 628 CG1 ILE A 41 9.883 8.612 6.055 1.00 2.71 C ATOM 629 CG2 ILE A 41 9.081 8.076 8.369 1.00 2.86 C ATOM 630 CD1 ILE A 41 10.436 10.005 6.308 1.00 2.68 C ATOM 631 HA ILE A 41 8.564 6.153 6.503 1.00 0.00 H ATOM 632 HB ILE A 41 7.947 9.103 6.836 1.00 0.00 H ATOM 633 HG12 ILE A 41 10.665 7.886 6.274 1.00 0.00 H ATOM 634 HG13 ILE A 41 9.604 8.538 5.004 1.00 0.00 H ATOM 635 HD11 ILE A 41 9.669 10.746 6.082 1.00 0.00 H ATOM 636 HD12 ILE A 41 10.731 10.093 7.354 1.00 0.00 H ATOM 637 HD13 ILE A 41 11.303 10.172 5.669 1.00 0.00 H ATOM 638 HG21 ILE A 41 8.202 7.906 8.990 1.00 0.00 H ATOM 639 HG22 ILE A 41 9.747 7.216 8.436 1.00 0.00 H ATOM 640 HG23 ILE A 41 9.603 8.969 8.714 1.00 0.00 H ATOM 641 H ILE A 41 6.721 7.653 4.705 1.00 0.00 H ATOM 642 N ALA A 42 6.682 5.781 8.088 1.00 2.85 N ATOM 643 CA ALA A 42 5.640 5.459 9.054 1.00 3.00 C ATOM 644 C ALA A 42 6.150 5.742 10.467 1.00 2.83 C ATOM 645 O ALA A 42 7.313 5.503 10.763 1.00 3.78 O ATOM 646 CB ALA A 42 5.222 4.003 8.981 1.00 2.82 C ATOM 647 HA ALA A 42 4.775 6.078 8.816 1.00 0.00 H ATOM 648 HB1 ALA A 42 4.839 3.786 7.984 1.00 0.00 H ATOM 649 HB2 ALA A 42 6.084 3.368 9.187 1.00 0.00 H ATOM 650 HB3 ALA A 42 4.444 3.812 9.720 1.00 0.00 H ATOM 651 H ALA A 42 7.509 5.152 8.046 1.00 0.00 H ATOM 652 N LEU A 43 5.264 6.215 11.327 1.00 3.21 N ATOM 653 CA LEU A 43 5.538 6.451 12.744 1.00 4.09 C ATOM 654 C LEU A 43 4.467 5.729 13.551 1.00 4.48 C ATOM 655 O LEU A 43 3.292 5.999 13.384 1.00 6.01 O ATOM 656 CB LEU A 43 5.618 7.922 13.084 1.00 4.95 C ATOM 657 CG LEU A 43 5.800 8.311 14.550 1.00 5.42 C ATOM 658 CD1 LEU A 43 7.157 7.898 15.054 1.00 5.73 C ATOM 659 CD2 LEU A 43 5.562 9.808 14.766 1.00 8.34 C ATOM 660 HA LEU A 43 6.522 6.055 12.996 1.00 0.00 H ATOM 661 HB2 LEU A 43 6.461 8.337 12.531 1.00 0.00 H ATOM 662 HB3 LEU A 43 4.694 8.386 12.738 1.00 0.00 H ATOM 663 HG LEU A 43 5.049 7.774 15.129 1.00 0.00 H ATOM 664 HD21 LEU A 43 6.272 10.378 14.166 1.00 0.00 H ATOM 665 HD22 LEU A 43 4.545 10.060 14.465 1.00 0.00 H ATOM 666 HD23 LEU A 43 5.700 10.048 15.820 1.00 0.00 H ATOM 667 HD11 LEU A 43 7.263 6.817 14.963 1.00 0.00 H ATOM 668 HD12 LEU A 43 7.928 8.391 14.463 1.00 0.00 H ATOM 669 HD13 LEU A 43 7.258 8.188 16.100 1.00 0.00 H ATOM 670 H LEU A 43 4.311 6.433 10.973 1.00 0.00 H ATOM 671 N GLN A 44 4.879 4.716 14.312 1.00 3.84 N ATOM 672 CA GLN A 44 3.947 3.914 15.105 1.00 4.84 C ATOM 673 C GLN A 44 4.312 4.029 16.583 1.00 4.09 C ATOM 674 O GLN A 44 5.435 3.689 16.971 1.00 4.64 O ATOM 675 CB GLN A 44 3.980 2.461 14.629 1.00 7.87 C ATOM 676 CG GLN A 44 3.833 2.281 13.124 1.00 11.93 C ATOM 677 CD GLN A 44 3.597 0.870 12.671 1.00 14.78 C ATOM 678 OE1 GLN A 44 4.324 0.263 11.876 1.00 15.01 O ATOM 679 NE2 GLN A 44 2.510 0.284 13.172 1.00 16.36 N ATOM 680 HA GLN A 44 2.930 4.284 14.975 1.00 0.00 H ATOM 681 HB2 GLN A 44 4.932 2.026 14.932 1.00 0.00 H ATOM 682 HB3 GLN A 44 3.166 1.925 15.116 1.00 0.00 H ATOM 683 HG2 GLN A 44 2.991 2.888 12.792 1.00 0.00 H ATOM 684 HG3 GLN A 44 4.747 2.640 12.650 1.00 0.00 H ATOM 685 HE22 GLN A 44 1.902 0.800 13.840 1.00 0.00 H ATOM 686 HE21 GLN A 44 2.269 -0.689 12.895 1.00 0.00 H ATOM 687 H GLN A 44 5.893 4.489 14.343 1.00 0.00 H ATOM 688 N GLN A 45 3.397 4.505 17.395 1.00 4.42 N ATOM 689 CA GLN A 45 3.594 4.658 18.832 1.00 5.26 C ATOM 690 C GLN A 45 3.125 3.378 19.514 1.00 5.30 C ATOM 691 O GLN A 45 2.010 2.893 19.281 1.00 7.33 O ATOM 692 CB GLN A 45 2.830 5.879 19.349 1.00 6.69 C ATOM 693 CG GLN A 45 3.357 7.157 18.703 1.00 9.24 C ATOM 694 CD GLN A 45 2.834 8.433 19.305 1.00 12.61 C ATOM 695 OE1 GLN A 45 2.563 8.538 20.499 1.00 13.21 O ATOM 696 NE2 GLN A 45 2.689 9.436 18.436 1.00 14.61 N ATOM 697 HA GLN A 45 4.648 4.822 19.056 1.00 0.00 H ATOM 698 HB2 GLN A 45 1.772 5.767 19.111 1.00 0.00 H ATOM 699 HB3 GLN A 45 2.953 5.947 20.430 1.00 0.00 H ATOM 700 HG2 GLN A 45 4.443 7.160 18.794 1.00 0.00 H ATOM 701 HG3 GLN A 45 3.082 7.142 17.648 1.00 0.00 H ATOM 702 HE22 GLN A 45 2.933 9.296 17.435 1.00 0.00 H ATOM 703 HE21 GLN A 45 2.332 10.358 18.760 1.00 0.00 H ATOM 704 H GLN A 45 2.481 4.789 16.992 1.00 0.00 H ATOM 705 N ILE A 46 4.008 2.798 20.320 1.00 4.48 N ATOM 706 CA ILE A 46 3.789 1.499 20.945 1.00 4.47 C ATOM 707 C ILE A 46 3.842 1.687 22.458 1.00 4.49 C ATOM 708 O ILE A 46 4.814 2.252 22.984 1.00 5.33 O ATOM 709 CB ILE A 46 4.947 0.534 20.565 1.00 5.79 C ATOM 710 CG1 ILE A 46 5.200 0.428 19.066 1.00 8.15 C ATOM 711 CG2 ILE A 46 4.731 -0.834 21.207 1.00 5.94 C ATOM 712 CD1 ILE A 46 4.040 -0.120 18.285 1.00 9.87 C ATOM 713 HA ILE A 46 2.832 1.094 20.617 1.00 0.00 H ATOM 714 HB ILE A 46 5.860 0.971 20.969 1.00 0.00 H ATOM 715 HG12 ILE A 46 5.429 1.424 18.686 1.00 0.00 H ATOM 716 HG13 ILE A 46 6.058 -0.226 18.909 1.00 0.00 H ATOM 717 HD11 ILE A 46 3.804 -1.122 18.643 1.00 0.00 H ATOM 718 HD12 ILE A 46 3.174 0.528 18.420 1.00 0.00 H ATOM 719 HD13 ILE A 46 4.303 -0.163 17.228 1.00 0.00 H ATOM 720 HG21 ILE A 46 4.700 -0.724 22.291 1.00 0.00 H ATOM 721 HG22 ILE A 46 3.788 -1.254 20.856 1.00 0.00 H ATOM 722 HG23 ILE A 46 5.551 -1.497 20.931 1.00 0.00 H ATOM 723 H ILE A 46 4.900 3.296 20.515 1.00 0.00 H ATOM 724 N GLN A 47 2.781 1.290 23.160 1.00 4.90 N ATOM 725 CA GLN A 47 2.784 1.403 24.623 1.00 5.95 C ATOM 726 C GLN A 47 3.906 0.548 25.173 1.00 5.34 C ATOM 727 O GLN A 47 4.244 -0.503 24.620 1.00 4.62 O ATOM 728 CB GLN A 47 1.427 0.943 25.163 1.00 8.49 C ATOM 729 CG GLN A 47 0.257 1.743 24.629 1.00 12.61 C ATOM 730 CD GLN A 47 0.193 3.145 25.163 1.00 15.52 C ATOM 731 OE1 GLN A 47 0.620 3.437 26.278 1.00 16.82 O ATOM 732 NE2 GLN A 47 -0.343 4.047 24.341 1.00 17.42 N ATOM 733 HA GLN A 47 2.945 2.436 24.931 1.00 0.00 H ATOM 734 HB2 GLN A 47 1.283 -0.102 24.889 1.00 0.00 H ATOM 735 HB3 GLN A 47 1.440 1.034 26.249 1.00 0.00 H ATOM 736 HG2 GLN A 47 0.339 1.791 23.543 1.00 0.00 H ATOM 737 HG3 GLN A 47 -0.665 1.228 24.900 1.00 0.00 H ATOM 738 HE22 GLN A 47 -0.692 3.756 23.406 1.00 0.00 H ATOM 739 HE21 GLN A 47 -0.412 5.042 24.635 1.00 0.00 H ATOM 740 H GLN A 47 1.950 0.900 22.671 1.00 0.00 H ATOM 741 N PRO A 48 4.517 0.925 26.298 1.00 6.13 N ATOM 742 CA PRO A 48 5.656 0.206 26.831 1.00 6.88 C ATOM 743 C PRO A 48 5.435 -1.271 27.044 1.00 6.90 C ATOM 744 O PRO A 48 6.316 -2.087 26.769 1.00 7.34 O ATOM 745 CB PRO A 48 5.971 0.903 28.146 1.00 8.83 C ATOM 746 CG PRO A 48 5.407 2.257 28.002 1.00 10.00 C ATOM 747 CD PRO A 48 4.247 2.183 27.042 1.00 7.77 C ATOM 748 HA PRO A 48 6.475 0.234 26.112 1.00 0.00 H ATOM 749 HD3 PRO A 48 3.298 2.128 27.575 1.00 0.00 H ATOM 750 HD2 PRO A 48 4.236 3.042 26.371 1.00 0.00 H ATOM 751 HG3 PRO A 48 6.167 2.934 27.612 1.00 0.00 H ATOM 752 HG2 PRO A 48 5.062 2.619 28.971 1.00 0.00 H ATOM 753 HB2 PRO A 48 5.504 0.379 28.980 1.00 0.00 H ATOM 754 HB3 PRO A 48 7.048 0.951 28.307 1.00 0.00 H ATOM 755 N GLU A 49 4.248 -1.662 27.500 1.00 6.83 N ATOM 756 CA GLU A 49 3.941 -3.063 27.748 1.00 6.57 C ATOM 757 C GLU A 49 3.844 -3.892 26.488 1.00 6.04 C ATOM 758 O GLU A 49 3.789 -5.127 26.505 1.00 6.91 O ATOM 759 CB GLU A 49 2.664 -3.142 28.602 1.00 7.12 C ATOM 760 CG GLU A 49 1.396 -2.822 27.852 1.00 7.50 C ATOM 761 CD GLU A 49 0.951 -1.386 27.747 1.00 7.55 C ATOM 762 OE1 GLU A 49 1.725 -0.511 28.211 1.00 6.42 O ATOM 763 OE2 GLU A 49 -0.183 -1.143 27.221 1.00 7.48 O ATOM 764 HA GLU A 49 4.774 -3.505 28.295 1.00 0.00 H ATOM 765 HB2 GLU A 49 2.580 -4.154 28.999 1.00 0.00 H ATOM 766 HB3 GLU A 49 2.760 -2.436 29.427 1.00 0.00 H ATOM 767 HG2 GLU A 49 1.524 -3.192 26.835 1.00 0.00 H ATOM 768 HG3 GLU A 49 0.590 -3.372 28.338 1.00 0.00 H ATOM 769 H GLU A 49 3.518 -0.945 27.685 1.00 0.00 H ATOM 770 N SER A 50 3.836 -3.273 25.304 1.00 5.49 N ATOM 771 CA SER A 50 3.822 -3.968 24.037 1.00 4.61 C ATOM 772 C SER A 50 5.181 -3.901 23.343 1.00 3.41 C ATOM 773 O SER A 50 5.309 -4.433 22.242 1.00 3.47 O ATOM 774 CB SER A 50 2.708 -3.412 23.133 1.00 5.26 C ATOM 775 OG SER A 50 1.453 -3.816 23.674 1.00 7.59 O ATOM 776 HA SER A 50 3.614 -5.020 24.233 1.00 0.00 H ATOM 777 HB2 SER A 50 2.820 -3.808 22.123 1.00 0.00 H ATOM 778 HB3 SER A 50 2.765 -2.324 23.104 1.00 0.00 H ATOM 779 HG SER A 50 1.359 -3.456 24.591 1.00 0.00 H ATOM 780 H SER A 50 3.840 -2.233 25.294 1.00 0.00 H ATOM 781 N TRP A 51 6.210 -3.399 24.024 1.00 3.01 N ATOM 782 CA TRP A 51 7.552 -3.322 23.395 1.00 3.10 C ATOM 783 C TRP A 51 8.185 -4.693 23.327 1.00 2.79 C ATOM 784 O TRP A 51 8.997 -4.919 22.420 1.00 3.16 O ATOM 785 CB TRP A 51 8.451 -2.360 24.172 1.00 3.29 C ATOM 786 CG TRP A 51 9.649 -1.978 23.360 1.00 3.07 C ATOM 787 CD1 TRP A 51 10.934 -2.392 23.527 1.00 3.27 C ATOM 788 CD2 TRP A 51 9.644 -1.072 22.239 1.00 2.97 C ATOM 789 NE1 TRP A 51 11.742 -1.805 22.581 1.00 3.44 N ATOM 790 CE2 TRP A 51 10.976 -0.987 21.796 1.00 3.16 C ATOM 791 CE3 TRP A 51 8.675 -0.301 21.603 1.00 2.80 C ATOM 792 CZ2 TRP A 51 11.366 -0.192 20.726 1.00 2.98 C ATOM 793 CZ3 TRP A 51 9.052 0.478 20.515 1.00 3.59 C ATOM 794 CH2 TRP A 51 10.400 0.553 20.108 1.00 3.69 C ATOM 795 HA TRP A 51 7.435 -2.945 22.379 1.00 0.00 H ATOM 796 HB2 TRP A 51 7.885 -1.462 24.418 1.00 0.00 H ATOM 797 HB3 TRP A 51 8.782 -2.843 25.091 1.00 0.00 H ATOM 798 HE1 TRP A 51 12.766 -1.958 22.479 1.00 0.00 H ATOM 799 HD1 TRP A 51 11.273 -3.086 24.296 1.00 0.00 H ATOM 800 HZ2 TRP A 51 12.403 -0.163 20.391 1.00 0.00 H ATOM 801 HH2 TRP A 51 10.676 1.215 19.288 1.00 0.00 H ATOM 802 HZ3 TRP A 51 8.294 1.039 19.968 1.00 0.00 H ATOM 803 HE3 TRP A 51 7.642 -0.308 21.951 1.00 0.00 H ATOM 804 H TRP A 51 6.073 -3.061 24.998 1.00 0.00 H ATOM 805 N GLN A 52 7.853 -5.596 24.259 1.00 3.87 N ATOM 806 CA GLN A 52 8.466 -6.916 24.226 1.00 3.55 C ATOM 807 C GLN A 52 8.245 -7.605 22.891 1.00 3.04 C ATOM 808 O GLN A 52 9.148 -8.251 22.368 1.00 3.10 O ATOM 809 CB GLN A 52 7.942 -7.779 25.380 1.00 3.20 C ATOM 810 CG GLN A 52 8.630 -9.139 25.505 1.00 2.88 C ATOM 811 CD GLN A 52 10.031 -8.963 26.070 1.00 3.36 C ATOM 812 OE1 GLN A 52 10.180 -8.424 27.157 1.00 5.29 O ATOM 813 NE2 GLN A 52 11.006 -9.422 25.307 1.00 4.05 N ATOM 814 HA GLN A 52 9.541 -6.786 24.349 1.00 0.00 H ATOM 815 HB2 GLN A 52 8.091 -7.233 26.311 1.00 0.00 H ATOM 816 HB3 GLN A 52 6.876 -7.947 25.225 1.00 0.00 H ATOM 817 HG2 GLN A 52 8.050 -9.778 26.171 1.00 0.00 H ATOM 818 HG3 GLN A 52 8.693 -9.604 24.521 1.00 0.00 H ATOM 819 HE22 GLN A 52 10.786 -9.868 24.394 1.00 0.00 H ATOM 820 HE21 GLN A 52 11.994 -9.338 25.619 1.00 0.00 H ATOM 821 H GLN A 52 7.163 -5.356 25.000 1.00 0.00 H ATOM 822 N ALA A 53 7.070 -7.441 22.284 1.00 3.87 N ATOM 823 CA ALA A 53 6.794 -8.056 20.997 1.00 4.11 C ATOM 824 C ALA A 53 7.704 -7.486 19.917 1.00 3.75 C ATOM 825 O ALA A 53 8.090 -8.192 18.975 1.00 4.70 O ATOM 826 CB ALA A 53 5.346 -7.845 20.591 1.00 5.93 C ATOM 827 HA ALA A 53 6.983 -9.124 21.100 1.00 0.00 H ATOM 828 HB1 ALA A 53 4.691 -8.291 21.340 1.00 0.00 H ATOM 829 HB2 ALA A 53 5.142 -6.777 20.519 1.00 0.00 H ATOM 830 HB3 ALA A 53 5.169 -8.316 19.624 1.00 0.00 H ATOM 831 H ALA A 53 6.337 -6.862 22.740 1.00 0.00 H ATOM 832 N ILE A 54 8.058 -6.213 19.997 1.00 3.05 N ATOM 833 CA ILE A 54 8.959 -5.557 19.066 1.00 3.45 C ATOM 834 C ILE A 54 10.383 -6.079 19.256 1.00 3.38 C ATOM 835 O ILE A 54 11.090 -6.427 18.316 1.00 3.40 O ATOM 836 CB ILE A 54 8.953 -4.022 19.209 1.00 4.21 C ATOM 837 CG1 ILE A 54 7.550 -3.416 19.091 1.00 5.65 C ATOM 838 CG2 ILE A 54 9.895 -3.402 18.190 1.00 5.15 C ATOM 839 CD1 ILE A 54 6.754 -3.821 17.880 1.00 7.04 C ATOM 840 HA ILE A 54 8.600 -5.793 18.064 1.00 0.00 H ATOM 841 HB ILE A 54 9.302 -3.792 20.215 1.00 0.00 H ATOM 842 HG12 ILE A 54 6.984 -3.710 19.975 1.00 0.00 H ATOM 843 HG13 ILE A 54 7.656 -2.331 19.073 1.00 0.00 H ATOM 844 HD11 ILE A 54 7.289 -3.523 16.979 1.00 0.00 H ATOM 845 HD12 ILE A 54 6.617 -4.902 17.882 1.00 0.00 H ATOM 846 HD13 ILE A 54 5.781 -3.330 17.906 1.00 0.00 H ATOM 847 HG21 ILE A 54 10.906 -3.775 18.357 1.00 0.00 H ATOM 848 HG22 ILE A 54 9.569 -3.671 17.185 1.00 0.00 H ATOM 849 HG23 ILE A 54 9.884 -2.318 18.299 1.00 0.00 H ATOM 850 H ILE A 54 7.666 -5.647 20.776 1.00 0.00 H ATOM 851 N TRP A 55 10.811 -6.204 20.515 1.00 2.31 N ATOM 852 CA TRP A 55 12.104 -6.797 20.816 1.00 2.21 C ATOM 853 C TRP A 55 12.183 -8.205 20.208 1.00 2.66 C ATOM 854 O TRP A 55 13.146 -8.595 19.546 1.00 2.49 O ATOM 855 CB TRP A 55 12.309 -6.900 22.345 1.00 2.92 C ATOM 856 CG TRP A 55 13.622 -7.572 22.670 1.00 3.00 C ATOM 857 CD1 TRP A 55 13.795 -8.898 22.930 1.00 3.18 C ATOM 858 CD2 TRP A 55 14.915 -6.960 22.769 1.00 3.25 C ATOM 859 NE1 TRP A 55 15.127 -9.134 23.151 1.00 2.96 N ATOM 860 CE2 TRP A 55 15.846 -7.978 23.040 1.00 2.93 C ATOM 861 CE3 TRP A 55 15.375 -5.650 22.614 1.00 2.95 C ATOM 862 CZ2 TRP A 55 17.213 -7.723 23.190 1.00 2.55 C ATOM 863 CZ3 TRP A 55 16.720 -5.387 22.774 1.00 3.01 C ATOM 864 CH2 TRP A 55 17.618 -6.426 23.035 1.00 2.99 C ATOM 865 HA TRP A 55 12.881 -6.162 20.390 1.00 0.00 H ATOM 866 HB2 TRP A 55 12.305 -5.898 22.774 1.00 0.00 H ATOM 867 HB3 TRP A 55 11.494 -7.482 22.776 1.00 0.00 H ATOM 868 HE1 TRP A 55 15.534 -10.065 23.373 1.00 0.00 H ATOM 869 HD1 TRP A 55 13.004 -9.648 22.958 1.00 0.00 H ATOM 870 HZ2 TRP A 55 17.921 -8.519 23.419 1.00 0.00 H ATOM 871 HH2 TRP A 55 18.680 -6.194 23.118 1.00 0.00 H ATOM 872 HZ3 TRP A 55 17.085 -4.363 22.696 1.00 0.00 H ATOM 873 HE3 TRP A 55 14.680 -4.846 22.370 1.00 0.00 H ATOM 874 H TRP A 55 10.208 -5.871 21.294 1.00 0.00 H ATOM 875 N ASP A 56 11.148 -9.009 20.475 1.00 2.63 N ATOM 876 CA ASP A 56 11.163 -10.412 20.083 1.00 3.85 C ATOM 877 C ASP A 56 11.091 -10.629 18.574 1.00 5.00 C ATOM 878 O ASP A 56 11.735 -11.566 18.082 1.00 6.34 O ATOM 879 CB ASP A 56 9.984 -11.140 20.737 1.00 4.28 C ATOM 880 CG ASP A 56 10.086 -11.297 22.233 1.00 4.37 C ATOM 881 OD1 ASP A 56 11.111 -10.959 22.843 1.00 4.76 O ATOM 882 OD2 ASP A 56 9.082 -11.800 22.808 1.00 6.41 O ATOM 883 HA ASP A 56 12.119 -10.812 20.421 1.00 0.00 H ATOM 884 HB2 ASP A 56 9.075 -10.580 20.516 1.00 0.00 H ATOM 885 HB3 ASP A 56 9.913 -12.134 20.296 1.00 0.00 H ATOM 886 H ASP A 56 10.318 -8.626 20.971 1.00 0.00 H ATOM 887 N ALA A 57 10.313 -9.819 17.881 1.00 4.46 N ATOM 888 CA ALA A 57 10.144 -10.025 16.451 1.00 5.63 C ATOM 889 C ALA A 57 11.102 -9.247 15.579 1.00 6.44 C ATOM 890 O ALA A 57 11.382 -9.686 14.455 1.00 8.30 O ATOM 891 CB ALA A 57 8.725 -9.602 16.052 1.00 7.31 C ATOM 892 HA ALA A 57 10.343 -11.084 16.285 1.00 0.00 H ATOM 893 HB1 ALA A 57 8.000 -10.204 16.600 1.00 0.00 H ATOM 894 HB2 ALA A 57 8.580 -8.549 16.293 1.00 0.00 H ATOM 895 HB3 ALA A 57 8.590 -9.753 14.981 1.00 0.00 H ATOM 896 H ALA A 57 9.822 -9.035 18.356 1.00 0.00 H ATOM 897 N GLU A 58 11.516 -8.077 16.026 1.00 5.84 N ATOM 898 CA GLU A 58 12.302 -7.186 15.189 1.00 6.94 C ATOM 899 C GLU A 58 13.729 -6.955 15.643 1.00 7.45 C ATOM 900 O GLU A 58 14.678 -6.970 14.841 1.00 10.89 O ATOM 901 CB GLU A 58 11.606 -5.814 15.107 1.00 8.71 C ATOM 902 CG GLU A 58 10.211 -5.814 14.527 1.00 12.34 C ATOM 903 CD GLU A 58 10.147 -6.209 13.073 1.00 14.89 C ATOM 904 OE1 GLU A 58 11.108 -6.035 12.288 1.00 15.52 O ATOM 905 OE2 GLU A 58 9.077 -6.721 12.683 1.00 17.27 O ATOM 906 HA GLU A 58 12.362 -7.690 14.225 1.00 0.00 H ATOM 907 HB2 GLU A 58 11.548 -5.408 16.117 1.00 0.00 H ATOM 908 HB3 GLU A 58 12.224 -5.162 14.490 1.00 0.00 H ATOM 909 HG2 GLU A 58 9.602 -6.514 15.099 1.00 0.00 H ATOM 910 HG3 GLU A 58 9.799 -4.810 14.627 1.00 0.00 H ATOM 911 H GLU A 58 11.275 -7.787 16.995 1.00 0.00 H ATOM 912 N ILE A 59 13.932 -6.682 16.925 1.00 4.80 N ATOM 913 CA ILE A 59 15.239 -6.272 17.407 1.00 3.79 C ATOM 914 C ILE A 59 16.168 -7.447 17.633 1.00 4.18 C ATOM 915 O ILE A 59 17.257 -7.528 17.046 1.00 5.57 O ATOM 916 CB ILE A 59 15.115 -5.348 18.641 1.00 3.48 C ATOM 917 CG1 ILE A 59 14.174 -4.167 18.348 1.00 4.16 C ATOM 918 CG2 ILE A 59 16.501 -4.858 19.041 1.00 3.80 C ATOM 919 CD1 ILE A 59 13.859 -3.303 19.538 1.00 4.20 C ATOM 920 HA ILE A 59 15.709 -5.683 16.620 1.00 0.00 H ATOM 921 HB ILE A 59 14.683 -5.910 19.470 1.00 0.00 H ATOM 922 HG12 ILE A 59 14.641 -3.541 17.588 1.00 0.00 H ATOM 923 HG13 ILE A 59 13.237 -4.567 17.961 1.00 0.00 H ATOM 924 HD11 ILE A 59 13.377 -3.907 20.307 1.00 0.00 H ATOM 925 HD12 ILE A 59 14.783 -2.880 19.933 1.00 0.00 H ATOM 926 HD13 ILE A 59 13.190 -2.498 19.234 1.00 0.00 H ATOM 927 HG21 ILE A 59 17.131 -5.713 19.285 1.00 0.00 H ATOM 928 HG22 ILE A 59 16.943 -4.305 18.212 1.00 0.00 H ATOM 929 HG23 ILE A 59 16.418 -4.206 19.911 1.00 0.00 H ATOM 930 H ILE A 59 13.142 -6.763 17.596 1.00 0.00 H ATOM 931 N ALA A 60 15.763 -8.346 18.521 1.00 4.02 N ATOM 932 CA ALA A 60 16.586 -9.487 18.875 1.00 4.54 C ATOM 933 C ALA A 60 16.976 -10.356 17.709 1.00 3.69 C ATOM 934 O ALA A 60 18.181 -10.626 17.522 1.00 4.89 O ATOM 935 CB ALA A 60 15.961 -10.306 19.996 1.00 6.12 C ATOM 936 HA ALA A 60 17.520 -9.060 19.242 1.00 0.00 H ATOM 937 HB1 ALA A 60 15.844 -9.679 20.880 1.00 0.00 H ATOM 938 HB2 ALA A 60 14.985 -10.672 19.676 1.00 0.00 H ATOM 939 HB3 ALA A 60 16.608 -11.151 20.231 1.00 0.00 H ATOM 940 H ALA A 60 14.834 -8.230 18.974 1.00 0.00 H ATOM 941 N PRO A 61 16.070 -10.768 16.837 1.00 3.33 N ATOM 942 CA PRO A 61 16.467 -11.654 15.749 1.00 4.11 C ATOM 943 C PRO A 61 17.448 -10.996 14.793 1.00 4.54 C ATOM 944 O PRO A 61 18.245 -11.705 14.160 1.00 6.20 O ATOM 945 CB PRO A 61 15.163 -12.016 15.054 1.00 5.12 C ATOM 946 CG PRO A 61 14.066 -11.632 15.965 1.00 7.00 C ATOM 947 CD PRO A 61 14.599 -10.597 16.910 1.00 4.87 C ATOM 948 HA PRO A 61 16.996 -12.532 16.121 1.00 0.00 H ATOM 949 HD3 PRO A 61 14.309 -9.596 16.592 1.00 0.00 H ATOM 950 HD2 PRO A 61 14.238 -10.774 17.923 1.00 0.00 H ATOM 951 HG3 PRO A 61 13.724 -12.504 16.523 1.00 0.00 H ATOM 952 HG2 PRO A 61 13.235 -11.220 15.393 1.00 0.00 H ATOM 953 HB2 PRO A 61 15.076 -11.472 14.113 1.00 0.00 H ATOM 954 HB3 PRO A 61 15.129 -13.088 14.857 1.00 0.00 H ATOM 955 N GLN A 62 17.380 -9.675 14.657 1.00 3.64 N ATOM 956 CA GLN A 62 18.255 -8.957 13.759 1.00 3.25 C ATOM 957 C GLN A 62 19.531 -8.424 14.390 1.00 3.08 C ATOM 958 O GLN A 62 20.289 -7.726 13.704 1.00 2.93 O ATOM 959 CB GLN A 62 17.518 -7.773 13.110 1.00 4.36 C ATOM 960 CG GLN A 62 16.415 -8.244 12.149 1.00 6.33 C ATOM 961 CD GLN A 62 15.801 -7.029 11.481 1.00 8.49 C ATOM 962 OE1 GLN A 62 14.985 -6.318 12.024 1.00 10.56 O ATOM 963 NE2 GLN A 62 16.227 -6.742 10.265 1.00 9.71 N ATOM 964 HA GLN A 62 18.549 -9.704 13.022 1.00 0.00 H ATOM 965 HB2 GLN A 62 17.067 -7.165 13.894 1.00 0.00 H ATOM 966 HB3 GLN A 62 18.237 -7.171 12.554 1.00 0.00 H ATOM 967 HG2 GLN A 62 16.843 -8.902 11.393 1.00 0.00 H ATOM 968 HG3 GLN A 62 15.649 -8.783 12.706 1.00 0.00 H ATOM 969 HE22 GLN A 62 16.928 -7.355 9.801 1.00 0.00 H ATOM 970 HE21 GLN A 62 15.862 -5.903 9.771 1.00 0.00 H ATOM 971 H GLN A 62 16.678 -9.145 15.212 1.00 0.00 H ATOM 972 N MET A 63 19.821 -8.752 15.638 1.00 2.53 N ATOM 973 CA MET A 63 21.000 -8.256 16.324 1.00 2.75 C ATOM 974 C MET A 63 22.262 -8.439 15.510 1.00 3.19 C ATOM 975 O MET A 63 23.089 -7.526 15.426 1.00 3.36 O ATOM 976 CB MET A 63 21.155 -8.942 17.693 1.00 2.63 C ATOM 977 CG MET A 63 22.174 -8.266 18.590 1.00 3.51 C ATOM 978 SD MET A 63 21.700 -6.673 19.243 1.00 2.82 S ATOM 979 CE MET A 63 20.218 -7.049 20.185 1.00 3.92 C ATOM 980 HA MET A 63 20.855 -7.185 16.467 1.00 0.00 H ATOM 981 HB2 MET A 63 20.189 -8.931 18.197 1.00 0.00 H ATOM 982 HB3 MET A 63 21.467 -9.974 17.530 1.00 0.00 H ATOM 983 HG2 MET A 63 23.090 -8.133 18.015 1.00 0.00 H ATOM 984 HG3 MET A 63 22.369 -8.929 19.433 1.00 0.00 H ATOM 985 HE1 MET A 63 19.464 -7.472 19.521 1.00 0.00 H ATOM 986 HE2 MET A 63 20.459 -7.769 20.967 1.00 0.00 H ATOM 987 HE3 MET A 63 19.834 -6.134 20.637 1.00 0.00 H ATOM 988 H MET A 63 19.178 -9.391 16.148 1.00 0.00 H ATOM 989 N GLU A 64 22.409 -9.570 14.823 1.00 2.66 N ATOM 990 CA GLU A 64 23.547 -9.877 13.994 1.00 2.94 C ATOM 991 C GLU A 64 23.757 -8.933 12.808 1.00 3.01 C ATOM 992 O GLU A 64 24.864 -8.879 12.293 1.00 3.67 O ATOM 993 CB GLU A 64 23.431 -11.308 13.427 1.00 3.12 C ATOM 994 CG GLU A 64 22.254 -11.486 12.478 1.00 3.73 C ATOM 995 CD GLU A 64 22.006 -12.905 12.036 1.00 4.71 C ATOM 996 OE1 GLU A 64 22.764 -13.811 12.439 1.00 4.67 O ATOM 997 OE2 GLU A 64 21.056 -13.126 11.267 1.00 8.25 O ATOM 998 HA GLU A 64 24.402 -9.763 14.660 1.00 0.00 H ATOM 999 HB2 GLU A 64 24.349 -11.542 12.888 1.00 0.00 H ATOM 1000 HB3 GLU A 64 23.313 -12.002 14.259 1.00 0.00 H ATOM 1001 HG2 GLU A 64 21.356 -11.125 12.980 1.00 0.00 H ATOM 1002 HG3 GLU A 64 22.440 -10.882 11.590 1.00 0.00 H ATOM 1003 H GLU A 64 21.652 -10.280 14.889 1.00 0.00 H ATOM 1004 N ALA A 65 22.712 -8.207 12.419 1.00 2.87 N ATOM 1005 CA ALA A 65 22.741 -7.338 11.254 1.00 3.61 C ATOM 1006 C ALA A 65 22.412 -5.893 11.557 1.00 3.03 C ATOM 1007 O ALA A 65 22.605 -5.068 10.658 1.00 4.07 O ATOM 1008 CB ALA A 65 21.701 -7.845 10.250 1.00 4.75 C ATOM 1009 HA ALA A 65 23.760 -7.368 10.869 1.00 0.00 H ATOM 1010 HB1 ALA A 65 21.945 -8.867 9.961 1.00 0.00 H ATOM 1011 HB2 ALA A 65 20.713 -7.822 10.710 1.00 0.00 H ATOM 1012 HB3 ALA A 65 21.708 -7.205 9.368 1.00 0.00 H ATOM 1013 H ALA A 65 21.834 -8.264 12.974 1.00 0.00 H ATOM 1014 N LEU A 66 21.873 -5.562 12.725 1.00 3.11 N ATOM 1015 CA LEU A 66 21.517 -4.174 12.958 1.00 3.01 C ATOM 1016 C LEU A 66 22.669 -3.236 12.674 1.00 3.23 C ATOM 1017 O LEU A 66 23.827 -3.480 13.018 1.00 2.77 O ATOM 1018 CB LEU A 66 21.091 -3.986 14.428 1.00 2.76 C ATOM 1019 CG LEU A 66 19.814 -4.703 14.888 1.00 2.64 C ATOM 1020 CD1 LEU A 66 19.641 -4.469 16.379 1.00 2.95 C ATOM 1021 CD2 LEU A 66 18.627 -4.218 14.079 1.00 3.10 C ATOM 1022 HA LEU A 66 20.698 -3.934 12.280 1.00 0.00 H ATOM 1023 HB2 LEU A 66 21.910 -4.340 15.054 1.00 0.00 H ATOM 1024 HB3 LEU A 66 20.945 -2.918 14.593 1.00 0.00 H ATOM 1025 HG LEU A 66 19.888 -5.777 14.719 1.00 0.00 H ATOM 1026 HD21 LEU A 66 18.507 -3.144 14.221 1.00 0.00 H ATOM 1027 HD22 LEU A 66 18.797 -4.430 13.023 1.00 0.00 H ATOM 1028 HD23 LEU A 66 17.726 -4.733 14.413 1.00 0.00 H ATOM 1029 HD11 LEU A 66 20.505 -4.868 16.911 1.00 0.00 H ATOM 1030 HD12 LEU A 66 19.557 -3.399 16.570 1.00 0.00 H ATOM 1031 HD13 LEU A 66 18.737 -4.972 16.722 1.00 0.00 H ATOM 1032 H LEU A 66 21.709 -6.282 13.457 1.00 0.00 H ATOM 1033 N ILE A 67 22.353 -2.088 12.058 1.00 2.58 N ATOM 1034 CA ILE A 67 23.389 -1.061 11.843 1.00 2.61 C ATOM 1035 C ILE A 67 23.599 -0.239 13.105 1.00 2.39 C ATOM 1036 O ILE A 67 24.636 0.406 13.239 1.00 3.42 O ATOM 1037 CB ILE A 67 23.164 -0.204 10.592 1.00 2.43 C ATOM 1038 CG1 ILE A 67 21.920 0.671 10.629 1.00 2.83 C ATOM 1039 CG2 ILE A 67 23.167 -1.134 9.377 1.00 2.94 C ATOM 1040 CD1 ILE A 67 21.860 1.678 9.486 1.00 3.63 C ATOM 1041 HA ILE A 67 24.320 -1.588 11.634 1.00 0.00 H ATOM 1042 HB ILE A 67 23.979 0.517 10.536 1.00 0.00 H ATOM 1043 HG12 ILE A 67 21.042 0.028 10.571 1.00 0.00 H ATOM 1044 HG13 ILE A 67 21.908 1.216 11.573 1.00 0.00 H ATOM 1045 HD11 ILE A 67 22.728 2.336 9.537 1.00 0.00 H ATOM 1046 HD12 ILE A 67 21.861 1.146 8.535 1.00 0.00 H ATOM 1047 HD13 ILE A 67 20.948 2.269 9.572 1.00 0.00 H ATOM 1048 HG21 ILE A 67 24.127 -1.647 9.316 1.00 0.00 H ATOM 1049 HG22 ILE A 67 22.368 -1.868 9.481 1.00 0.00 H ATOM 1050 HG23 ILE A 67 23.008 -0.548 8.472 1.00 0.00 H ATOM 1051 H ILE A 67 21.379 -1.922 11.732 1.00 0.00 H ATOM 1052 N LYS A 68 22.660 -0.247 14.039 1.00 2.39 N ATOM 1053 CA LYS A 68 22.860 0.314 15.377 1.00 2.63 C ATOM 1054 C LYS A 68 22.134 -0.621 16.347 1.00 2.96 C ATOM 1055 O LYS A 68 20.925 -0.764 16.265 1.00 2.36 O ATOM 1056 CB LYS A 68 22.350 1.739 15.511 1.00 2.42 C ATOM 1057 CG LYS A 68 22.568 2.325 16.919 1.00 2.67 C ATOM 1058 CD LYS A 68 22.023 3.736 16.981 1.00 3.42 C ATOM 1059 CE LYS A 68 22.232 4.456 18.296 1.00 3.71 C ATOM 1060 NZ LYS A 68 23.665 4.725 18.561 1.00 5.86 N ATOM 1061 HA LYS A 68 23.927 0.377 15.593 1.00 0.00 H ATOM 1062 HB2 LYS A 68 22.874 2.365 14.789 1.00 0.00 H ATOM 1063 HB3 LYS A 68 21.282 1.748 15.292 1.00 0.00 H ATOM 1064 HG2 LYS A 68 22.052 1.705 17.652 1.00 0.00 H ATOM 1065 HG3 LYS A 68 23.635 2.339 17.144 1.00 0.00 H ATOM 1066 HD2 LYS A 68 22.508 4.319 16.198 1.00 0.00 H ATOM 1067 HD3 LYS A 68 20.951 3.691 16.788 1.00 0.00 H ATOM 1068 HE2 LYS A 68 21.835 3.839 19.102 1.00 0.00 H ATOM 1069 HE3 LYS A 68 21.695 5.404 18.267 1.00 0.00 H ATOM 1070 HZ1 LYS A 68 24.185 3.825 18.597 1.00 0.00 H ATOM 1071 HZ2 LYS A 68 24.051 5.319 17.800 1.00 0.00 H ATOM 1072 HZ3 LYS A 68 23.761 5.219 19.471 1.00 0.00 H ATOM 1073 H LYS A 68 21.738 -0.671 13.812 1.00 0.00 H ATOM 1074 N LYS A 69 22.914 -1.203 17.248 1.00 2.81 N ATOM 1075 CA LYS A 69 22.328 -2.105 18.260 1.00 2.68 C ATOM 1076 C LYS A 69 21.813 -1.278 19.427 1.00 3.78 C ATOM 1077 O LYS A 69 22.328 -0.208 19.695 1.00 3.79 O ATOM 1078 CB LYS A 69 23.413 -3.057 18.729 1.00 2.54 C ATOM 1079 CG LYS A 69 23.931 -4.029 17.691 1.00 2.74 C ATOM 1080 CD LYS A 69 24.981 -4.924 18.305 1.00 3.32 C ATOM 1081 CE LYS A 69 25.585 -5.913 17.345 1.00 4.02 C ATOM 1082 NZ LYS A 69 26.562 -5.223 16.453 1.00 4.53 N ATOM 1083 HA LYS A 69 21.497 -2.672 17.839 1.00 0.00 H ATOM 1084 HB2 LYS A 69 24.255 -2.459 19.077 1.00 0.00 H ATOM 1085 HB3 LYS A 69 23.013 -3.637 19.560 1.00 0.00 H ATOM 1086 HG2 LYS A 69 23.106 -4.639 17.323 1.00 0.00 H ATOM 1087 HG3 LYS A 69 24.369 -3.474 16.862 1.00 0.00 H ATOM 1088 HD2 LYS A 69 25.780 -4.295 18.697 1.00 0.00 H ATOM 1089 HD3 LYS A 69 24.522 -5.478 19.124 1.00 0.00 H ATOM 1090 HE2 LYS A 69 24.795 -6.359 16.740 1.00 0.00 H ATOM 1091 HE3 LYS A 69 26.097 -6.695 17.906 1.00 0.00 H ATOM 1092 HZ1 LYS A 69 26.074 -4.478 15.917 1.00 0.00 H ATOM 1093 HZ2 LYS A 69 27.317 -4.799 17.030 1.00 0.00 H ATOM 1094 HZ3 LYS A 69 26.974 -5.913 15.793 1.00 0.00 H ATOM 1095 H LYS A 69 23.938 -1.024 17.242 1.00 0.00 H ATOM 1096 N PRO A 70 20.764 -1.735 20.081 1.00 3.12 N ATOM 1097 CA PRO A 70 20.260 -1.047 21.261 1.00 3.38 C ATOM 1098 C PRO A 70 21.280 -1.039 22.388 1.00 3.61 C ATOM 1099 O PRO A 70 22.168 -1.877 22.473 1.00 4.50 O ATOM 1100 CB PRO A 70 19.031 -1.861 21.647 1.00 3.70 C ATOM 1101 CG PRO A 70 19.351 -3.252 21.217 1.00 3.66 C ATOM 1102 CD PRO A 70 20.098 -3.055 19.912 1.00 3.32 C ATOM 1103 HA PRO A 70 20.039 0.003 21.068 1.00 0.00 H ATOM 1104 HD3 PRO A 70 20.834 -3.845 19.762 1.00 0.00 H ATOM 1105 HD2 PRO A 70 19.408 -3.037 19.068 1.00 0.00 H ATOM 1106 HG3 PRO A 70 18.441 -3.832 21.062 1.00 0.00 H ATOM 1107 HG2 PRO A 70 19.978 -3.754 21.954 1.00 0.00 H ATOM 1108 HB2 PRO A 70 18.864 -1.819 22.723 1.00 0.00 H ATOM 1109 HB3 PRO A 70 18.146 -1.492 21.129 1.00 0.00 H ATOM 1110 N GLY A 71 21.156 -0.082 23.288 1.00 3.13 N ATOM 1111 CA GLY A 71 21.966 0.051 24.485 1.00 4.00 C ATOM 1112 C GLY A 71 21.315 -0.596 25.699 1.00 3.83 C ATOM 1113 O GLY A 71 21.701 -0.323 26.836 1.00 5.65 O ATOM 1114 HA3 GLY A 71 22.116 1.111 24.691 1.00 0.00 H ATOM 1115 HA2 GLY A 71 22.931 -0.424 24.310 1.00 0.00 H ATOM 1116 H GLY A 71 20.419 0.634 23.127 1.00 0.00 H ATOM 1117 N TYR A 72 20.329 -1.445 25.479 1.00 3.12 N ATOM 1118 CA TYR A 72 19.662 -2.197 26.509 1.00 2.72 C ATOM 1119 C TYR A 72 19.407 -3.605 25.951 1.00 2.85 C ATOM 1120 O TYR A 72 19.525 -3.842 24.737 1.00 2.75 O ATOM 1121 CB TYR A 72 18.315 -1.551 26.888 1.00 2.87 C ATOM 1122 CG TYR A 72 17.331 -1.517 25.749 1.00 2.60 C ATOM 1123 CD1 TYR A 72 17.380 -0.519 24.780 1.00 2.74 C ATOM 1124 CD2 TYR A 72 16.381 -2.520 25.600 1.00 2.54 C ATOM 1125 CE1 TYR A 72 16.490 -0.521 23.721 1.00 2.65 C ATOM 1126 CE2 TYR A 72 15.486 -2.526 24.545 1.00 2.56 C ATOM 1127 CZ TYR A 72 15.567 -1.529 23.592 1.00 2.29 C ATOM 1128 OH TYR A 72 14.688 -1.572 22.530 1.00 2.52 O ATOM 1129 HA TYR A 72 20.282 -2.224 27.405 1.00 0.00 H ATOM 1130 HB3 TYR A 72 18.501 -0.528 27.216 1.00 0.00 H ATOM 1131 HB2 TYR A 72 17.876 -2.120 27.708 1.00 0.00 H ATOM 1132 HD2 TYR A 72 16.340 -3.324 26.335 1.00 0.00 H ATOM 1133 HE2 TYR A 72 14.728 -3.306 24.467 1.00 0.00 H ATOM 1134 HE1 TYR A 72 16.522 0.282 22.985 1.00 0.00 H ATOM 1135 HD1 TYR A 72 18.127 0.271 24.856 1.00 0.00 H ATOM 1136 HH TYR A 72 14.858 -0.803 21.931 1.00 0.00 H ATOM 1137 H TYR A 72 20.013 -1.579 24.497 1.00 0.00 H ATOM 1138 N SER A 73 19.114 -4.523 26.872 1.00 2.96 N ATOM 1139 CA SER A 73 18.726 -5.868 26.450 1.00 2.67 C ATOM 1140 C SER A 73 17.400 -6.199 27.129 1.00 2.79 C ATOM 1141 O SER A 73 17.177 -5.793 28.294 1.00 3.50 O ATOM 1142 CB SER A 73 19.767 -6.933 26.767 1.00 2.67 C ATOM 1143 OG SER A 73 19.933 -7.102 28.166 1.00 3.72 O ATOM 1144 HA SER A 73 18.634 -5.872 25.364 1.00 0.00 H ATOM 1145 HB2 SER A 73 20.721 -6.637 26.331 1.00 0.00 H ATOM 1146 HB3 SER A 73 19.448 -7.880 26.331 1.00 0.00 H ATOM 1147 HG SER A 73 20.615 -7.800 28.334 1.00 0.00 H ATOM 1148 H SER A 73 19.161 -4.284 27.883 1.00 0.00 H ATOM 1149 N MET A 74 16.505 -6.897 26.447 1.00 3.48 N ATOM 1150 CA MET A 74 15.209 -7.301 26.983 1.00 4.46 C ATOM 1151 C MET A 74 14.852 -8.728 26.594 1.00 3.60 C ATOM 1152 O MET A 74 13.703 -9.009 26.253 1.00 3.58 O ATOM 1153 CB MET A 74 14.131 -6.358 26.430 1.00 9.18 C ATOM 1154 CG MET A 74 13.882 -5.104 27.236 1.00 11.28 C ATOM 1155 SD MET A 74 12.595 -4.240 26.331 1.00 11.67 S ATOM 1156 CE MET A 74 11.138 -5.165 26.638 1.00 11.37 C ATOM 1157 HA MET A 74 15.263 -7.249 28.070 1.00 0.00 H ATOM 1158 HB2 MET A 74 14.431 -6.057 25.426 1.00 0.00 H ATOM 1159 HB3 MET A 74 13.195 -6.914 26.377 1.00 0.00 H ATOM 1160 HG2 MET A 74 14.786 -4.498 27.296 1.00 0.00 H ATOM 1161 HG3 MET A 74 13.546 -5.352 28.243 1.00 0.00 H ATOM 1162 HE1 MET A 74 11.273 -6.184 26.276 1.00 0.00 H ATOM 1163 HE2 MET A 74 10.939 -5.182 27.710 1.00 0.00 H ATOM 1164 HE3 MET A 74 10.299 -4.702 26.118 1.00 0.00 H ATOM 1165 H MET A 74 16.739 -7.174 25.472 1.00 0.00 H ATOM 1166 N ASN A 75 15.855 -9.612 26.627 1.00 2.68 N ATOM 1167 CA ASN A 75 15.528 -11.036 26.335 1.00 2.78 C ATOM 1168 C ASN A 75 14.719 -11.589 27.501 1.00 3.70 C ATOM 1169 O ASN A 75 15.110 -11.457 28.659 1.00 3.39 O ATOM 1170 CB ASN A 75 16.819 -11.810 26.116 1.00 2.79 C ATOM 1171 CG ASN A 75 17.593 -11.365 24.909 1.00 3.22 C ATOM 1172 OD1 ASN A 75 18.792 -11.058 24.933 1.00 4.15 O ATOM 1173 ND2 ASN A 75 16.916 -11.347 23.777 1.00 2.94 N ATOM 1174 HA ASN A 75 14.932 -11.129 25.427 1.00 0.00 H ATOM 1175 HB2 ASN A 75 17.450 -11.683 26.996 1.00 0.00 H ATOM 1176 HB3 ASN A 75 16.572 -12.865 25.997 1.00 0.00 H ATOM 1177 HD22 ASN A 75 15.909 -11.607 23.769 1.00 0.00 H ATOM 1178 HD21 ASN A 75 17.389 -11.073 22.892 1.00 0.00 H ATOM 1179 H ASN A 75 16.827 -9.316 26.848 1.00 0.00 H ATOM 1180 N ALA A 76 13.584 -12.189 27.203 1.00 5.31 N ATOM 1181 CA ALA A 76 12.710 -12.739 28.241 1.00 7.49 C ATOM 1182 C ALA A 76 12.656 -14.254 28.193 1.00 10.15 C ATOM 1183 O ALA A 76 12.037 -14.909 29.063 1.00 13.08 O ATOM 1184 CB ALA A 76 11.332 -12.121 28.062 1.00 7.77 C ATOM 1185 HA ALA A 76 13.106 -12.490 29.226 1.00 0.00 H ATOM 1186 OXT ALA A 76 13.098 -14.835 27.201 1.00 13.29 O ATOM 1187 HB1 ALA A 76 11.405 -11.038 28.162 1.00 0.00 H ATOM 1188 HB2 ALA A 76 10.949 -12.370 27.072 1.00 0.00 H ATOM 1189 HB3 ALA A 76 10.658 -12.513 28.823 1.00 0.00 H ATOM 1190 H ALA A 76 13.302 -12.274 26.206 1.00 0.00 H TER 1191 ALA A 76 ATOM 1192 N PRO B 1 13.464 3.976 20.732 1.00 3.83 N ATOM 1193 CA PRO B 1 12.840 3.849 19.410 1.00 3.66 C ATOM 1194 C PRO B 1 13.574 2.819 18.574 1.00 3.80 C ATOM 1195 O PRO B 1 14.785 2.660 18.721 1.00 3.37 O ATOM 1196 CB PRO B 1 12.939 5.244 18.778 1.00 4.28 C ATOM 1197 CG PRO B 1 13.045 6.169 19.939 1.00 4.05 C ATOM 1198 CD PRO B 1 13.855 5.405 20.955 1.00 3.75 C ATOM 1199 HA PRO B 1 11.805 3.513 19.476 1.00 0.00 H ATOM 1200 HD3 PRO B 1 14.922 5.546 20.785 1.00 0.00 H ATOM 1201 HD2 PRO B 1 13.605 5.722 21.968 1.00 0.00 H ATOM 1202 HG3 PRO B 1 12.057 6.408 20.333 1.00 0.00 H ATOM 1203 HG2 PRO B 1 13.553 7.090 19.654 1.00 0.00 H ATOM 1204 HB2 PRO B 1 13.822 5.318 18.143 1.00 0.00 H ATOM 1205 HB3 PRO B 1 12.049 5.465 18.188 1.00 0.00 H ATOM 1206 N HIS B 2 12.840 2.131 17.695 1.00 3.22 N ATOM 1207 CA HIS B 2 13.414 1.163 16.763 1.00 2.59 C ATOM 1208 C HIS B 2 13.055 1.632 15.355 1.00 2.57 C ATOM 1209 O HIS B 2 11.887 1.865 15.010 1.00 2.19 O ATOM 1210 CB HIS B 2 12.873 -0.256 16.959 1.00 2.82 C ATOM 1211 CG HIS B 2 13.475 -1.207 15.961 1.00 2.30 C ATOM 1212 ND1 HIS B 2 14.826 -1.501 15.928 1.00 2.64 N ATOM 1213 CD2 HIS B 2 12.875 -1.869 14.937 1.00 2.69 C ATOM 1214 CE1 HIS B 2 15.040 -2.319 14.912 1.00 2.95 C ATOM 1215 NE2 HIS B 2 13.873 -2.564 14.314 1.00 3.02 N ATOM 1216 HA HIS B 2 14.489 1.116 16.934 1.00 0.00 H ATOM 1217 HB2 HIS B 2 13.117 -0.595 17.966 1.00 0.00 H ATOM 1218 HB3 HIS B 2 11.790 -0.245 16.833 1.00 0.00 H ATOM 1219 HD2 HIS B 2 11.819 -1.850 14.669 1.00 0.00 H ATOM 1220 HE1 HIS B 2 16.007 -2.725 14.613 1.00 0.00 H ATOM 1221 H HIS B 2 11.813 2.292 17.673 1.00 0.00 H ATOM 1222 N ILE B 3 14.091 1.830 14.547 1.00 2.49 N ATOM 1223 CA ILE B 3 13.937 2.348 13.182 1.00 2.72 C ATOM 1224 C ILE B 3 14.310 1.245 12.196 1.00 2.54 C ATOM 1225 O ILE B 3 15.414 0.692 12.292 1.00 2.93 O ATOM 1226 CB ILE B 3 14.817 3.588 12.959 1.00 2.52 C ATOM 1227 CG1 ILE B 3 14.480 4.753 13.902 1.00 4.12 C ATOM 1228 CG2 ILE B 3 14.671 4.105 11.535 1.00 3.14 C ATOM 1229 CD1 ILE B 3 15.073 4.741 15.279 1.00 6.66 C ATOM 1230 HA ILE B 3 12.901 2.650 13.026 1.00 0.00 H ATOM 1231 HB ILE B 3 15.835 3.254 13.162 1.00 0.00 H ATOM 1232 HG12 ILE B 3 14.811 5.670 13.415 1.00 0.00 H ATOM 1233 HG13 ILE B 3 13.396 4.774 14.016 1.00 0.00 H ATOM 1234 HD11 ILE B 3 14.745 3.846 15.807 1.00 0.00 H ATOM 1235 HD12 ILE B 3 16.160 4.742 15.205 1.00 0.00 H ATOM 1236 HD13 ILE B 3 14.743 5.626 15.823 1.00 0.00 H ATOM 1237 HG21 ILE B 3 14.975 3.327 10.834 1.00 0.00 H ATOM 1238 HG22 ILE B 3 13.631 4.374 11.352 1.00 0.00 H ATOM 1239 HG23 ILE B 3 15.303 4.983 11.402 1.00 0.00 H ATOM 1240 H ILE B 3 15.046 1.610 14.894 1.00 0.00 H ATOM 1241 N ASP B 4 13.419 0.984 11.259 1.00 2.63 N ATOM 1242 CA ASP B 4 13.647 -0.025 10.235 1.00 2.61 C ATOM 1243 C ASP B 4 13.706 0.684 8.888 1.00 2.80 C ATOM 1244 O ASP B 4 12.772 1.419 8.546 1.00 2.75 O ATOM 1245 CB ASP B 4 12.550 -1.095 10.260 1.00 3.12 C ATOM 1246 CG ASP B 4 12.795 -2.179 9.250 1.00 3.88 C ATOM 1247 OD1 ASP B 4 13.517 -3.130 9.580 1.00 5.75 O ATOM 1248 OD2 ASP B 4 12.358 -2.098 8.093 1.00 4.21 O ATOM 1249 HA ASP B 4 14.587 -0.544 10.420 1.00 0.00 H ATOM 1250 HB2 ASP B 4 12.517 -1.541 11.254 1.00 0.00 H ATOM 1251 HB3 ASP B 4 11.592 -0.622 10.043 1.00 0.00 H ATOM 1252 H ASP B 4 12.525 1.516 11.252 1.00 0.00 H ATOM 1253 N ILE B 5 14.778 0.487 8.148 1.00 2.57 N ATOM 1254 CA ILE B 5 14.950 1.084 6.826 1.00 2.61 C ATOM 1255 C ILE B 5 14.972 -0.019 5.765 1.00 2.76 C ATOM 1256 O ILE B 5 15.854 -0.883 5.814 1.00 3.48 O ATOM 1257 CB ILE B 5 16.263 1.882 6.699 1.00 3.02 C ATOM 1258 CG1 ILE B 5 16.398 2.949 7.793 1.00 3.29 C ATOM 1259 CG2 ILE B 5 16.387 2.518 5.313 1.00 2.80 C ATOM 1260 CD1 ILE B 5 17.787 3.503 7.986 1.00 4.61 C ATOM 1261 HA ILE B 5 14.114 1.768 6.681 1.00 0.00 H ATOM 1262 HB ILE B 5 17.079 1.172 6.831 1.00 0.00 H ATOM 1263 HG12 ILE B 5 15.737 3.778 7.539 1.00 0.00 H ATOM 1264 HG13 ILE B 5 16.078 2.507 8.736 1.00 0.00 H ATOM 1265 HD11 ILE B 5 18.465 2.694 8.257 1.00 0.00 H ATOM 1266 HD12 ILE B 5 18.124 3.966 7.059 1.00 0.00 H ATOM 1267 HD13 ILE B 5 17.772 4.248 8.781 1.00 0.00 H ATOM 1268 HG21 ILE B 5 16.378 1.736 4.554 1.00 0.00 H ATOM 1269 HG22 ILE B 5 15.549 3.195 5.149 1.00 0.00 H ATOM 1270 HG23 ILE B 5 17.322 3.074 5.252 1.00 0.00 H ATOM 1271 H ILE B 5 15.535 -0.120 8.522 1.00 0.00 H ATOM 1272 N LYS B 6 13.992 -0.052 4.881 1.00 2.76 N ATOM 1273 CA LYS B 6 13.924 -1.014 3.793 1.00 2.98 C ATOM 1274 C LYS B 6 14.233 -0.280 2.491 1.00 2.75 C ATOM 1275 O LYS B 6 13.710 0.799 2.240 1.00 2.77 O ATOM 1276 CB LYS B 6 12.515 -1.615 3.693 1.00 3.30 C ATOM 1277 CG LYS B 6 12.339 -2.716 4.746 1.00 3.83 C ATOM 1278 CD LYS B 6 10.926 -3.264 4.683 1.00 4.98 C ATOM 1279 CE LYS B 6 10.724 -4.409 5.644 1.00 6.15 C ATOM 1280 NZ LYS B 6 10.637 -3.960 7.043 1.00 6.93 N ATOM 1281 HA LYS B 6 14.639 -1.817 3.975 1.00 0.00 H ATOM 1282 HB2 LYS B 6 11.775 -0.832 3.862 1.00 0.00 H ATOM 1283 HB3 LYS B 6 12.373 -2.039 2.699 1.00 0.00 H ATOM 1284 HG2 LYS B 6 13.049 -3.520 4.552 1.00 0.00 H ATOM 1285 HG3 LYS B 6 12.523 -2.302 5.737 1.00 0.00 H ATOM 1286 HD2 LYS B 6 10.227 -2.466 4.933 1.00 0.00 H ATOM 1287 HD3 LYS B 6 10.728 -3.615 3.670 1.00 0.00 H ATOM 1288 HE2 LYS B 6 11.563 -5.098 5.549 1.00 0.00 H ATOM 1289 HE3 LYS B 6 9.800 -4.926 5.384 1.00 0.00 H ATOM 1290 HZ1 LYS B 6 11.518 -3.472 7.305 1.00 0.00 H ATOM 1291 HZ2 LYS B 6 9.834 -3.308 7.147 1.00 0.00 H ATOM 1292 HZ3 LYS B 6 10.498 -4.784 7.662 1.00 0.00 H ATOM 1293 H LYS B 6 13.228 0.648 4.968 1.00 0.00 H ATOM 1294 N CYS B 7 15.085 -0.847 1.650 1.00 2.74 N ATOM 1295 CA CYS B 7 15.476 -0.250 0.382 1.00 3.73 C ATOM 1296 C CYS B 7 15.939 -1.325 -0.597 1.00 3.50 C ATOM 1297 O CYS B 7 16.230 -2.452 -0.189 1.00 3.54 O ATOM 1298 CB CYS B 7 16.598 0.757 0.602 1.00 4.32 C ATOM 1299 SG CYS B 7 18.130 0.063 1.267 1.00 5.80 S ATOM 1300 HA CYS B 7 14.609 0.260 -0.039 1.00 0.00 H ATOM 1301 HB2 CYS B 7 16.240 1.515 1.298 1.00 0.00 H ATOM 1302 HB3 CYS B 7 16.826 1.224 -0.356 1.00 0.00 H ATOM 1303 HG CYS B 7 18.618 -0.889 0.395 1.00 0.00 H ATOM 1304 H CYS B 7 15.496 -1.767 1.909 1.00 0.00 H ATOM 1305 N PHE B 8 16.041 -0.968 -1.879 1.00 4.23 N ATOM 1306 CA PHE B 8 16.572 -1.899 -2.870 1.00 5.35 C ATOM 1307 C PHE B 8 18.033 -2.138 -2.546 1.00 6.62 C ATOM 1308 O PHE B 8 18.675 -1.330 -1.856 1.00 6.78 O ATOM 1309 CB PHE B 8 16.441 -1.284 -4.265 1.00 6.25 C ATOM 1310 CG PHE B 8 15.087 -1.372 -4.908 1.00 7.35 C ATOM 1311 CD1 PHE B 8 13.951 -1.783 -4.238 1.00 8.79 C ATOM 1312 CD2 PHE B 8 14.963 -0.991 -6.245 1.00 8.42 C ATOM 1313 CE1 PHE B 8 12.729 -1.854 -4.881 1.00 9.58 C ATOM 1314 CE2 PHE B 8 13.733 -1.057 -6.881 1.00 9.27 C ATOM 1315 CZ PHE B 8 12.627 -1.486 -6.200 1.00 9.56 C ATOM 1316 HA PHE B 8 16.023 -2.840 -2.850 1.00 0.00 H ATOM 1317 HB2 PHE B 8 16.705 -0.229 -4.189 1.00 0.00 H ATOM 1318 HB3 PHE B 8 17.152 -1.789 -4.919 1.00 0.00 H ATOM 1319 HD2 PHE B 8 15.838 -0.640 -6.792 1.00 0.00 H ATOM 1320 HE2 PHE B 8 13.647 -0.766 -7.928 1.00 0.00 H ATOM 1321 HZ PHE B 8 11.663 -1.536 -6.705 1.00 0.00 H ATOM 1322 HE1 PHE B 8 11.848 -2.202 -4.342 1.00 0.00 H ATOM 1323 HD1 PHE B 8 14.019 -2.056 -3.185 1.00 0.00 H ATOM 1324 H PHE B 8 15.739 -0.018 -2.175 1.00 0.00 H ATOM 1325 N PRO B 9 18.615 -3.212 -3.053 1.00 7.65 N ATOM 1326 CA PRO B 9 19.982 -3.557 -2.730 1.00 9.27 C ATOM 1327 C PRO B 9 21.015 -2.530 -3.146 1.00 11.60 C ATOM 1328 O PRO B 9 20.904 -1.919 -4.196 1.00 12.14 O ATOM 1329 CB PRO B 9 20.224 -4.885 -3.437 1.00 9.91 C ATOM 1330 CG PRO B 9 18.862 -5.437 -3.694 1.00 9.79 C ATOM 1331 CD PRO B 9 17.960 -4.251 -3.893 1.00 8.56 C ATOM 1332 HA PRO B 9 20.099 -3.608 -1.648 1.00 0.00 H ATOM 1333 HD3 PRO B 9 17.928 -3.950 -4.940 1.00 0.00 H ATOM 1334 HD2 PRO B 9 16.949 -4.461 -3.545 1.00 0.00 H ATOM 1335 HG3 PRO B 9 18.527 -6.029 -2.842 1.00 0.00 H ATOM 1336 HG2 PRO B 9 18.869 -6.061 -4.588 1.00 0.00 H ATOM 1337 HB2 PRO B 9 20.758 -4.729 -4.374 1.00 0.00 H ATOM 1338 HB3 PRO B 9 20.798 -5.559 -2.801 1.00 0.00 H ATOM 1339 N ARG B 10 22.008 -2.364 -2.277 1.00 14.52 N ATOM 1340 CA ARG B 10 23.122 -1.479 -2.567 1.00 17.04 C ATOM 1341 C ARG B 10 24.262 -1.855 -1.605 1.00 18.73 C ATOM 1342 O ARG B 10 24.000 -2.377 -0.527 1.00 20.08 O ATOM 1343 CB ARG B 10 22.831 -0.001 -2.498 1.00 18.30 C ATOM 1344 CG ARG B 10 22.349 0.543 -1.171 1.00 18.66 C ATOM 1345 CD ARG B 10 20.897 0.946 -1.271 1.00 18.27 C ATOM 1346 NE ARG B 10 20.582 2.297 -1.725 1.00 17.09 N ATOM 1347 CZ ARG B 10 19.389 2.560 -2.270 1.00 16.28 C ATOM 1348 NH1 ARG B 10 18.503 1.578 -2.386 1.00 14.91 N ATOM 1349 NH2 ARG B 10 18.997 3.753 -2.695 1.00 16.51 N ATOM 1350 HA ARG B 10 23.385 -1.631 -3.614 1.00 0.00 H ATOM 1351 HB2 ARG B 10 23.749 0.527 -2.757 1.00 0.00 H ATOM 1352 HB3 ARG B 10 22.065 0.219 -3.242 1.00 0.00 H ATOM 1353 HG2 ARG B 10 22.458 -0.225 -0.405 1.00 0.00 H ATOM 1354 HG3 ARG B 10 22.947 1.413 -0.899 1.00 0.00 H ATOM 1355 HD2 ARG B 10 20.461 0.829 -0.279 1.00 0.00 H ATOM 1356 HD3 ARG B 10 20.417 0.253 -1.962 1.00 0.00 H ATOM 1357 HE ARG B 10 21.286 3.056 -1.625 1.00 0.00 H ATOM 1358 HH12 ARG B 10 17.571 1.766 -2.807 1.00 0.00 H ATOM 1359 HH11 ARG B 10 18.741 0.621 -2.055 1.00 0.00 H ATOM 1360 HH22 ARG B 10 18.050 3.873 -3.108 1.00 0.00 H ATOM 1361 HH21 ARG B 10 19.637 4.569 -2.616 1.00 0.00 H ATOM 1362 H ARG B 10 21.986 -2.878 -1.373 1.00 0.00 H ATOM 1363 N GLU B 11 25.470 -1.604 -2.069 1.00 19.53 N ATOM 1364 CA GLU B 11 26.639 -1.928 -1.264 1.00 19.58 C ATOM 1365 C GLU B 11 26.965 -0.833 -0.259 1.00 18.29 C ATOM 1366 O GLU B 11 27.262 0.296 -0.655 1.00 20.32 O ATOM 1367 CB GLU B 11 27.834 -2.126 -2.194 1.00 20.83 C ATOM 1368 HA GLU B 11 26.422 -2.837 -0.703 1.00 0.00 H ATOM 1369 HB2 GLU B 11 27.623 -2.941 -2.886 1.00 0.00 H ATOM 1370 HB3 GLU B 11 28.012 -1.208 -2.755 1.00 0.00 H ATOM 1371 H GLU B 11 25.588 -1.175 -3.009 1.00 0.00 H ATOM 1372 N LEU B 12 26.887 -1.138 1.027 1.00 16.86 N ATOM 1373 CA LEU B 12 27.248 -0.209 2.082 1.00 14.90 C ATOM 1374 C LEU B 12 28.324 -0.868 2.961 1.00 13.05 C ATOM 1375 O LEU B 12 28.086 -1.915 3.569 1.00 12.53 O ATOM 1376 CB LEU B 12 26.134 0.278 2.998 1.00 15.53 C ATOM 1377 CG LEU B 12 25.549 1.671 2.742 1.00 15.82 C ATOM 1378 CD1 LEU B 12 24.625 1.606 1.533 1.00 16.04 C ATOM 1379 CD2 LEU B 12 24.815 2.216 3.956 1.00 15.75 C ATOM 1380 HA LEU B 12 27.582 0.682 1.551 1.00 0.00 H ATOM 1381 HB2 LEU B 12 25.315 -0.437 2.921 1.00 0.00 H ATOM 1382 HB3 LEU B 12 26.525 0.272 4.015 1.00 0.00 H ATOM 1383 HG LEU B 12 26.370 2.359 2.542 1.00 0.00 H ATOM 1384 HD21 LEU B 12 23.995 1.546 4.215 1.00 0.00 H ATOM 1385 HD22 LEU B 12 25.507 2.287 4.795 1.00 0.00 H ATOM 1386 HD23 LEU B 12 24.418 3.205 3.726 1.00 0.00 H ATOM 1387 HD11 LEU B 12 25.192 1.279 0.661 1.00 0.00 H ATOM 1388 HD12 LEU B 12 23.819 0.899 1.731 1.00 0.00 H ATOM 1389 HD13 LEU B 12 24.205 2.594 1.345 1.00 0.00 H ATOM 1390 H LEU B 12 26.552 -2.086 1.293 1.00 0.00 H ATOM 1391 N ASP B 13 29.474 -0.203 3.031 1.00 11.05 N ATOM 1392 CA ASP B 13 30.554 -0.744 3.860 1.00 9.45 C ATOM 1393 C ASP B 13 30.324 -0.386 5.318 1.00 7.91 C ATOM 1394 O ASP B 13 29.320 0.298 5.615 1.00 8.00 O ATOM 1395 CB ASP B 13 31.918 -0.344 3.318 1.00 9.57 C ATOM 1396 CG ASP B 13 32.278 1.114 3.435 1.00 10.93 C ATOM 1397 OD1 ASP B 13 31.620 1.868 4.193 1.00 10.02 O ATOM 1398 OD2 ASP B 13 33.240 1.526 2.750 1.00 13.47 O ATOM 1399 HA ASP B 13 30.544 -1.833 3.813 1.00 0.00 H ATOM 1400 HB2 ASP B 13 32.672 -0.917 3.857 1.00 0.00 H ATOM 1401 HB3 ASP B 13 31.948 -0.611 2.262 1.00 0.00 H ATOM 1402 H ASP B 13 29.604 0.685 2.506 1.00 0.00 H ATOM 1403 N GLU B 14 31.168 -0.826 6.233 1.00 7.95 N ATOM 1404 CA GLU B 14 30.939 -0.586 7.652 1.00 8.28 C ATOM 1405 C GLU B 14 30.933 0.882 8.006 1.00 7.77 C ATOM 1406 O GLU B 14 30.096 1.340 8.805 1.00 6.97 O ATOM 1407 CB GLU B 14 31.890 -1.411 8.529 1.00 11.19 C ATOM 1408 CG GLU B 14 31.600 -2.904 8.526 1.00 15.54 C ATOM 1409 CD GLU B 14 30.232 -3.322 9.027 1.00 18.95 C ATOM 1410 OE1 GLU B 14 29.745 -2.734 10.011 1.00 19.28 O ATOM 1411 OE2 GLU B 14 29.626 -4.242 8.425 1.00 21.82 O ATOM 1412 HA GLU B 14 29.931 -0.938 7.871 1.00 0.00 H ATOM 1413 HB2 GLU B 14 32.907 -1.259 8.168 1.00 0.00 H ATOM 1414 HB3 GLU B 14 31.811 -1.049 9.554 1.00 0.00 H ATOM 1415 HG2 GLU B 14 31.702 -3.261 7.501 1.00 0.00 H ATOM 1416 HG3 GLU B 14 32.347 -3.389 9.154 1.00 0.00 H ATOM 1417 H GLU B 14 32.013 -1.354 5.935 1.00 0.00 H ATOM 1418 N GLN B 15 31.825 1.660 7.432 1.00 7.33 N ATOM 1419 CA GLN B 15 31.869 3.095 7.690 1.00 7.76 C ATOM 1420 C GLN B 15 30.563 3.745 7.218 1.00 6.07 C ATOM 1421 O GLN B 15 30.000 4.557 7.965 1.00 5.53 O ATOM 1422 CB GLN B 15 33.105 3.704 7.037 1.00 11.19 C ATOM 1423 CG GLN B 15 33.185 5.210 7.231 1.00 15.63 C ATOM 1424 CD GLN B 15 34.451 5.787 6.639 1.00 19.65 C ATOM 1425 OE1 GLN B 15 34.780 6.935 6.930 1.00 21.58 O ATOM 1426 NE2 GLN B 15 35.146 5.013 5.824 1.00 21.05 N ATOM 1427 HA GLN B 15 31.953 3.283 8.760 1.00 0.00 H ATOM 1428 HB2 GLN B 15 33.993 3.247 7.475 1.00 0.00 H ATOM 1429 HB3 GLN B 15 33.077 3.490 5.969 1.00 0.00 H ATOM 1430 HG2 GLN B 15 32.326 5.674 6.747 1.00 0.00 H ATOM 1431 HG3 GLN B 15 33.162 5.430 8.298 1.00 0.00 H ATOM 1432 HE22 GLN B 15 34.817 4.049 5.615 1.00 0.00 H ATOM 1433 HE21 GLN B 15 36.022 5.368 5.391 1.00 0.00 H ATOM 1434 H GLN B 15 32.516 1.241 6.778 1.00 0.00 H ATOM 1435 N GLN B 16 30.060 3.384 6.055 1.00 4.80 N ATOM 1436 CA GLN B 16 28.810 3.906 5.556 1.00 4.53 C ATOM 1437 C GLN B 16 27.628 3.564 6.438 1.00 4.39 C ATOM 1438 O GLN B 16 26.773 4.422 6.702 1.00 4.53 O ATOM 1439 CB GLN B 16 28.551 3.437 4.125 1.00 6.68 C ATOM 1440 CG GLN B 16 29.513 4.089 3.145 1.00 8.90 C ATOM 1441 CD GLN B 16 29.490 3.505 1.761 1.00 11.04 C ATOM 1442 OE1 GLN B 16 29.366 2.300 1.549 1.00 10.92 O ATOM 1443 NE2 GLN B 16 29.632 4.401 0.793 1.00 12.88 N ATOM 1444 HA GLN B 16 28.912 4.991 5.566 1.00 0.00 H ATOM 1445 HB2 GLN B 16 28.675 2.355 4.078 1.00 0.00 H ATOM 1446 HB3 GLN B 16 27.530 3.696 3.846 1.00 0.00 H ATOM 1447 HG2 GLN B 16 29.259 5.146 3.072 1.00 0.00 H ATOM 1448 HG3 GLN B 16 30.523 3.986 3.541 1.00 0.00 H ATOM 1449 HE22 GLN B 16 29.733 5.409 1.028 1.00 0.00 H ATOM 1450 HE21 GLN B 16 29.642 4.095 -0.201 1.00 0.00 H ATOM 1451 H GLN B 16 30.583 2.697 5.475 1.00 0.00 H ATOM 1452 N LYS B 17 27.558 2.317 6.887 1.00 4.27 N ATOM 1453 CA LYS B 17 26.451 1.877 7.741 1.00 4.22 C ATOM 1454 C LYS B 17 26.463 2.642 9.055 1.00 3.34 C ATOM 1455 O LYS B 17 25.412 3.109 9.523 1.00 3.50 O ATOM 1456 CB LYS B 17 26.526 0.379 8.022 1.00 6.42 C ATOM 1457 CG LYS B 17 26.156 -0.512 6.852 1.00 9.87 C ATOM 1458 CD LYS B 17 26.410 -1.980 7.210 1.00 12.63 C ATOM 1459 CE LYS B 17 25.936 -2.882 6.087 1.00 16.00 C ATOM 1460 NZ LYS B 17 26.119 -4.312 6.480 1.00 18.22 N ATOM 1461 HA LYS B 17 25.522 2.081 7.208 1.00 0.00 H ATOM 1462 HB2 LYS B 17 27.547 0.141 8.319 1.00 0.00 H ATOM 1463 HB3 LYS B 17 25.848 0.155 8.846 1.00 0.00 H ATOM 1464 HG2 LYS B 17 25.101 -0.376 6.614 1.00 0.00 H ATOM 1465 HG3 LYS B 17 26.761 -0.241 5.986 1.00 0.00 H ATOM 1466 HD2 LYS B 17 27.477 -2.133 7.369 1.00 0.00 H ATOM 1467 HD3 LYS B 17 25.869 -2.227 8.123 1.00 0.00 H ATOM 1468 HE2 LYS B 17 26.515 -2.676 5.187 1.00 0.00 H ATOM 1469 HE3 LYS B 17 24.881 -2.692 5.890 1.00 0.00 H ATOM 1470 HZ1 LYS B 17 27.126 -4.493 6.667 1.00 0.00 H ATOM 1471 HZ2 LYS B 17 25.565 -4.508 7.338 1.00 0.00 H ATOM 1472 HZ3 LYS B 17 25.793 -4.927 5.707 1.00 0.00 H ATOM 1473 H LYS B 17 28.303 1.639 6.628 1.00 0.00 H ATOM 1474 N ALA B 18 27.658 2.832 9.631 1.00 3.22 N ATOM 1475 CA ALA B 18 27.754 3.536 10.894 1.00 3.31 C ATOM 1476 C ALA B 18 27.420 5.023 10.755 1.00 3.15 C ATOM 1477 O ALA B 18 26.747 5.565 11.636 1.00 3.17 O ATOM 1478 CB ALA B 18 29.122 3.397 11.535 1.00 3.86 C ATOM 1479 HA ALA B 18 27.015 3.064 11.541 1.00 0.00 H ATOM 1480 HB1 ALA B 18 29.329 2.343 11.721 1.00 0.00 H ATOM 1481 HB2 ALA B 18 29.879 3.805 10.865 1.00 0.00 H ATOM 1482 HB3 ALA B 18 29.137 3.944 12.478 1.00 0.00 H ATOM 1483 H ALA B 18 28.519 2.473 9.170 1.00 0.00 H ATOM 1484 N ALA B 19 27.812 5.654 9.649 1.00 3.24 N ATOM 1485 CA ALA B 19 27.513 7.077 9.463 1.00 2.69 C ATOM 1486 C ALA B 19 26.013 7.275 9.250 1.00 2.50 C ATOM 1487 O ALA B 19 25.421 8.221 9.778 1.00 2.68 O ATOM 1488 CB ALA B 19 28.302 7.661 8.305 1.00 3.37 C ATOM 1489 HA ALA B 19 27.813 7.609 10.366 1.00 0.00 H ATOM 1490 HB1 ALA B 19 29.368 7.554 8.503 1.00 0.00 H ATOM 1491 HB2 ALA B 19 28.046 7.130 7.388 1.00 0.00 H ATOM 1492 HB3 ALA B 19 28.056 8.717 8.195 1.00 0.00 H ATOM 1493 H ALA B 19 28.333 5.134 8.914 1.00 0.00 H ATOM 1494 N LEU B 20 25.392 6.402 8.464 1.00 2.35 N ATOM 1495 CA LEU B 20 23.941 6.493 8.285 1.00 2.21 C ATOM 1496 C LEU B 20 23.252 6.301 9.626 1.00 2.29 C ATOM 1497 O LEU B 20 22.386 7.110 10.001 1.00 2.23 O ATOM 1498 CB LEU B 20 23.480 5.408 7.327 1.00 2.78 C ATOM 1499 CG LEU B 20 21.986 5.090 7.309 1.00 2.45 C ATOM 1500 CD1 LEU B 20 21.163 6.309 6.910 1.00 2.89 C ATOM 1501 CD2 LEU B 20 21.697 3.914 6.389 1.00 3.10 C ATOM 1502 HA LEU B 20 23.687 7.472 7.879 1.00 0.00 H ATOM 1503 HB2 LEU B 20 23.764 5.715 6.320 1.00 0.00 H ATOM 1504 HB3 LEU B 20 24.009 4.491 7.588 1.00 0.00 H ATOM 1505 HG LEU B 20 21.692 4.812 8.321 1.00 0.00 H ATOM 1506 HD21 LEU B 20 22.018 4.159 5.376 1.00 0.00 H ATOM 1507 HD22 LEU B 20 22.240 3.037 6.741 1.00 0.00 H ATOM 1508 HD23 LEU B 20 20.627 3.706 6.392 1.00 0.00 H ATOM 1509 HD11 LEU B 20 21.338 7.113 7.625 1.00 0.00 H ATOM 1510 HD12 LEU B 20 21.460 6.636 5.913 1.00 0.00 H ATOM 1511 HD13 LEU B 20 20.105 6.047 6.908 1.00 0.00 H ATOM 1512 H LEU B 20 25.933 5.658 7.979 1.00 0.00 H ATOM 1513 N ALA B 21 23.674 5.303 10.402 1.00 2.19 N ATOM 1514 CA ALA B 21 23.088 5.100 11.716 1.00 2.60 C ATOM 1515 C ALA B 21 23.253 6.308 12.628 1.00 2.43 C ATOM 1516 O ALA B 21 22.305 6.665 13.336 1.00 2.12 O ATOM 1517 CB ALA B 21 23.737 3.888 12.367 1.00 3.03 C ATOM 1518 HA ALA B 21 22.018 4.945 11.576 1.00 0.00 H ATOM 1519 HB1 ALA B 21 23.564 3.008 11.747 1.00 0.00 H ATOM 1520 HB2 ALA B 21 24.809 4.060 12.465 1.00 0.00 H ATOM 1521 HB3 ALA B 21 23.301 3.730 13.354 1.00 0.00 H ATOM 1522 H ALA B 21 24.425 4.667 10.066 1.00 0.00 H ATOM 1523 N ALA B 22 24.398 6.973 12.576 1.00 2.37 N ATOM 1524 CA ALA B 22 24.627 8.140 13.418 1.00 2.48 C ATOM 1525 C ALA B 22 23.746 9.324 13.028 1.00 2.86 C ATOM 1526 O ALA B 22 23.154 9.991 13.896 1.00 2.25 O ATOM 1527 CB ALA B 22 26.096 8.548 13.418 1.00 2.68 C ATOM 1528 HA ALA B 22 24.349 7.846 14.430 1.00 0.00 H ATOM 1529 HB1 ALA B 22 26.701 7.724 13.797 1.00 0.00 H ATOM 1530 HB2 ALA B 22 26.405 8.789 12.401 1.00 0.00 H ATOM 1531 HB3 ALA B 22 26.229 9.421 14.056 1.00 0.00 H ATOM 1532 H ALA B 22 25.144 6.657 11.924 1.00 0.00 H ATOM 1533 N ASP B 23 23.612 9.581 11.729 1.00 2.46 N ATOM 1534 CA ASP B 23 22.729 10.661 11.277 1.00 2.74 C ATOM 1535 C ASP B 23 21.287 10.382 11.648 1.00 2.54 C ATOM 1536 O ASP B 23 20.577 11.294 12.080 1.00 2.45 O ATOM 1537 CB ASP B 23 22.871 10.971 9.796 1.00 2.46 C ATOM 1538 CG ASP B 23 23.991 11.942 9.449 1.00 2.86 C ATOM 1539 OD1 ASP B 23 24.763 12.379 10.323 1.00 2.79 O ATOM 1540 OD2 ASP B 23 24.111 12.241 8.230 1.00 2.66 O ATOM 1541 HA ASP B 23 23.050 11.559 11.805 1.00 0.00 H ATOM 1542 HB2 ASP B 23 23.059 10.035 9.270 1.00 0.00 H ATOM 1543 HB3 ASP B 23 21.931 11.399 9.448 1.00 0.00 H ATOM 1544 H ASP B 23 24.135 9.014 11.032 1.00 0.00 H ATOM 1545 N ILE B 24 20.817 9.130 11.490 1.00 2.41 N ATOM 1546 CA ILE B 24 19.448 8.773 11.896 1.00 2.65 C ATOM 1547 C ILE B 24 19.270 8.963 13.400 1.00 3.02 C ATOM 1548 O ILE B 24 18.264 9.531 13.854 1.00 2.69 O ATOM 1549 CB ILE B 24 19.108 7.335 11.461 1.00 2.29 C ATOM 1550 CG1 ILE B 24 19.031 7.209 9.941 1.00 2.43 C ATOM 1551 CG2 ILE B 24 17.812 6.867 12.114 1.00 2.38 C ATOM 1552 CD1 ILE B 24 17.851 7.845 9.256 1.00 3.47 C ATOM 1553 HA ILE B 24 18.749 9.441 11.392 1.00 0.00 H ATOM 1554 HB ILE B 24 19.917 6.687 11.800 1.00 0.00 H ATOM 1555 HG12 ILE B 24 19.933 7.661 9.528 1.00 0.00 H ATOM 1556 HG13 ILE B 24 19.016 6.146 9.700 1.00 0.00 H ATOM 1557 HD11 ILE B 24 16.930 7.399 9.632 1.00 0.00 H ATOM 1558 HD12 ILE B 24 17.848 8.916 9.460 1.00 0.00 H ATOM 1559 HD13 ILE B 24 17.924 7.679 8.181 1.00 0.00 H ATOM 1560 HG21 ILE B 24 17.924 6.891 13.198 1.00 0.00 H ATOM 1561 HG22 ILE B 24 16.998 7.528 11.817 1.00 0.00 H ATOM 1562 HG23 ILE B 24 17.592 5.849 11.792 1.00 0.00 H ATOM 1563 H ILE B 24 21.432 8.402 11.074 1.00 0.00 H ATOM 1564 N THR B 25 20.261 8.490 14.169 1.00 2.55 N ATOM 1565 CA THR B 25 20.211 8.610 15.624 1.00 2.97 C ATOM 1566 C THR B 25 19.979 10.035 16.083 1.00 2.85 C ATOM 1567 O THR B 25 19.097 10.305 16.888 1.00 2.74 O ATOM 1568 CB THR B 25 21.533 8.072 16.227 1.00 2.77 C ATOM 1569 OG1 THR B 25 21.560 6.646 16.043 1.00 2.70 O ATOM 1570 CG2 THR B 25 21.643 8.321 17.717 1.00 2.84 C ATOM 1571 HA THR B 25 19.364 8.020 15.975 1.00 0.00 H ATOM 1572 HB THR B 25 22.352 8.588 15.725 1.00 0.00 H ATOM 1573 HG1 THR B 25 21.516 6.438 15.076 1.00 0.00 H ATOM 1574 HG23 THR B 25 21.627 9.394 17.907 1.00 0.00 H ATOM 1575 HG21 THR B 25 20.803 7.848 18.226 1.00 0.00 H ATOM 1576 HG22 THR B 25 22.578 7.899 18.086 1.00 0.00 H ATOM 1577 H THR B 25 21.079 8.030 13.722 1.00 0.00 H ATOM 1578 N ASP B 26 20.749 10.975 15.532 1.00 2.72 N ATOM 1579 CA ASP B 26 20.628 12.379 15.979 1.00 2.55 C ATOM 1580 C ASP B 26 19.286 12.962 15.584 1.00 2.34 C ATOM 1581 O ASP B 26 18.719 13.749 16.352 1.00 2.65 O ATOM 1582 CB ASP B 26 21.827 13.171 15.487 1.00 3.17 C ATOM 1583 CG ASP B 26 23.123 12.742 16.153 1.00 3.47 C ATOM 1584 OD1 ASP B 26 23.037 12.081 17.208 1.00 4.52 O ATOM 1585 OD2 ASP B 26 24.189 13.088 15.608 1.00 5.02 O ATOM 1586 HA ASP B 26 20.645 12.432 17.068 1.00 0.00 H ATOM 1587 HB2 ASP B 26 21.923 13.027 14.411 1.00 0.00 H ATOM 1588 HB3 ASP B 26 21.659 14.227 15.698 1.00 0.00 H ATOM 1589 H ASP B 26 21.432 10.721 14.790 1.00 0.00 H ATOM 1590 N VAL B 27 18.742 12.590 14.435 1.00 2.50 N ATOM 1591 CA VAL B 27 17.398 13.041 14.047 1.00 2.68 C ATOM 1592 C VAL B 27 16.381 12.522 15.050 1.00 2.73 C ATOM 1593 O VAL B 27 15.494 13.285 15.476 1.00 2.59 O ATOM 1594 CB VAL B 27 17.054 12.589 12.620 1.00 2.66 C ATOM 1595 CG1 VAL B 27 15.577 12.757 12.294 1.00 2.54 C ATOM 1596 CG2 VAL B 27 17.902 13.362 11.611 1.00 2.77 C ATOM 1597 HA VAL B 27 17.373 14.131 14.053 1.00 0.00 H ATOM 1598 HB VAL B 27 17.278 11.524 12.556 1.00 0.00 H ATOM 1599 HG11 VAL B 27 14.983 12.161 12.987 1.00 0.00 H ATOM 1600 HG12 VAL B 27 15.303 13.808 12.389 1.00 0.00 H ATOM 1601 HG13 VAL B 27 15.391 12.422 11.274 1.00 0.00 H ATOM 1602 HG21 VAL B 27 17.700 14.428 11.710 1.00 0.00 H ATOM 1603 HG22 VAL B 27 18.958 13.172 11.804 1.00 0.00 H ATOM 1604 HG23 VAL B 27 17.652 13.035 10.602 1.00 0.00 H ATOM 1605 H VAL B 27 19.276 11.967 13.796 1.00 0.00 H ATOM 1606 N ILE B 28 16.453 11.256 15.427 1.00 2.49 N ATOM 1607 CA ILE B 28 15.521 10.688 16.401 1.00 2.42 C ATOM 1608 C ILE B 28 15.659 11.350 17.770 1.00 2.69 C ATOM 1609 O ILE B 28 14.645 11.678 18.394 1.00 2.55 O ATOM 1610 CB ILE B 28 15.702 9.157 16.463 1.00 2.75 C ATOM 1611 CG1 ILE B 28 15.323 8.531 15.114 1.00 2.91 C ATOM 1612 CG2 ILE B 28 14.942 8.535 17.616 1.00 3.11 C ATOM 1613 CD1 ILE B 28 13.866 8.562 14.754 1.00 3.23 C ATOM 1614 HA ILE B 28 14.502 10.894 16.074 1.00 0.00 H ATOM 1615 HB ILE B 28 16.754 8.946 16.655 1.00 0.00 H ATOM 1616 HG12 ILE B 28 15.870 9.063 14.335 1.00 0.00 H ATOM 1617 HG13 ILE B 28 15.639 7.488 15.131 1.00 0.00 H ATOM 1618 HD11 ILE B 28 13.295 8.020 15.508 1.00 0.00 H ATOM 1619 HD12 ILE B 28 13.525 9.597 14.712 1.00 0.00 H ATOM 1620 HD13 ILE B 28 13.723 8.091 13.781 1.00 0.00 H ATOM 1621 HG21 ILE B 28 15.300 8.956 18.555 1.00 0.00 H ATOM 1622 HG22 ILE B 28 13.878 8.746 17.504 1.00 0.00 H ATOM 1623 HG23 ILE B 28 15.102 7.457 17.615 1.00 0.00 H ATOM 1624 H ILE B 28 17.192 10.648 15.020 1.00 0.00 H ATOM 1625 N ILE B 29 16.910 11.567 18.209 1.00 2.44 N ATOM 1626 CA ILE B 29 17.124 12.277 19.474 1.00 2.37 C ATOM 1627 C ILE B 29 16.458 13.647 19.449 1.00 2.96 C ATOM 1628 O ILE B 29 15.755 14.019 20.401 1.00 3.70 O ATOM 1629 CB ILE B 29 18.639 12.380 19.732 1.00 2.31 C ATOM 1630 CG1 ILE B 29 19.208 11.004 20.076 1.00 2.71 C ATOM 1631 CG2 ILE B 29 18.899 13.385 20.841 1.00 2.92 C ATOM 1632 CD1 ILE B 29 20.701 10.969 20.262 1.00 2.47 C ATOM 1633 HA ILE B 29 16.664 11.723 20.292 1.00 0.00 H ATOM 1634 HB ILE B 29 19.143 12.730 18.831 1.00 0.00 H ATOM 1635 HG12 ILE B 29 18.742 10.665 21.002 1.00 0.00 H ATOM 1636 HG13 ILE B 29 18.950 10.318 19.269 1.00 0.00 H ATOM 1637 HD11 ILE B 29 21.188 11.291 19.342 1.00 0.00 H ATOM 1638 HD12 ILE B 29 20.980 11.638 21.076 1.00 0.00 H ATOM 1639 HD13 ILE B 29 21.012 9.953 20.503 1.00 0.00 H ATOM 1640 HG21 ILE B 29 18.514 14.360 20.543 1.00 0.00 H ATOM 1641 HG22 ILE B 29 18.397 13.057 21.751 1.00 0.00 H ATOM 1642 HG23 ILE B 29 19.972 13.456 21.021 1.00 0.00 H ATOM 1643 H ILE B 29 17.723 11.233 17.654 1.00 0.00 H ATOM 1644 N ARG B 30 16.623 14.382 18.347 1.00 3.24 N ATOM 1645 CA ARG B 30 16.040 15.705 18.266 1.00 4.10 C ATOM 1646 C ARG B 30 14.531 15.712 18.316 1.00 4.44 C ATOM 1647 O ARG B 30 13.925 16.529 19.030 1.00 7.47 O ATOM 1648 CB ARG B 30 16.444 16.347 16.924 1.00 5.27 C ATOM 1649 CG ARG B 30 17.882 16.775 16.858 1.00 7.22 C ATOM 1650 CD ARG B 30 18.172 17.250 15.447 1.00 8.07 C ATOM 1651 NE ARG B 30 19.549 17.624 15.284 1.00 9.46 N ATOM 1652 CZ ARG B 30 20.030 18.841 15.563 1.00 8.42 C ATOM 1653 NH1 ARG B 30 19.292 19.839 16.011 1.00 8.54 N ATOM 1654 NH2 ARG B 30 21.309 18.989 15.333 1.00 10.04 N ATOM 1655 HA ARG B 30 16.411 16.251 19.133 1.00 0.00 H ATOM 1656 HB2 ARG B 30 16.265 15.622 16.130 1.00 0.00 H ATOM 1657 HB3 ARG B 30 15.818 17.224 16.761 1.00 0.00 H ATOM 1658 HG2 ARG B 30 18.058 17.586 17.564 1.00 0.00 H ATOM 1659 HG3 ARG B 30 18.529 15.933 17.104 1.00 0.00 H ATOM 1660 HD2 ARG B 30 17.543 18.113 15.228 1.00 0.00 H ATOM 1661 HD3 ARG B 30 17.939 16.446 14.749 1.00 0.00 H ATOM 1662 HE ARG B 30 20.212 16.906 14.928 1.00 0.00 H ATOM 1663 HH12 ARG B 30 19.730 20.762 16.208 1.00 0.00 H ATOM 1664 HH11 ARG B 30 18.273 19.703 16.167 1.00 0.00 H ATOM 1665 HH22 ARG B 30 21.769 19.903 15.521 1.00 0.00 H ATOM 1666 HH21 ARG B 30 21.866 18.193 14.962 1.00 0.00 H ATOM 1667 H ARG B 30 17.170 14.005 17.547 1.00 0.00 H ATOM 1668 N HIS B 31 13.867 14.907 17.505 1.00 3.60 N ATOM 1669 CA HIS B 31 12.425 14.938 17.367 1.00 4.00 C ATOM 1670 C HIS B 31 11.654 14.154 18.408 1.00 4.40 C ATOM 1671 O HIS B 31 10.514 14.514 18.693 1.00 5.87 O ATOM 1672 CB HIS B 31 12.027 14.488 15.949 1.00 4.37 C ATOM 1673 CG HIS B 31 12.501 15.469 14.931 1.00 3.74 C ATOM 1674 ND1 HIS B 31 11.822 16.629 14.637 1.00 4.97 N ATOM 1675 CD2 HIS B 31 13.635 15.483 14.180 1.00 3.55 C ATOM 1676 CE1 HIS B 31 12.543 17.287 13.737 1.00 5.30 C ATOM 1677 NE2 HIS B 31 13.637 16.616 13.425 1.00 4.36 N ATOM 1678 HA HIS B 31 12.141 15.976 17.539 1.00 0.00 H ATOM 1679 HB2 HIS B 31 12.474 13.515 15.744 1.00 0.00 H ATOM 1680 HB3 HIS B 31 10.942 14.408 15.890 1.00 0.00 H ATOM 1681 HD2 HIS B 31 14.411 14.717 14.182 1.00 0.00 H ATOM 1682 HE1 HIS B 31 12.269 18.253 13.312 1.00 0.00 H ATOM 1683 H HIS B 31 14.405 14.219 16.940 1.00 0.00 H ATOM 1684 N LEU B 32 12.221 13.083 18.943 1.00 3.68 N ATOM 1685 CA LEU B 32 11.513 12.240 19.902 1.00 3.86 C ATOM 1686 C LEU B 32 12.051 12.380 21.298 1.00 4.22 C ATOM 1687 O LEU B 32 11.616 11.651 22.198 1.00 6.34 O ATOM 1688 CB LEU B 32 11.500 10.788 19.428 1.00 5.40 C ATOM 1689 CG LEU B 32 10.906 10.521 18.040 1.00 5.94 C ATOM 1690 CD1 LEU B 32 10.937 9.028 17.746 1.00 7.69 C ATOM 1691 CD2 LEU B 32 9.487 11.039 17.929 1.00 6.30 C ATOM 1692 HA LEU B 32 10.481 12.586 19.949 1.00 0.00 H ATOM 1693 HB2 LEU B 32 12.531 10.434 19.420 1.00 0.00 H ATOM 1694 HB3 LEU B 32 10.924 10.210 20.151 1.00 0.00 H ATOM 1695 HG LEU B 32 11.512 11.054 17.308 1.00 0.00 H ATOM 1696 HD21 LEU B 32 8.862 10.544 18.672 1.00 0.00 H ATOM 1697 HD22 LEU B 32 9.479 12.115 18.105 1.00 0.00 H ATOM 1698 HD23 LEU B 32 9.102 10.830 16.931 1.00 0.00 H ATOM 1699 HD11 LEU B 32 11.968 8.675 17.772 1.00 0.00 H ATOM 1700 HD12 LEU B 32 10.351 8.499 18.498 1.00 0.00 H ATOM 1701 HD13 LEU B 32 10.514 8.845 16.758 1.00 0.00 H ATOM 1702 H LEU B 32 13.195 12.837 18.673 1.00 0.00 H ATOM 1703 N ASN B 33 13.031 13.238 21.540 1.00 4.61 N ATOM 1704 CA ASN B 33 13.611 13.474 22.856 1.00 5.94 C ATOM 1705 C ASN B 33 14.205 12.200 23.438 1.00 5.66 C ATOM 1706 O ASN B 33 14.156 11.948 24.646 1.00 8.13 O ATOM 1707 CB ASN B 33 12.551 14.070 23.813 1.00 7.69 C ATOM 1708 CG ASN B 33 13.193 14.745 24.999 1.00 10.50 C ATOM 1709 OD1 ASN B 33 14.304 15.265 24.879 1.00 11.77 O ATOM 1710 ND2 ASN B 33 12.540 14.736 26.157 1.00 12.38 N ATOM 1711 HA ASN B 33 14.422 14.193 22.741 1.00 0.00 H ATOM 1712 HB2 ASN B 33 11.954 14.802 23.269 1.00 0.00 H ATOM 1713 HB3 ASN B 33 11.904 13.268 24.169 1.00 0.00 H ATOM 1714 HD22 ASN B 33 11.604 14.288 26.223 1.00 0.00 H ATOM 1715 HD21 ASN B 33 12.965 15.177 26.997 1.00 0.00 H ATOM 1716 H ASN B 33 13.412 13.779 20.738 1.00 0.00 H ATOM 1717 N SER B 34 14.777 11.373 22.585 1.00 4.28 N ATOM 1718 CA SER B 34 15.299 10.080 22.981 1.00 3.73 C ATOM 1719 C SER B 34 16.745 10.092 23.435 1.00 3.41 C ATOM 1720 O SER B 34 17.518 11.006 23.113 1.00 3.47 O ATOM 1721 CB SER B 34 15.175 9.166 21.747 1.00 4.00 C ATOM 1722 OG SER B 34 15.611 7.855 22.026 1.00 4.43 O ATOM 1723 HA SER B 34 14.727 9.738 23.844 1.00 0.00 H ATOM 1724 HB2 SER B 34 15.782 9.577 20.940 1.00 0.00 H ATOM 1725 HB3 SER B 34 14.131 9.133 21.434 1.00 0.00 H ATOM 1726 HG SER B 34 16.561 7.877 22.305 1.00 0.00 H ATOM 1727 H SER B 34 14.857 11.660 21.589 1.00 0.00 H ATOM 1728 N LYS B 35 17.094 9.081 24.233 1.00 3.47 N ATOM 1729 CA LYS B 35 18.475 8.870 24.628 1.00 4.54 C ATOM 1730 C LYS B 35 19.098 7.937 23.592 1.00 4.00 C ATOM 1731 O LYS B 35 18.405 7.101 22.977 1.00 4.22 O ATOM 1732 CB LYS B 35 18.548 8.265 26.016 1.00 5.73 C ATOM 1733 CG LYS B 35 17.962 9.095 27.149 1.00 6.91 C ATOM 1734 CD LYS B 35 18.441 10.540 27.200 1.00 9.69 C ATOM 1735 CE LYS B 35 17.915 11.223 28.471 1.00 12.24 C ATOM 1736 NZ LYS B 35 18.288 12.660 28.502 1.00 15.47 N ATOM 1737 HA LYS B 35 19.016 9.815 24.666 1.00 0.00 H ATOM 1738 HB2 LYS B 35 18.016 7.314 25.992 1.00 0.00 H ATOM 1739 HB3 LYS B 35 19.599 8.086 26.245 1.00 0.00 H ATOM 1740 HG2 LYS B 35 16.878 9.101 27.039 1.00 0.00 H ATOM 1741 HG3 LYS B 35 18.227 8.617 28.092 1.00 0.00 H ATOM 1742 HD2 LYS B 35 19.531 10.559 27.204 1.00 0.00 H ATOM 1743 HD3 LYS B 35 18.073 11.074 26.324 1.00 0.00 H ATOM 1744 HE2 LYS B 35 18.339 10.726 29.344 1.00 0.00 H ATOM 1745 HE3 LYS B 35 16.829 11.137 28.498 1.00 0.00 H ATOM 1746 HZ1 LYS B 35 19.324 12.748 28.482 1.00 0.00 H ATOM 1747 HZ2 LYS B 35 17.881 13.140 27.674 1.00 0.00 H ATOM 1748 HZ3 LYS B 35 17.919 13.094 29.372 1.00 0.00 H ATOM 1749 H LYS B 35 16.361 8.430 24.580 1.00 0.00 H ATOM 1750 N ASP B 36 20.407 8.015 23.430 1.00 3.06 N ATOM 1751 CA ASP B 36 21.135 7.140 22.503 1.00 2.82 C ATOM 1752 C ASP B 36 20.907 5.667 22.786 1.00 2.93 C ATOM 1753 O ASP B 36 20.677 4.891 21.830 1.00 2.46 O ATOM 1754 CB ASP B 36 22.629 7.476 22.582 1.00 2.82 C ATOM 1755 CG ASP B 36 23.454 6.537 21.717 1.00 3.39 C ATOM 1756 OD1 ASP B 36 23.364 6.685 20.490 1.00 3.86 O ATOM 1757 OD2 ASP B 36 24.136 5.657 22.266 1.00 6.51 O ATOM 1758 HA ASP B 36 20.755 7.320 21.497 1.00 0.00 H ATOM 1759 HB2 ASP B 36 22.781 8.500 22.240 1.00 0.00 H ATOM 1760 HB3 ASP B 36 22.959 7.387 23.617 1.00 0.00 H ATOM 1761 H ASP B 36 20.940 8.720 23.978 1.00 0.00 H ATOM 1762 N SER B 37 20.946 5.242 24.048 1.00 2.79 N ATOM 1763 CA SER B 37 20.801 3.819 24.354 1.00 2.64 C ATOM 1764 C SER B 37 19.455 3.228 23.991 1.00 2.81 C ATOM 1765 O SER B 37 19.344 2.013 23.787 1.00 3.92 O ATOM 1766 CB SER B 37 21.074 3.581 25.840 1.00 2.57 C ATOM 1767 OG SER B 37 20.093 4.269 26.595 1.00 3.35 O ATOM 1768 HA SER B 37 21.533 3.308 23.728 1.00 0.00 H ATOM 1769 HB2 SER B 37 22.065 3.956 26.096 1.00 0.00 H ATOM 1770 HB3 SER B 37 21.023 2.514 26.057 1.00 0.00 H ATOM 1771 HG SER B 37 20.259 4.123 27.560 1.00 0.00 H ATOM 1772 H SER B 37 21.080 5.926 24.820 1.00 0.00 H ATOM 1773 N SER B 38 18.418 4.035 23.839 1.00 2.57 N ATOM 1774 CA SER B 38 17.092 3.573 23.489 1.00 2.58 C ATOM 1775 C SER B 38 16.905 3.298 22.003 1.00 2.27 C ATOM 1776 O SER B 38 15.863 2.767 21.641 1.00 2.29 O ATOM 1777 CB SER B 38 16.076 4.687 23.829 1.00 2.50 C ATOM 1778 OG SER B 38 16.201 5.061 25.184 1.00 2.63 O ATOM 1779 HA SER B 38 16.945 2.646 24.043 1.00 0.00 H ATOM 1780 HB2 SER B 38 15.065 4.321 23.648 1.00 0.00 H ATOM 1781 HB3 SER B 38 16.266 5.554 23.196 1.00 0.00 H ATOM 1782 HG SER B 38 15.546 5.774 25.390 1.00 0.00 H ATOM 1783 H SER B 38 18.563 5.055 23.978 1.00 0.00 H ATOM 1784 N ILE B 39 17.878 3.687 21.186 1.00 2.28 N ATOM 1785 CA ILE B 39 17.721 3.585 19.735 1.00 2.75 C ATOM 1786 C ILE B 39 18.422 2.401 19.126 1.00 2.70 C ATOM 1787 O ILE B 39 19.593 2.102 19.362 1.00 3.00 O ATOM 1788 CB ILE B 39 18.286 4.905 19.133 1.00 2.93 C ATOM 1789 CG1 ILE B 39 17.531 6.142 19.660 1.00 3.29 C ATOM 1790 CG2 ILE B 39 18.280 4.871 17.612 1.00 2.79 C ATOM 1791 CD1 ILE B 39 18.240 7.460 19.389 1.00 4.09 C ATOM 1792 HA ILE B 39 16.665 3.438 19.509 1.00 0.00 H ATOM 1793 HB ILE B 39 19.322 4.987 19.461 1.00 0.00 H ATOM 1794 HG12 ILE B 39 16.551 6.175 19.183 1.00 0.00 H ATOM 1795 HG13 ILE B 39 17.406 6.035 20.737 1.00 0.00 H ATOM 1796 HD11 ILE B 39 19.218 7.450 19.869 1.00 0.00 H ATOM 1797 HD12 ILE B 39 18.363 7.591 18.314 1.00 0.00 H ATOM 1798 HD13 ILE B 39 17.645 8.280 19.790 1.00 0.00 H ATOM 1799 HG21 ILE B 39 18.897 4.041 17.266 1.00 0.00 H ATOM 1800 HG22 ILE B 39 17.258 4.739 17.257 1.00 0.00 H ATOM 1801 HG23 ILE B 39 18.681 5.809 17.227 1.00 0.00 H ATOM 1802 H ILE B 39 18.761 4.068 21.582 1.00 0.00 H ATOM 1803 N SER B 40 17.655 1.705 18.276 1.00 2.45 N ATOM 1804 CA SER B 40 18.169 0.604 17.462 1.00 2.85 C ATOM 1805 C SER B 40 17.736 0.850 16.020 1.00 2.61 C ATOM 1806 O SER B 40 16.689 1.470 15.777 1.00 2.74 O ATOM 1807 CB SER B 40 17.675 -0.746 17.943 1.00 2.72 C ATOM 1808 OG SER B 40 16.290 -0.765 18.143 1.00 2.66 O ATOM 1809 HA SER B 40 19.256 0.577 17.543 1.00 0.00 H ATOM 1810 HB2 SER B 40 18.169 -0.985 18.885 1.00 0.00 H ATOM 1811 HB3 SER B 40 17.932 -1.499 17.198 1.00 0.00 H ATOM 1812 HG SER B 40 16.047 -0.089 18.824 1.00 0.00 H ATOM 1813 H SER B 40 16.650 1.959 18.191 1.00 0.00 H ATOM 1814 N ILE B 41 18.589 0.442 15.069 1.00 2.67 N ATOM 1815 CA ILE B 41 18.326 0.725 13.659 1.00 2.84 C ATOM 1816 C ILE B 41 18.673 -0.500 12.815 1.00 2.49 C ATOM 1817 O ILE B 41 19.765 -1.043 12.897 1.00 2.75 O ATOM 1818 CB ILE B 41 19.119 1.954 13.149 1.00 2.67 C ATOM 1819 CG1 ILE B 41 18.914 3.192 14.019 1.00 2.83 C ATOM 1820 CG2 ILE B 41 18.749 2.246 11.695 1.00 2.57 C ATOM 1821 CD1 ILE B 41 19.861 4.332 13.728 1.00 3.01 C ATOM 1822 HA ILE B 41 17.266 0.958 13.564 1.00 0.00 H ATOM 1823 HB ILE B 41 20.178 1.705 13.211 1.00 0.00 H ATOM 1824 HG12 ILE B 41 17.895 3.549 13.867 1.00 0.00 H ATOM 1825 HG13 ILE B 41 19.044 2.900 15.061 1.00 0.00 H ATOM 1826 HD11 ILE B 41 20.887 4.000 13.888 1.00 0.00 H ATOM 1827 HD12 ILE B 41 19.738 4.650 12.693 1.00 0.00 H ATOM 1828 HD13 ILE B 41 19.639 5.166 14.394 1.00 0.00 H ATOM 1829 HG21 ILE B 41 18.992 1.380 11.079 1.00 0.00 H ATOM 1830 HG22 ILE B 41 17.681 2.454 11.628 1.00 0.00 H ATOM 1831 HG23 ILE B 41 19.311 3.112 11.345 1.00 0.00 H ATOM 1832 H ILE B 41 19.447 -0.081 15.337 1.00 0.00 H ATOM 1833 N ALA B 42 17.721 -0.915 12.010 1.00 2.74 N ATOM 1834 CA ALA B 42 17.894 -2.022 11.076 1.00 2.95 C ATOM 1835 C ALA B 42 17.887 -1.483 9.644 1.00 2.75 C ATOM 1836 O ALA B 42 17.179 -0.517 9.354 1.00 4.09 O ATOM 1837 CB ALA B 42 16.766 -3.037 11.153 1.00 3.30 C ATOM 1838 HA ALA B 42 18.835 -2.504 11.342 1.00 0.00 H ATOM 1839 HB1 ALA B 42 16.721 -3.453 12.160 1.00 0.00 H ATOM 1840 HB2 ALA B 42 15.821 -2.547 10.919 1.00 0.00 H ATOM 1841 HB3 ALA B 42 16.949 -3.837 10.436 1.00 0.00 H ATOM 1842 H ALA B 42 16.801 -0.431 12.040 1.00 0.00 H ATOM 1843 N LEU B 43 18.662 -2.103 8.759 1.00 3.68 N ATOM 1844 CA LEU B 43 18.693 -1.765 7.332 1.00 3.82 C ATOM 1845 C LEU B 43 18.508 -3.094 6.594 1.00 4.37 C ATOM 1846 O LEU B 43 19.344 -3.997 6.683 1.00 6.72 O ATOM 1847 CB LEU B 43 19.991 -1.102 6.931 1.00 5.75 C ATOM 1848 CG LEU B 43 20.249 -0.763 5.463 1.00 7.54 C ATOM 1849 CD1 LEU B 43 19.320 0.333 5.011 1.00 8.62 C ATOM 1850 CD2 LEU B 43 21.692 -0.287 5.290 1.00 9.39 C ATOM 1851 HA LEU B 43 17.912 -1.046 7.086 1.00 0.00 H ATOM 1852 HB2 LEU B 43 20.053 -0.166 7.487 1.00 0.00 H ATOM 1853 HB3 LEU B 43 20.796 -1.765 7.248 1.00 0.00 H ATOM 1854 HG LEU B 43 20.076 -1.657 4.864 1.00 0.00 H ATOM 1855 HD21 LEU B 43 21.856 0.601 5.901 1.00 0.00 H ATOM 1856 HD22 LEU B 43 22.374 -1.077 5.604 1.00 0.00 H ATOM 1857 HD23 LEU B 43 21.871 -0.047 4.242 1.00 0.00 H ATOM 1858 HD11 LEU B 43 18.288 0.003 5.125 1.00 0.00 H ATOM 1859 HD12 LEU B 43 19.487 1.223 5.618 1.00 0.00 H ATOM 1860 HD13 LEU B 43 19.515 0.564 3.964 1.00 0.00 H ATOM 1861 H LEU B 43 19.279 -2.869 9.097 1.00 0.00 H ATOM 1862 N GLN B 44 17.357 -3.217 5.942 1.00 4.13 N ATOM 1863 CA GLN B 44 17.033 -4.455 5.239 1.00 4.67 C ATOM 1864 C GLN B 44 16.933 -4.203 3.738 1.00 5.05 C ATOM 1865 O GLN B 44 16.135 -3.383 3.290 1.00 5.55 O ATOM 1866 CB GLN B 44 15.708 -5.020 5.761 1.00 5.83 C ATOM 1867 CG GLN B 44 15.706 -5.354 7.244 1.00 7.79 C ATOM 1868 CD GLN B 44 14.467 -6.080 7.694 1.00 9.37 C ATOM 1869 OE1 GLN B 44 13.578 -5.635 8.414 1.00 10.55 O ATOM 1870 NE2 GLN B 44 14.377 -7.327 7.238 1.00 11.17 N ATOM 1871 HA GLN B 44 17.828 -5.178 5.421 1.00 0.00 H ATOM 1872 HB2 GLN B 44 14.927 -4.282 5.577 1.00 0.00 H ATOM 1873 HB3 GLN B 44 15.484 -5.931 5.206 1.00 0.00 H ATOM 1874 HG2 GLN B 44 16.571 -5.982 7.458 1.00 0.00 H ATOM 1875 HG3 GLN B 44 15.785 -4.424 7.807 1.00 0.00 H ATOM 1876 HE22 GLN B 44 15.125 -7.713 6.627 1.00 0.00 H ATOM 1877 HE21 GLN B 44 13.558 -7.916 7.492 1.00 0.00 H ATOM 1878 H GLN B 44 16.682 -2.426 5.932 1.00 0.00 H ATOM 1879 N GLN B 45 17.740 -4.943 2.999 1.00 4.94 N ATOM 1880 CA GLN B 45 17.742 -4.873 1.544 1.00 5.57 C ATOM 1881 C GLN B 45 16.657 -5.788 0.993 1.00 5.02 C ATOM 1882 O GLN B 45 16.505 -6.957 1.367 1.00 5.20 O ATOM 1883 CB GLN B 45 19.131 -5.200 0.997 1.00 7.70 C ATOM 1884 CG GLN B 45 20.067 -4.037 1.327 1.00 9.59 C ATOM 1885 CD GLN B 45 21.443 -4.185 0.717 1.00 11.36 C ATOM 1886 OE1 GLN B 45 21.606 -4.731 -0.377 1.00 11.02 O ATOM 1887 NE2 GLN B 45 22.436 -3.681 1.442 1.00 12.57 N ATOM 1888 HA GLN B 45 17.513 -3.859 1.216 1.00 0.00 H ATOM 1889 HB2 GLN B 45 19.503 -6.114 1.459 1.00 0.00 H ATOM 1890 HB3 GLN B 45 19.079 -5.336 -0.083 1.00 0.00 H ATOM 1891 HG2 GLN B 45 19.620 -3.116 0.953 1.00 0.00 H ATOM 1892 HG3 GLN B 45 20.173 -3.975 2.410 1.00 0.00 H ATOM 1893 HE22 GLN B 45 22.235 -3.232 2.358 1.00 0.00 H ATOM 1894 HE21 GLN B 45 23.414 -3.736 1.093 1.00 0.00 H ATOM 1895 H GLN B 45 18.396 -5.597 3.472 1.00 0.00 H ATOM 1896 N ILE B 46 15.836 -5.183 0.140 1.00 4.55 N ATOM 1897 CA ILE B 46 14.707 -5.897 -0.440 1.00 4.52 C ATOM 1898 C ILE B 46 14.875 -5.979 -1.950 1.00 5.09 C ATOM 1899 O ILE B 46 15.061 -4.943 -2.597 1.00 4.80 O ATOM 1900 CB ILE B 46 13.394 -5.145 -0.119 1.00 4.67 C ATOM 1901 CG1 ILE B 46 13.211 -4.882 1.377 1.00 5.63 C ATOM 1902 CG2 ILE B 46 12.186 -5.893 -0.671 1.00 5.00 C ATOM 1903 CD1 ILE B 46 13.102 -6.098 2.270 1.00 7.09 C ATOM 1904 HA ILE B 46 14.667 -6.902 -0.019 1.00 0.00 H ATOM 1905 HB ILE B 46 13.470 -4.175 -0.611 1.00 0.00 H ATOM 1906 HG12 ILE B 46 14.066 -4.297 1.717 1.00 0.00 H ATOM 1907 HG13 ILE B 46 12.299 -4.297 1.501 1.00 0.00 H ATOM 1908 HD11 ILE B 46 12.242 -6.695 1.965 1.00 0.00 H ATOM 1909 HD12 ILE B 46 14.010 -6.695 2.182 1.00 0.00 H ATOM 1910 HD13 ILE B 46 12.975 -5.778 3.304 1.00 0.00 H ATOM 1911 HG21 ILE B 46 12.281 -5.985 -1.753 1.00 0.00 H ATOM 1912 HG22 ILE B 46 12.139 -6.886 -0.223 1.00 0.00 H ATOM 1913 HG23 ILE B 46 11.277 -5.341 -0.430 1.00 0.00 H ATOM 1914 H ILE B 46 16.002 -4.189 -0.116 1.00 0.00 H ATOM 1915 N GLN B 47 14.784 -7.168 -2.528 1.00 5.58 N ATOM 1916 CA GLN B 47 14.920 -7.264 -3.987 1.00 6.00 C ATOM 1917 C GLN B 47 13.738 -6.569 -4.632 1.00 5.70 C ATOM 1918 O GLN B 47 12.634 -6.596 -4.091 1.00 5.87 O ATOM 1919 CB GLN B 47 14.937 -8.728 -4.411 1.00 7.75 C ATOM 1920 CG GLN B 47 16.048 -9.571 -3.822 1.00 9.45 C ATOM 1921 CD GLN B 47 17.418 -9.069 -4.211 1.00 12.08 C ATOM 1922 OE1 GLN B 47 17.672 -8.734 -5.371 1.00 13.47 O ATOM 1923 NE2 GLN B 47 18.325 -8.999 -3.247 1.00 13.97 N ATOM 1924 HA GLN B 47 15.851 -6.792 -4.300 1.00 0.00 H ATOM 1925 HB2 GLN B 47 13.987 -9.173 -4.116 1.00 0.00 H ATOM 1926 HB3 GLN B 47 15.031 -8.761 -5.496 1.00 0.00 H ATOM 1927 HG2 GLN B 47 15.963 -9.553 -2.735 1.00 0.00 H ATOM 1928 HG3 GLN B 47 15.936 -10.596 -4.177 1.00 0.00 H ATOM 1929 HE22 GLN B 47 18.079 -9.289 -2.279 1.00 0.00 H ATOM 1930 HE21 GLN B 47 19.283 -8.654 -3.458 1.00 0.00 H ATOM 1931 H GLN B 47 14.619 -8.021 -1.956 1.00 0.00 H ATOM 1932 N PRO B 48 13.898 -6.037 -5.834 1.00 6.33 N ATOM 1933 CA PRO B 48 12.823 -5.301 -6.485 1.00 7.36 C ATOM 1934 C PRO B 48 11.548 -6.090 -6.623 1.00 8.04 C ATOM 1935 O PRO B 48 10.449 -5.586 -6.384 1.00 8.47 O ATOM 1936 CB PRO B 48 13.380 -4.929 -7.846 1.00 7.61 C ATOM 1937 CG PRO B 48 14.843 -4.810 -7.587 1.00 8.47 C ATOM 1938 CD PRO B 48 15.170 -5.885 -6.574 1.00 7.25 C ATOM 1939 HA PRO B 48 12.538 -4.436 -5.887 1.00 0.00 H ATOM 1940 HD3 PRO B 48 15.452 -6.816 -7.066 1.00 0.00 H ATOM 1941 HD2 PRO B 48 15.975 -5.568 -5.911 1.00 0.00 H ATOM 1942 HG3 PRO B 48 15.079 -3.825 -7.185 1.00 0.00 H ATOM 1943 HG2 PRO B 48 15.406 -4.970 -8.506 1.00 0.00 H ATOM 1944 HB2 PRO B 48 13.174 -5.707 -8.580 1.00 0.00 H ATOM 1945 HB3 PRO B 48 12.965 -3.983 -8.195 1.00 0.00 H ATOM 1946 N GLU B 49 11.663 -7.374 -6.964 1.00 8.09 N ATOM 1947 CA GLU B 49 10.498 -8.232 -7.128 1.00 8.68 C ATOM 1948 C GLU B 49 9.795 -8.545 -5.824 1.00 8.21 C ATOM 1949 O GLU B 49 8.714 -9.135 -5.836 1.00 9.05 O ATOM 1950 CB GLU B 49 10.907 -9.498 -7.891 1.00 9.35 C ATOM 1951 CG GLU B 49 11.914 -10.353 -7.160 1.00 10.11 C ATOM 1952 CD GLU B 49 13.377 -10.030 -7.346 1.00 11.16 C ATOM 1953 OE1 GLU B 49 13.743 -8.954 -7.857 1.00 10.18 O ATOM 1954 OE2 GLU B 49 14.205 -10.910 -6.976 1.00 12.78 O ATOM 1955 HA GLU B 49 9.757 -7.687 -7.714 1.00 0.00 H ATOM 1956 HB2 GLU B 49 10.013 -10.096 -8.069 1.00 0.00 H ATOM 1957 HB3 GLU B 49 11.339 -9.199 -8.846 1.00 0.00 H ATOM 1958 HG2 GLU B 49 11.696 -10.274 -6.095 1.00 0.00 H ATOM 1959 HG3 GLU B 49 11.764 -11.383 -7.485 1.00 0.00 H ATOM 1960 H GLU B 49 12.611 -7.774 -7.117 1.00 0.00 H ATOM 1961 N SER B 50 10.334 -8.159 -4.667 1.00 7.46 N ATOM 1962 CA SER B 50 9.696 -8.326 -3.380 1.00 7.79 C ATOM 1963 C SER B 50 9.156 -7.013 -2.816 1.00 6.85 C ATOM 1964 O SER B 50 8.600 -6.986 -1.717 1.00 7.53 O ATOM 1965 CB SER B 50 10.687 -8.957 -2.397 1.00 10.11 C ATOM 1966 OG SER B 50 11.073 -10.234 -2.930 1.00 13.39 O ATOM 1967 HA SER B 50 8.838 -8.983 -3.521 1.00 0.00 H ATOM 1968 HB2 SER B 50 10.214 -9.088 -1.424 1.00 0.00 H ATOM 1969 HB3 SER B 50 11.564 -8.318 -2.290 1.00 0.00 H ATOM 1970 HG SER B 50 11.716 -10.667 -2.314 1.00 0.00 H ATOM 1971 H SER B 50 11.272 -7.710 -4.692 1.00 0.00 H ATOM 1972 N TRP B 51 9.275 -5.907 -3.551 1.00 5.38 N ATOM 1973 CA TRP B 51 8.817 -4.601 -3.078 1.00 4.13 C ATOM 1974 C TRP B 51 7.306 -4.488 -3.050 1.00 4.56 C ATOM 1975 O TRP B 51 6.747 -3.876 -2.138 1.00 5.32 O ATOM 1976 CB TRP B 51 9.406 -3.452 -3.922 1.00 4.21 C ATOM 1977 CG TRP B 51 9.278 -2.148 -3.179 1.00 3.64 C ATOM 1978 CD1 TRP B 51 8.339 -1.183 -3.379 1.00 3.97 C ATOM 1979 CD2 TRP B 51 10.096 -1.708 -2.089 1.00 3.70 C ATOM 1980 NE1 TRP B 51 8.536 -0.166 -2.473 1.00 3.87 N ATOM 1981 CE2 TRP B 51 9.604 -0.464 -1.681 1.00 3.85 C ATOM 1982 CE3 TRP B 51 11.208 -2.269 -1.452 1.00 4.19 C ATOM 1983 CZ2 TRP B 51 10.185 0.252 -0.645 1.00 3.88 C ATOM 1984 CZ3 TRP B 51 11.776 -1.562 -0.404 1.00 3.82 C ATOM 1985 CH2 TRP B 51 11.272 -0.306 -0.035 1.00 4.48 C ATOM 1986 HA TRP B 51 9.180 -4.513 -2.054 1.00 0.00 H ATOM 1987 HB2 TRP B 51 10.459 -3.653 -4.121 1.00 0.00 H ATOM 1988 HB3 TRP B 51 8.866 -3.384 -4.866 1.00 0.00 H ATOM 1989 HE1 TRP B 51 7.959 0.696 -2.404 1.00 0.00 H ATOM 1990 HD1 TRP B 51 7.556 -1.211 -4.136 1.00 0.00 H ATOM 1991 HZ2 TRP B 51 9.791 1.219 -0.331 1.00 0.00 H ATOM 1992 HH2 TRP B 51 11.765 0.244 0.767 1.00 0.00 H ATOM 1993 HZ3 TRP B 51 12.622 -1.986 0.138 1.00 0.00 H ATOM 1994 HE3 TRP B 51 11.614 -3.230 -1.769 1.00 0.00 H ATOM 1995 H TRP B 51 9.709 -5.975 -4.494 1.00 0.00 H ATOM 1996 N GLN B 52 6.589 -5.151 -3.966 1.00 5.17 N ATOM 1997 CA GLN B 52 5.132 -5.150 -3.936 1.00 5.94 C ATOM 1998 C GLN B 52 4.581 -5.621 -2.598 1.00 6.03 C ATOM 1999 O GLN B 52 3.610 -5.060 -2.082 1.00 7.04 O ATOM 2000 CB GLN B 52 4.591 -6.015 -5.089 1.00 6.24 C ATOM 2001 CG GLN B 52 3.079 -5.999 -5.213 1.00 7.80 C ATOM 2002 CD GLN B 52 2.529 -4.720 -5.760 1.00 8.80 C ATOM 2003 OE1 GLN B 52 2.922 -4.237 -6.826 1.00 10.50 O ATOM 2004 NE2 GLN B 52 1.585 -4.124 -5.032 1.00 10.11 N ATOM 2005 HA GLN B 52 4.794 -4.122 -4.065 1.00 0.00 H ATOM 2006 HB2 GLN B 52 5.016 -5.647 -6.023 1.00 0.00 H ATOM 2007 HB3 GLN B 52 4.911 -7.044 -4.926 1.00 0.00 H ATOM 2008 HG2 GLN B 52 2.780 -6.812 -5.874 1.00 0.00 H ATOM 2009 HG3 GLN B 52 2.652 -6.161 -4.224 1.00 0.00 H ATOM 2010 HE22 GLN B 52 1.271 -4.551 -4.137 1.00 0.00 H ATOM 2011 HE21 GLN B 52 1.162 -3.232 -5.359 1.00 0.00 H ATOM 2012 H GLN B 52 7.082 -5.678 -4.715 1.00 0.00 H ATOM 2013 N ALA B 53 5.194 -6.635 -1.998 1.00 6.00 N ATOM 2014 CA ALA B 53 4.805 -7.140 -0.694 1.00 7.30 C ATOM 2015 C ALA B 53 4.957 -6.062 0.379 1.00 7.17 C ATOM 2016 O ALA B 53 4.119 -5.992 1.269 1.00 7.68 O ATOM 2017 CB ALA B 53 5.577 -8.397 -0.323 1.00 8.61 C ATOM 2018 HA ALA B 53 3.751 -7.413 -0.751 1.00 0.00 H ATOM 2019 HB1 ALA B 53 5.383 -9.173 -1.063 1.00 0.00 H ATOM 2020 HB2 ALA B 53 6.644 -8.173 -0.300 1.00 0.00 H ATOM 2021 HB3 ALA B 53 5.256 -8.742 0.660 1.00 0.00 H ATOM 2022 H ALA B 53 5.992 -7.089 -2.486 1.00 0.00 H ATOM 2023 N ILE B 54 6.000 -5.252 0.312 1.00 6.75 N ATOM 2024 CA ILE B 54 6.200 -4.166 1.263 1.00 6.77 C ATOM 2025 C ILE B 54 5.114 -3.115 1.059 1.00 6.05 C ATOM 2026 O ILE B 54 4.477 -2.635 1.994 1.00 6.70 O ATOM 2027 CB ILE B 54 7.601 -3.560 1.114 1.00 7.02 C ATOM 2028 CG1 ILE B 54 8.711 -4.582 1.352 1.00 7.60 C ATOM 2029 CG2 ILE B 54 7.756 -2.350 2.027 1.00 6.98 C ATOM 2030 CD1 ILE B 54 8.626 -5.384 2.621 1.00 8.73 C ATOM 2031 HA ILE B 54 6.126 -4.556 2.278 1.00 0.00 H ATOM 2032 HB ILE B 54 7.704 -3.232 0.080 1.00 0.00 H ATOM 2033 HG12 ILE B 54 8.701 -5.282 0.517 1.00 0.00 H ATOM 2034 HG13 ILE B 54 9.659 -4.045 1.363 1.00 0.00 H ATOM 2035 HD11 ILE B 54 8.653 -4.710 3.478 1.00 0.00 H ATOM 2036 HD12 ILE B 54 7.694 -5.949 2.630 1.00 0.00 H ATOM 2037 HD13 ILE B 54 9.470 -6.072 2.672 1.00 0.00 H ATOM 2038 HG21 ILE B 54 7.013 -1.598 1.761 1.00 0.00 H ATOM 2039 HG22 ILE B 54 7.609 -2.657 3.063 1.00 0.00 H ATOM 2040 HG23 ILE B 54 8.756 -1.933 1.908 1.00 0.00 H ATOM 2041 H ILE B 54 6.700 -5.395 -0.444 1.00 0.00 H ATOM 2042 N TRP B 55 4.880 -2.771 -0.213 1.00 5.20 N ATOM 2043 CA TRP B 55 3.810 -1.825 -0.539 1.00 5.04 C ATOM 2044 C TRP B 55 2.465 -2.280 0.019 1.00 5.67 C ATOM 2045 O TRP B 55 1.730 -1.551 0.677 1.00 5.41 O ATOM 2046 CB TRP B 55 3.749 -1.630 -2.055 1.00 5.43 C ATOM 2047 CG TRP B 55 2.604 -0.775 -2.509 1.00 4.89 C ATOM 2048 CD1 TRP B 55 1.335 -1.187 -2.812 1.00 5.72 C ATOM 2049 CD2 TRP B 55 2.623 0.650 -2.705 1.00 5.18 C ATOM 2050 NE1 TRP B 55 0.560 -0.119 -3.162 1.00 6.58 N ATOM 2051 CE2 TRP B 55 1.320 1.015 -3.112 1.00 5.83 C ATOM 2052 CE3 TRP B 55 3.597 1.639 -2.586 1.00 5.05 C ATOM 2053 CZ2 TRP B 55 0.968 2.335 -3.401 1.00 6.22 C ATOM 2054 CZ3 TRP B 55 3.245 2.949 -2.880 1.00 5.25 C ATOM 2055 CH2 TRP B 55 1.940 3.286 -3.255 1.00 6.13 C ATOM 2056 HA TRP B 55 4.034 -0.868 -0.067 1.00 0.00 H ATOM 2057 HB2 TRP B 55 4.678 -1.161 -2.379 1.00 0.00 H ATOM 2058 HB3 TRP B 55 3.654 -2.609 -2.524 1.00 0.00 H ATOM 2059 HE1 TRP B 55 -0.446 -0.162 -3.424 1.00 0.00 H ATOM 2060 HD1 TRP B 55 0.992 -2.221 -2.779 1.00 0.00 H ATOM 2061 HZ2 TRP B 55 -0.038 2.596 -3.729 1.00 0.00 H ATOM 2062 HH2 TRP B 55 1.692 4.332 -3.435 1.00 0.00 H ATOM 2063 HZ3 TRP B 55 4.001 3.732 -2.817 1.00 0.00 H ATOM 2064 HE3 TRP B 55 4.610 1.390 -2.270 1.00 0.00 H ATOM 2065 H TRP B 55 5.461 -3.177 -0.974 1.00 0.00 H ATOM 2066 N ASP B 56 2.114 -3.539 -0.250 1.00 5.75 N ATOM 2067 CA ASP B 56 0.831 -4.081 0.162 1.00 7.01 C ATOM 2068 C ASP B 56 0.661 -4.188 1.673 1.00 7.58 C ATOM 2069 O ASP B 56 -0.468 -4.019 2.145 1.00 8.59 O ATOM 2070 CB ASP B 56 0.644 -5.482 -0.452 1.00 8.47 C ATOM 2071 CG ASP B 56 0.469 -5.457 -1.955 1.00 9.63 C ATOM 2072 OD1 ASP B 56 0.179 -4.417 -2.551 1.00 10.51 O ATOM 2073 OD2 ASP B 56 0.603 -6.566 -2.526 1.00 12.09 O ATOM 2074 HA ASP B 56 0.078 -3.379 -0.196 1.00 0.00 H ATOM 2075 HB2 ASP B 56 1.521 -6.084 -0.215 1.00 0.00 H ATOM 2076 HB3 ASP B 56 -0.240 -5.940 -0.008 1.00 0.00 H ATOM 2077 H ASP B 56 2.777 -4.149 -0.769 1.00 0.00 H ATOM 2078 N ALA B 57 1.729 -4.513 2.394 1.00 6.74 N ATOM 2079 CA ALA B 57 1.579 -4.682 3.826 1.00 8.47 C ATOM 2080 C ALA B 57 1.839 -3.446 4.656 1.00 8.67 C ATOM 2081 O ALA B 57 1.248 -3.281 5.731 1.00 11.28 O ATOM 2082 CB ALA B 57 2.567 -5.767 4.308 1.00 9.04 C ATOM 2083 HA ALA B 57 0.532 -4.947 3.971 1.00 0.00 H ATOM 2084 HB1 ALA B 57 2.349 -6.707 3.801 1.00 0.00 H ATOM 2085 HB2 ALA B 57 3.586 -5.457 4.078 1.00 0.00 H ATOM 2086 HB3 ALA B 57 2.461 -5.901 5.385 1.00 0.00 H ATOM 2087 H ALA B 57 2.655 -4.644 1.939 1.00 0.00 H ATOM 2088 N GLU B 58 2.778 -2.594 4.235 1.00 7.84 N ATOM 2089 CA GLU B 58 3.205 -1.456 5.026 1.00 7.37 C ATOM 2090 C GLU B 58 2.830 -0.077 4.514 1.00 7.13 C ATOM 2091 O GLU B 58 2.666 0.868 5.300 1.00 7.44 O ATOM 2092 CB GLU B 58 4.746 -1.471 5.129 1.00 7.42 C ATOM 2093 CG GLU B 58 5.421 -2.681 5.725 1.00 7.31 C ATOM 2094 CD GLU B 58 5.080 -2.956 7.168 1.00 7.07 C ATOM 2095 OE1 GLU B 58 4.801 -2.016 7.931 1.00 6.19 O ATOM 2096 OE2 GLU B 58 5.098 -4.148 7.552 1.00 8.42 O ATOM 2097 HA GLU B 58 2.677 -1.588 5.970 1.00 0.00 H ATOM 2098 HB2 GLU B 58 5.136 -1.351 4.118 1.00 0.00 H ATOM 2099 HB3 GLU B 58 5.036 -0.612 5.734 1.00 0.00 H ATOM 2100 HG2 GLU B 58 5.133 -3.553 5.137 1.00 0.00 H ATOM 2101 HG3 GLU B 58 6.499 -2.536 5.654 1.00 0.00 H ATOM 2102 H GLU B 58 3.219 -2.753 3.306 1.00 0.00 H ATOM 2103 N ILE B 59 2.678 0.099 3.212 1.00 6.50 N ATOM 2104 CA ILE B 59 2.486 1.427 2.641 1.00 5.73 C ATOM 2105 C ILE B 59 1.039 1.703 2.314 1.00 5.61 C ATOM 2106 O ILE B 59 0.409 2.585 2.906 1.00 7.59 O ATOM 2107 CB ILE B 59 3.440 1.632 1.447 1.00 5.10 C ATOM 2108 CG1 ILE B 59 4.890 1.356 1.841 1.00 6.16 C ATOM 2109 CG2 ILE B 59 3.253 3.049 0.898 1.00 6.82 C ATOM 2110 CD1 ILE B 59 5.919 1.422 0.739 1.00 5.95 C ATOM 2111 HA ILE B 59 2.747 2.172 3.392 1.00 0.00 H ATOM 2112 HB ILE B 59 3.197 0.918 0.660 1.00 0.00 H ATOM 2113 HG12 ILE B 59 5.171 2.087 2.599 1.00 0.00 H ATOM 2114 HG13 ILE B 59 4.930 0.355 2.271 1.00 0.00 H ATOM 2115 HD11 ILE B 59 5.676 0.686 -0.028 1.00 0.00 H ATOM 2116 HD12 ILE B 59 5.917 2.420 0.301 1.00 0.00 H ATOM 2117 HD13 ILE B 59 6.905 1.207 1.151 1.00 0.00 H ATOM 2118 HG21 ILE B 59 2.221 3.177 0.571 1.00 0.00 H ATOM 2119 HG22 ILE B 59 3.481 3.773 1.680 1.00 0.00 H ATOM 2120 HG23 ILE B 59 3.925 3.201 0.053 1.00 0.00 H ATOM 2121 H ILE B 59 2.696 -0.728 2.582 1.00 0.00 H ATOM 2122 N ALA B 60 0.457 0.930 1.401 1.00 6.03 N ATOM 2123 CA ALA B 60 -0.908 1.144 0.968 1.00 7.43 C ATOM 2124 C ALA B 60 -1.954 1.150 2.070 1.00 9.10 C ATOM 2125 O ALA B 60 -2.772 2.087 2.076 1.00 9.71 O ATOM 2126 CB ALA B 60 -1.300 0.176 -0.135 1.00 8.99 C ATOM 2127 HA ALA B 60 -0.903 2.162 0.579 1.00 0.00 H ATOM 2128 HB1 ALA B 60 -0.640 0.316 -0.991 1.00 0.00 H ATOM 2129 HB2 ALA B 60 -1.210 -0.846 0.232 1.00 0.00 H ATOM 2130 HB3 ALA B 60 -2.331 0.366 -0.434 1.00 0.00 H ATOM 2131 H ALA B 60 1.000 0.147 0.985 1.00 0.00 H ATOM 2132 N PRO B 61 -1.970 0.189 2.979 1.00 9.07 N ATOM 2133 CA PRO B 61 -3.002 0.172 4.001 1.00 10.04 C ATOM 2134 C PRO B 61 -2.876 1.260 5.045 1.00 10.33 C ATOM 2135 O PRO B 61 -3.877 1.568 5.705 1.00 12.73 O ATOM 2136 CB PRO B 61 -2.902 -1.209 4.629 1.00 10.74 C ATOM 2137 CG PRO B 61 -1.754 -1.909 4.042 1.00 10.90 C ATOM 2138 CD PRO B 61 -1.083 -0.975 3.074 1.00 9.73 C ATOM 2139 HA PRO B 61 -3.974 0.373 3.550 1.00 0.00 H ATOM 2140 HD3 PRO B 61 -0.103 -0.679 3.447 1.00 0.00 H ATOM 2141 HD2 PRO B 61 -0.971 -1.451 2.100 1.00 0.00 H ATOM 2142 HG3 PRO B 61 -2.094 -2.803 3.518 1.00 0.00 H ATOM 2143 HG2 PRO B 61 -1.054 -2.194 4.827 1.00 0.00 H ATOM 2144 HB2 PRO B 61 -2.763 -1.114 5.706 1.00 0.00 H ATOM 2145 HB3 PRO B 61 -3.815 -1.770 4.430 1.00 0.00 H ATOM 2146 N GLN B 62 -1.716 1.860 5.210 1.00 9.39 N ATOM 2147 CA GLN B 62 -1.432 2.906 6.172 1.00 9.75 C ATOM 2148 C GLN B 62 -1.300 4.273 5.476 1.00 7.66 C ATOM 2149 O GLN B 62 -0.806 5.211 6.108 1.00 7.05 O ATOM 2150 CB GLN B 62 -0.049 2.680 6.808 1.00 12.43 C ATOM 2151 CG GLN B 62 0.394 1.557 7.683 1.00 15.35 C ATOM 2152 CD GLN B 62 1.740 1.831 8.349 1.00 16.91 C ATOM 2153 OE1 GLN B 62 2.834 1.384 7.964 1.00 15.20 O ATOM 2154 NE2 GLN B 62 1.684 2.616 9.432 1.00 19.04 N ATOM 2155 HA GLN B 62 -2.246 2.886 6.897 1.00 0.00 H ATOM 2156 HB2 GLN B 62 0.641 2.659 5.964 1.00 0.00 H ATOM 2157 HB3 GLN B 62 0.130 3.577 7.401 1.00 0.00 H ATOM 2158 HG2 GLN B 62 -0.355 1.402 8.459 1.00 0.00 H ATOM 2159 HG3 GLN B 62 0.480 0.655 7.078 1.00 0.00 H ATOM 2160 HE22 GLN B 62 0.770 2.991 9.756 1.00 0.00 H ATOM 2161 HE21 GLN B 62 2.555 2.851 9.950 1.00 0.00 H ATOM 2162 H GLN B 62 -0.934 1.556 4.595 1.00 0.00 H ATOM 2163 N MET B 63 -1.665 4.403 4.208 1.00 6.59 N ATOM 2164 CA MET B 63 -1.344 5.595 3.432 1.00 6.04 C ATOM 2165 C MET B 63 -1.649 6.911 4.113 1.00 6.56 C ATOM 2166 O MET B 63 -0.744 7.761 4.210 1.00 5.91 O ATOM 2167 CB MET B 63 -1.955 5.550 2.028 1.00 6.38 C ATOM 2168 CG MET B 63 -1.448 6.637 1.098 1.00 6.79 C ATOM 2169 SD MET B 63 0.246 6.377 0.528 1.00 5.90 S ATOM 2170 CE MET B 63 -0.007 5.072 -0.670 1.00 8.42 C ATOM 2171 HA MET B 63 -0.258 5.565 3.345 1.00 0.00 H ATOM 2172 HB2 MET B 63 -1.722 4.582 1.584 1.00 0.00 H ATOM 2173 HB3 MET B 63 -3.036 5.655 2.121 1.00 0.00 H ATOM 2174 HG2 MET B 63 -1.491 7.589 1.626 1.00 0.00 H ATOM 2175 HG3 MET B 63 -2.102 6.677 0.227 1.00 0.00 H ATOM 2176 HE1 MET B 63 -0.441 4.204 -0.174 1.00 0.00 H ATOM 2177 HE2 MET B 63 -0.683 5.422 -1.450 1.00 0.00 H ATOM 2178 HE3 MET B 63 0.950 4.797 -1.114 1.00 0.00 H ATOM 2179 H MET B 63 -2.196 3.632 3.754 1.00 0.00 H ATOM 2180 N GLU B 64 -2.883 7.152 4.580 1.00 7.11 N ATOM 2181 CA GLU B 64 -3.147 8.475 5.158 1.00 8.77 C ATOM 2182 C GLU B 64 -2.563 8.642 6.549 1.00 8.17 C ATOM 2183 O GLU B 64 -2.489 9.787 7.019 1.00 9.08 O ATOM 2184 CB GLU B 64 -4.589 8.918 5.014 1.00 10.72 C ATOM 2185 CG GLU B 64 -5.660 8.337 5.896 1.00 11.44 C ATOM 2186 CD GLU B 64 -7.035 8.878 5.532 1.00 11.78 C ATOM 2187 OE1 GLU B 64 -7.403 8.795 4.347 1.00 10.30 O ATOM 2188 OE2 GLU B 64 -7.750 9.392 6.415 1.00 12.49 O ATOM 2189 HA GLU B 64 -2.594 9.188 4.547 1.00 0.00 H ATOM 2190 HB2 GLU B 64 -4.602 9.996 5.176 1.00 0.00 H ATOM 2191 HB3 GLU B 64 -4.880 8.703 3.986 1.00 0.00 H ATOM 2192 HG2 GLU B 64 -5.664 7.253 5.782 1.00 0.00 H ATOM 2193 HG3 GLU B 64 -5.442 8.591 6.933 1.00 0.00 H ATOM 2194 H GLU B 64 -3.627 6.427 4.534 1.00 0.00 H ATOM 2195 N ALA B 65 -2.064 7.611 7.224 1.00 7.37 N ATOM 2196 CA ALA B 65 -1.382 7.717 8.474 1.00 7.09 C ATOM 2197 C ALA B 65 0.125 7.939 8.299 1.00 5.94 C ATOM 2198 O ALA B 65 0.754 8.401 9.251 1.00 7.03 O ATOM 2199 CB ALA B 65 -1.558 6.481 9.360 1.00 7.82 C ATOM 2200 HA ALA B 65 -1.840 8.581 8.956 1.00 0.00 H ATOM 2201 HB1 ALA B 65 -2.617 6.335 9.572 1.00 0.00 H ATOM 2202 HB2 ALA B 65 -1.166 5.606 8.842 1.00 0.00 H ATOM 2203 HB3 ALA B 65 -1.016 6.625 10.294 1.00 0.00 H ATOM 2204 H ALA B 65 -2.178 6.662 6.813 1.00 0.00 H ATOM 2205 N LEU B 66 0.685 7.650 7.129 1.00 5.38 N ATOM 2206 CA LEU B 66 2.118 7.853 6.937 1.00 3.21 C ATOM 2207 C LEU B 66 2.508 9.289 7.252 1.00 3.53 C ATOM 2208 O LEU B 66 1.758 10.198 6.863 1.00 4.14 O ATOM 2209 CB LEU B 66 2.544 7.477 5.518 1.00 3.23 C ATOM 2210 CG LEU B 66 2.397 5.996 5.148 1.00 4.01 C ATOM 2211 CD1 LEU B 66 2.736 5.823 3.667 1.00 3.68 C ATOM 2212 CD2 LEU B 66 3.222 5.074 6.028 1.00 3.98 C ATOM 2213 HA LEU B 66 2.643 7.196 7.630 1.00 0.00 H ATOM 2214 HB2 LEU B 66 1.939 8.058 4.822 1.00 0.00 H ATOM 2215 HB3 LEU B 66 3.593 7.749 5.400 1.00 0.00 H ATOM 2216 HG LEU B 66 1.363 5.701 5.325 1.00 0.00 H ATOM 2217 HD21 LEU B 66 4.277 5.334 5.936 1.00 0.00 H ATOM 2218 HD22 LEU B 66 2.908 5.187 7.066 1.00 0.00 H ATOM 2219 HD23 LEU B 66 3.072 4.042 5.712 1.00 0.00 H ATOM 2220 HD11 LEU B 66 2.053 6.424 3.067 1.00 0.00 H ATOM 2221 HD12 LEU B 66 3.761 6.149 3.490 1.00 0.00 H ATOM 2222 HD13 LEU B 66 2.635 4.773 3.393 1.00 0.00 H ATOM 2223 H LEU B 66 0.103 7.280 6.351 1.00 0.00 H ATOM 2224 N ILE B 67 3.671 9.494 7.869 1.00 2.87 N ATOM 2225 CA ILE B 67 4.168 10.857 8.090 1.00 3.52 C ATOM 2226 C ILE B 67 4.838 11.385 6.828 1.00 3.09 C ATOM 2227 O ILE B 67 4.997 12.601 6.669 1.00 4.78 O ATOM 2228 CB ILE B 67 4.982 11.018 9.361 1.00 3.87 C ATOM 2229 CG1 ILE B 67 6.294 10.233 9.352 1.00 3.85 C ATOM 2230 CG2 ILE B 67 4.134 10.644 10.580 1.00 5.18 C ATOM 2231 CD1 ILE B 67 7.221 10.685 10.480 1.00 4.12 C ATOM 2232 HA ILE B 67 3.308 11.499 8.281 1.00 0.00 H ATOM 2233 HB ILE B 67 5.264 12.069 9.418 1.00 0.00 H ATOM 2234 HG12 ILE B 67 6.074 9.173 9.476 1.00 0.00 H ATOM 2235 HG13 ILE B 67 6.795 10.389 8.397 1.00 0.00 H ATOM 2236 HD11 ILE B 67 7.449 11.744 10.359 1.00 0.00 H ATOM 2237 HD12 ILE B 67 6.728 10.526 11.439 1.00 0.00 H ATOM 2238 HD13 ILE B 67 8.144 10.106 10.444 1.00 0.00 H ATOM 2239 HG21 ILE B 67 3.262 11.296 10.628 1.00 0.00 H ATOM 2240 HG22 ILE B 67 3.810 9.607 10.491 1.00 0.00 H ATOM 2241 HG23 ILE B 67 4.729 10.764 11.485 1.00 0.00 H ATOM 2242 H ILE B 67 4.231 8.681 8.197 1.00 0.00 H ATOM 2243 N LYS B 68 5.238 10.514 5.909 1.00 3.14 N ATOM 2244 CA LYS B 68 5.711 10.891 4.596 1.00 2.70 C ATOM 2245 C LYS B 68 5.139 9.873 3.603 1.00 2.52 C ATOM 2246 O LYS B 68 5.413 8.672 3.693 1.00 2.59 O ATOM 2247 CB LYS B 68 7.227 10.925 4.464 1.00 2.87 C ATOM 2248 CG LYS B 68 7.663 11.325 3.051 1.00 3.11 C ATOM 2249 CD LYS B 68 9.101 11.798 3.065 1.00 2.84 C ATOM 2250 CE LYS B 68 9.557 12.301 1.703 1.00 2.93 C ATOM 2251 NZ LYS B 68 9.077 13.674 1.387 1.00 3.19 N ATOM 2252 HA LYS B 68 5.377 11.910 4.400 1.00 0.00 H ATOM 2253 HB2 LYS B 68 7.628 11.647 5.176 1.00 0.00 H ATOM 2254 HB3 LYS B 68 7.624 9.935 4.690 1.00 0.00 H ATOM 2255 HG2 LYS B 68 7.573 10.464 2.388 1.00 0.00 H ATOM 2256 HG3 LYS B 68 7.022 12.129 2.690 1.00 0.00 H ATOM 2257 HD2 LYS B 68 9.197 12.608 3.788 1.00 0.00 H ATOM 2258 HD3 LYS B 68 9.741 10.968 3.364 1.00 0.00 H ATOM 2259 HE2 LYS B 68 9.182 11.620 0.940 1.00 0.00 H ATOM 2260 HE3 LYS B 68 10.647 12.303 1.682 1.00 0.00 H ATOM 2261 HZ1 LYS B 68 8.037 13.686 1.392 1.00 0.00 H ATOM 2262 HZ2 LYS B 68 9.436 14.339 2.102 1.00 0.00 H ATOM 2263 HZ3 LYS B 68 9.423 13.953 0.447 1.00 0.00 H ATOM 2264 H LYS B 68 5.209 9.502 6.148 1.00 0.00 H ATOM 2265 N LYS B 69 4.319 10.356 2.672 1.00 2.84 N ATOM 2266 CA LYS B 69 3.710 9.488 1.670 1.00 3.62 C ATOM 2267 C LYS B 69 4.653 9.341 0.490 1.00 4.21 C ATOM 2268 O LYS B 69 5.341 10.298 0.172 1.00 3.94 O ATOM 2269 CB LYS B 69 2.384 10.054 1.162 1.00 4.15 C ATOM 2270 CG LYS B 69 1.230 9.880 2.139 1.00 5.71 C ATOM 2271 CD LYS B 69 1.314 10.844 3.296 1.00 7.61 C ATOM 2272 CE LYS B 69 -0.057 11.005 3.943 1.00 8.09 C ATOM 2273 NZ LYS B 69 0.052 11.747 5.218 1.00 10.86 N ATOM 2274 HA LYS B 69 3.520 8.523 2.140 1.00 0.00 H ATOM 2275 HB2 LYS B 69 2.515 11.119 0.970 1.00 0.00 H ATOM 2276 HB3 LYS B 69 2.127 9.547 0.232 1.00 0.00 H ATOM 2277 HG2 LYS B 69 0.292 10.048 1.609 1.00 0.00 H ATOM 2278 HG3 LYS B 69 1.249 8.862 2.528 1.00 0.00 H ATOM 2279 HD2 LYS B 69 2.019 10.461 4.034 1.00 0.00 H ATOM 2280 HD3 LYS B 69 1.659 11.813 2.934 1.00 0.00 H ATOM 2281 HE2 LYS B 69 -0.480 10.019 4.137 1.00 0.00 H ATOM 2282 HE3 LYS B 69 -0.711 11.552 3.265 1.00 0.00 H ATOM 2283 HZ1 LYS B 69 0.673 11.226 5.869 1.00 0.00 H ATOM 2284 HZ2 LYS B 69 0.452 12.690 5.036 1.00 0.00 H ATOM 2285 HZ3 LYS B 69 -0.892 11.846 5.642 1.00 0.00 H ATOM 2286 H LYS B 69 4.108 11.374 2.659 1.00 0.00 H ATOM 2287 N PRO B 70 4.623 8.211 -0.195 1.00 3.36 N ATOM 2288 CA PRO B 70 5.457 8.041 -1.377 1.00 3.42 C ATOM 2289 C PRO B 70 5.030 8.940 -2.529 1.00 3.27 C ATOM 2290 O PRO B 70 3.848 9.146 -2.759 1.00 3.25 O ATOM 2291 CB PRO B 70 5.273 6.558 -1.740 1.00 3.62 C ATOM 2292 CG PRO B 70 3.909 6.250 -1.215 1.00 3.25 C ATOM 2293 CD PRO B 70 3.769 7.033 0.073 1.00 3.94 C ATOM 2294 HA PRO B 70 6.494 8.315 -1.184 1.00 0.00 H ATOM 2295 HD3 PRO B 70 2.734 7.325 0.250 1.00 0.00 H ATOM 2296 HD2 PRO B 70 4.135 6.463 0.927 1.00 0.00 H ATOM 2297 HG3 PRO B 70 3.810 5.182 -1.022 1.00 0.00 H ATOM 2298 HG2 PRO B 70 3.148 6.560 -1.931 1.00 0.00 H ATOM 2299 HB2 PRO B 70 5.321 6.410 -2.819 1.00 0.00 H ATOM 2300 HB3 PRO B 70 6.028 5.939 -1.256 1.00 0.00 H ATOM 2301 N GLY B 71 6.023 9.420 -3.272 1.00 3.21 N ATOM 2302 CA GLY B 71 5.767 10.170 -4.493 1.00 2.68 C ATOM 2303 C GLY B 71 5.394 9.244 -5.642 1.00 2.31 C ATOM 2304 O GLY B 71 4.750 9.704 -6.575 1.00 2.56 O ATOM 2305 HA3 GLY B 71 6.664 10.727 -4.763 1.00 0.00 H ATOM 2306 HA2 GLY B 71 4.947 10.866 -4.317 1.00 0.00 H ATOM 2307 H GLY B 71 7.006 9.256 -2.974 1.00 0.00 H ATOM 2308 N TYR B 72 5.785 7.996 -5.582 1.00 2.62 N ATOM 2309 CA TYR B 72 5.422 6.979 -6.558 1.00 3.01 C ATOM 2310 C TYR B 72 4.161 6.266 -6.070 1.00 2.80 C ATOM 2311 O TYR B 72 3.782 6.339 -4.892 1.00 3.16 O ATOM 2312 CB TYR B 72 6.574 5.978 -6.769 1.00 3.92 C ATOM 2313 CG TYR B 72 6.867 5.090 -5.571 1.00 3.41 C ATOM 2314 CD1 TYR B 72 7.718 5.501 -4.555 1.00 3.52 C ATOM 2315 CD2 TYR B 72 6.270 3.856 -5.431 1.00 3.59 C ATOM 2316 CE1 TYR B 72 7.963 4.699 -3.455 1.00 4.37 C ATOM 2317 CE2 TYR B 72 6.499 3.026 -4.351 1.00 3.73 C ATOM 2318 CZ TYR B 72 7.357 3.461 -3.361 1.00 3.07 C ATOM 2319 OH TYR B 72 7.569 2.634 -2.265 1.00 3.02 O ATOM 2320 HA TYR B 72 5.228 7.451 -7.521 1.00 0.00 H ATOM 2321 HB3 TYR B 72 7.477 6.542 -7.003 1.00 0.00 H ATOM 2322 HB2 TYR B 72 6.318 5.337 -7.613 1.00 0.00 H ATOM 2323 HD2 TYR B 72 5.585 3.519 -6.209 1.00 0.00 H ATOM 2324 HE2 TYR B 72 6.014 2.052 -4.282 1.00 0.00 H ATOM 2325 HE1 TYR B 72 8.631 5.042 -2.665 1.00 0.00 H ATOM 2326 HD1 TYR B 72 8.203 6.475 -4.625 1.00 0.00 H ATOM 2327 HH TYR B 72 8.201 3.071 -1.641 1.00 0.00 H ATOM 2328 H TYR B 72 6.393 7.714 -4.787 1.00 0.00 H ATOM 2329 N SER B 73 3.540 5.484 -6.951 1.00 3.28 N ATOM 2330 CA SER B 73 2.408 4.651 -6.599 1.00 4.05 C ATOM 2331 C SER B 73 2.560 3.304 -7.298 1.00 4.10 C ATOM 2332 O SER B 73 2.962 3.250 -8.461 1.00 5.06 O ATOM 2333 CB SER B 73 1.059 5.252 -7.051 1.00 5.01 C ATOM 2334 OG SER B 73 -0.009 4.340 -6.797 1.00 6.42 O ATOM 2335 HA SER B 73 2.400 4.563 -5.513 1.00 0.00 H ATOM 2336 HB2 SER B 73 1.102 5.465 -8.119 1.00 0.00 H ATOM 2337 HB3 SER B 73 0.878 6.177 -6.504 1.00 0.00 H ATOM 2338 HG SER B 73 -0.863 4.743 -7.093 1.00 0.00 H ATOM 2339 H SER B 73 3.882 5.471 -7.933 1.00 0.00 H ATOM 2340 N MET B 74 2.150 2.239 -6.590 1.00 3.74 N ATOM 2341 CA MET B 74 2.101 0.913 -7.187 1.00 4.86 C ATOM 2342 C MET B 74 0.685 0.500 -7.507 1.00 7.08 C ATOM 2343 O MET B 74 0.423 -0.670 -7.815 1.00 8.80 O ATOM 2344 CB MET B 74 2.835 -0.121 -6.340 1.00 5.15 C ATOM 2345 CG MET B 74 4.315 0.239 -6.247 1.00 6.61 C ATOM 2346 SD MET B 74 5.264 -0.950 -5.322 1.00 8.49 S ATOM 2347 CE MET B 74 5.629 -2.182 -6.557 1.00 9.68 C ATOM 2348 HA MET B 74 2.634 0.964 -8.136 1.00 0.00 H ATOM 2349 HB2 MET B 74 2.404 -0.140 -5.339 1.00 0.00 H ATOM 2350 HB3 MET B 74 2.730 -1.104 -6.798 1.00 0.00 H ATOM 2351 HG2 MET B 74 4.407 1.210 -5.761 1.00 0.00 H ATOM 2352 HG3 MET B 74 4.722 0.299 -7.256 1.00 0.00 H ATOM 2353 HE1 MET B 74 4.697 -2.591 -6.947 1.00 0.00 H ATOM 2354 HE2 MET B 74 6.194 -1.724 -7.369 1.00 0.00 H ATOM 2355 HE3 MET B 74 6.218 -2.981 -6.108 1.00 0.00 H ATOM 2356 H MET B 74 1.863 2.364 -5.598 1.00 0.00 H ATOM 2357 N ASN B 75 -0.241 1.449 -7.540 1.00 8.49 N ATOM 2358 CA ASN B 75 -1.629 1.173 -7.876 1.00 10.21 C ATOM 2359 C ASN B 75 -2.178 2.223 -8.831 1.00 10.63 C ATOM 2360 O ASN B 75 -3.255 2.784 -8.629 1.00 11.65 O ATOM 2361 CB ASN B 75 -2.487 1.115 -6.610 1.00 12.60 C ATOM 2362 CG ASN B 75 -3.895 0.621 -6.888 1.00 15.59 C ATOM 2363 OD1 ASN B 75 -4.108 -0.184 -7.795 1.00 17.44 O ATOM 2364 ND2 ASN B 75 -4.864 1.123 -6.129 1.00 16.90 N ATOM 2365 HA ASN B 75 -1.667 0.203 -8.372 1.00 0.00 H ATOM 2366 HB2 ASN B 75 -2.014 0.441 -5.896 1.00 0.00 H ATOM 2367 HB3 ASN B 75 -2.545 2.115 -6.180 1.00 0.00 H ATOM 2368 HD22 ASN B 75 -4.635 1.801 -5.374 1.00 0.00 H ATOM 2369 HD21 ASN B 75 -5.851 0.838 -6.290 1.00 0.00 H ATOM 2370 H ASN B 75 0.036 2.427 -7.317 1.00 0.00 H ATOM 2371 N ALA B 76 -1.435 2.464 -9.913 1.00 10.22 N ATOM 2372 CA ALA B 76 -1.878 3.434 -10.916 1.00 10.29 C ATOM 2373 C ALA B 76 -2.782 2.789 -11.964 1.00 11.04 C ATOM 2374 O ALA B 76 -3.522 3.544 -12.634 1.00 12.01 O ATOM 2375 CB ALA B 76 -0.686 4.126 -11.545 1.00 10.17 C ATOM 2376 HA ALA B 76 -2.478 4.192 -10.413 1.00 0.00 H ATOM 2377 OXT ALA B 76 -2.753 1.550 -12.104 1.00 12.37 O ATOM 2378 HB1 ALA B 76 -0.120 4.647 -10.772 1.00 0.00 H ATOM 2379 HB2 ALA B 76 -0.049 3.384 -12.026 1.00 0.00 H ATOM 2380 HB3 ALA B 76 -1.034 4.843 -12.288 1.00 0.00 H ATOM 2381 H ALA B 76 -0.535 1.959 -10.045 1.00 0.00 H TER 2382 ALA B 76 HETATM 2383 O HOH 1 5.691 0.533 8.133 1.00 5.39 O HETATM 2384 O HOH 2 10.407 -0.031 13.328 1.00 4.80 O HETATM 2385 O HOH 3 4.189 5.431 28.074 1.00 28.71 O HETATM 2386 O HOH 4 -1.823 16.841 17.394 1.00 6.35 O HETATM 2387 O HOH 5 9.963 -2.607 12.889 1.00 12.62 O HETATM 2388 O HOH 6 5.197 -3.358 12.129 1.00 17.55 O HETATM 2389 O HOH 7 4.455 21.619 8.598 1.00 25.82 O HETATM 2390 O HOH 8 -0.137 18.272 20.418 1.00 32.17 O HETATM 2391 O HOH 9 -1.499 7.528 13.028 1.00 39.96 O HETATM 2392 O HOH 10 3.405 -3.146 15.917 1.00 32.57 O HETATM 2393 O HOH 11 9.892 19.777 3.880 1.00 28.55 O HETATM 2394 O HOH 12 11.175 20.982 8.408 1.00 24.89 O HETATM 2395 O HOH 13 5.731 7.232 26.690 1.00 18.68 O HETATM 2396 O HOH 14 15.297 22.056 11.513 1.00 27.60 O HETATM 2397 O HOH 15 6.260 13.966 24.655 1.00 26.52 O HETATM 2398 O HOH 16 5.094 13.674 24.996 1.00 23.76 O HETATM 2399 O HOH 17 6.942 15.484 21.882 1.00 14.96 O HETATM 2400 O HOH 18 0.978 12.002 18.122 1.00 28.10 O HETATM 2401 O HOH 19 29.026 7.360 4.306 1.00 17.42 O HETATM 2402 O HOH 20 4.169 22.590 16.989 1.00 33.68 O HETATM 2403 O HOH 21 1.578 22.788 15.069 1.00 21.70 O HETATM 2404 O HOH 22 -0.402 21.877 18.046 1.00 18.54 O HETATM 2405 O HOH 23 21.190 6.177 -7.782 1.00 42.57 O HETATM 2406 O HOH 24 14.543 12.025 -10.506 1.00 23.65 O HETATM 2407 O HOH 25 -2.491 15.319 14.936 1.00 4.37 O HETATM 2408 O HOH 26 1.434 12.970 10.002 1.00 16.86 O HETATM 2409 O HOH 27 2.355 15.986 9.466 1.00 21.66 O HETATM 2410 O HOH 28 6.812 20.985 9.951 1.00 15.67 O HETATM 2411 O HOH 29 2.628 18.518 20.430 1.00 17.83 O HETATM 2412 O HOH 30 8.838 20.725 18.342 1.00 25.86 O HETATM 2413 O HOH 31 4.171 18.272 21.297 1.00 14.20 O HETATM 2414 O HOH 32 7.510 -3.170 30.365 1.00 32.69 O HETATM 2415 O HOH 33 0.092 10.653 16.073 1.00 39.79 O HETATM 2416 O HOH 34 0.100 9.488 11.787 1.00 14.45 O HETATM 2417 O HOH 35 5.073 -9.995 25.320 1.00 14.89 O HETATM 2418 O HOH 36 4.018 -6.088 17.533 1.00 19.66 O HETATM 2419 O HOH 37 1.891 -3.174 18.664 1.00 18.62 O HETATM 2420 O HOH 38 7.850 18.915 5.647 1.00 21.05 O HETATM 2421 O HOH 39 8.624 20.355 7.927 1.00 20.70 O HETATM 2422 O HOH 40 7.788 16.398 5.713 1.00 7.72 O HETATM 2423 O HOH 41 2.700 -10.524 21.607 1.00 26.01 O HETATM 2424 O HOH 42 5.103 -11.480 20.844 1.00 18.63 O HETATM 2425 O HOH 43 8.195 -12.860 17.826 1.00 23.63 O HETATM 2426 O HOH 44 13.880 -12.340 11.424 1.00 39.75 O HETATM 2427 O HOH 45 17.328 -15.032 16.781 1.00 15.62 O HETATM 2428 O HOH 46 18.315 15.877 7.918 1.00 15.16 O HETATM 2429 O HOH 47 16.005 19.762 12.798 1.00 19.63 O HETATM 2430 O HOH 48 12.780 19.512 9.872 1.00 21.26 O HETATM 2431 O HOH 49 18.696 -9.501 9.207 1.00 36.09 O HETATM 2432 O HOH 50 24.268 -7.669 7.269 1.00 34.14 O HETATM 2433 O HOH 51 16.575 -12.081 10.836 1.00 36.05 O HETATM 2434 O HOH 52 26.688 1.655 17.213 1.00 19.96 O HETATM 2435 O HOH 53 18.012 17.324 1.233 1.00 7.32 O HETATM 2436 O HOH 54 17.728 18.430 7.118 1.00 15.03 O HETATM 2437 O HOH 55 15.588 16.528 1.595 1.00 12.86 O HETATM 2438 O HOH 56 19.562 15.849 1.956 1.00 12.76 O HETATM 2439 O HOH 57 13.695 17.040 3.539 1.00 19.18 O HETATM 2440 O HOH 58 21.173 18.309 4.234 1.00 11.88 O HETATM 2441 O HOH 59 17.808 19.966 4.525 1.00 27.97 O HETATM 2442 O HOH 60 14.823 18.923 6.861 1.00 22.78 O HETATM 2443 O HOH 61 16.009 -15.249 21.240 1.00 19.95 O HETATM 2444 O HOH 62 15.084 -13.598 32.346 1.00 9.94 O HETATM 2445 O HOH 63 11.255 -19.000 26.738 1.00 24.82 O HETATM 2446 O HOH 64 26.735 10.487 2.379 1.00 12.00 O HETATM 2447 O HOH 65 24.567 8.709 -1.122 1.00 13.38 O HETATM 2448 O HOH 66 25.152 6.143 -1.153 1.00 25.80 O HETATM 2449 O HOH 67 26.579 6.369 4.726 1.00 7.42 O HETATM 2450 O HOH 68 26.301 5.836 2.032 1.00 14.53 O HETATM 2451 O HOH 69 22.415 10.712 -7.832 1.00 44.36 O HETATM 2452 O HOH 70 18.987 8.720 -7.199 1.00 39.06 O HETATM 2453 O HOH 71 19.666 10.932 -5.656 1.00 12.54 O HETATM 2454 O HOH 72 17.079 6.822 -9.456 1.00 28.59 O HETATM 2455 O HOH 73 16.951 9.721 -10.868 1.00 21.08 O HETATM 2456 O HOH 74 16.721 11.165 -11.715 1.00 15.62 O HETATM 2457 O HOH 75 13.687 6.614 -9.176 1.00 16.26 O HETATM 2458 O HOH 76 15.567 6.813 -5.421 1.00 20.34 O HETATM 2459 O HOH 77 7.650 15.931 -1.683 1.00 8.03 O HETATM 2460 O HOH 78 7.654 12.809 -2.895 1.00 5.39 O HETATM 2461 O HOH 79 13.240 16.520 -0.045 1.00 19.78 O HETATM 2462 O HOH 80 11.215 6.177 -7.166 1.00 15.73 O HETATM 2463 O HOH 81 0.744 4.953 13.071 1.00 13.33 O HETATM 2464 O HOH 82 2.235 8.719 13.256 1.00 15.31 O HETATM 2465 O HOH 83 5.044 -2.189 11.116 1.00 16.95 O HETATM 2466 O HOH 84 0.475 2.400 14.217 1.00 18.27 O HETATM 2467 O HOH 85 0.541 0.816 18.018 1.00 27.85 O HETATM 2468 O HOH 86 1.873 8.574 15.769 1.00 21.37 O HETATM 2469 O HOH 87 -0.274 3.450 21.018 1.00 22.40 O HETATM 2470 O HOH 88 0.864 5.553 16.387 1.00 15.73 O HETATM 2471 O HOH 89 1.493 5.353 27.796 1.00 38.44 O HETATM 2472 O HOH 90 0.665 -0.101 21.904 1.00 16.53 O HETATM 2473 O HOH 91 7.175 -4.798 26.966 1.00 9.37 O HETATM 2474 O HOH 92 8.799 -1.733 28.375 1.00 21.28 O HETATM 2475 O HOH 93 4.529 -8.643 26.541 1.00 11.64 O HETATM 2476 O HOH 94 3.601 -0.264 30.940 1.00 28.67 O HETATM 2477 O HOH 95 -1.987 -2.850 28.672 1.00 29.29 O HETATM 2478 O HOH 96 0.829 2.141 28.845 1.00 23.84 O HETATM 2479 O HOH 97 2.244 -6.782 22.368 1.00 4.15 O HETATM 2480 O HOH 98 3.738 -4.656 19.848 1.00 12.74 O HETATM 2481 O HOH 99 -0.421 -2.103 24.485 1.00 10.01 O HETATM 2482 O HOH 100 11.864 -8.441 29.362 1.00 7.58 O HETATM 2483 O HOH 101 5.009 -10.171 23.476 1.00 17.44 O HETATM 2484 O HOH 102 6.334 -7.067 16.425 1.00 35.18 O HETATM 2485 O HOH 103 4.627 -7.285 24.112 1.00 9.59 O HETATM 2486 O HOH 104 6.776 -10.703 18.866 1.00 13.35 O HETATM 2487 O HOH 105 8.658 -14.468 21.978 1.00 28.35 O HETATM 2488 O HOH 106 13.445 -13.174 19.531 1.00 24.11 O HETATM 2489 O HOH 107 12.709 -12.508 24.434 1.00 7.67 O HETATM 2490 O HOH 108 6.512 -10.916 23.087 1.00 12.50 O HETATM 2491 O HOH 109 8.807 -12.931 25.173 1.00 19.32 O HETATM 2492 O HOH 110 6.569 -11.552 21.743 1.00 8.73 O HETATM 2493 O HOH 111 13.160 -9.764 12.304 1.00 19.79 O HETATM 2494 O HOH 112 10.317 -12.145 13.507 1.00 26.14 O HETATM 2495 O HOH 113 8.070 -6.104 10.237 1.00 20.37 O HETATM 2496 O HOH 114 7.057 -5.619 14.209 1.00 34.63 O HETATM 2497 O HOH 115 20.264 -12.127 18.415 1.00 4.57 O HETATM 2498 O HOH 116 17.834 -14.493 14.028 1.00 28.06 O HETATM 2499 O HOH 117 18.624 -6.733 9.426 1.00 19.45 O HETATM 2500 O HOH 118 19.244 -15.313 11.950 1.00 23.25 O HETATM 2501 O HOH 119 26.415 -7.807 10.206 1.00 19.27 O HETATM 2502 O HOH 120 20.692 -14.298 8.838 1.00 27.15 O HETATM 2503 O HOH 121 27.211 -9.473 13.572 1.00 6.67 O HETATM 2504 O HOH 122 19.037 -11.282 11.119 1.00 15.73 O HETATM 2505 O HOH 123 22.587 -16.412 11.621 1.00 4.15 O HETATM 2506 O HOH 124 20.898 -11.979 15.602 1.00 4.16 O HETATM 2507 O HOH 125 23.848 -5.027 8.169 1.00 7.92 O HETATM 2508 O HOH 126 25.441 -4.620 10.080 1.00 16.73 O HETATM 2509 O HOH 127 25.927 -2.842 14.868 1.00 7.89 O HETATM 2510 O HOH 128 24.989 -5.895 14.024 1.00 4.72 O HETATM 2511 O HOH 129 26.139 2.151 14.712 1.00 14.31 O HETATM 2512 O HOH 130 26.698 -0.782 11.591 1.00 20.75 O HETATM 2513 O HOH 131 25.111 2.488 19.519 1.00 5.67 O HETATM 2514 O HOH 132 24.978 5.863 16.186 1.00 8.51 O HETATM 2515 O HOH 133 23.694 1.249 21.145 1.00 2.17 O HETATM 2516 O HOH 134 28.486 -4.261 18.135 1.00 14.07 O HETATM 2517 O HOH 135 25.774 -0.935 16.973 1.00 11.02 O HETATM 2518 O HOH 136 24.867 -0.457 21.038 1.00 9.86 O HETATM 2519 O HOH 137 29.316 -4.072 15.477 1.00 31.45 O HETATM 2520 O HOH 138 23.879 1.235 27.210 1.00 8.92 O HETATM 2521 O HOH 139 15.190 0.129 20.511 1.00 3.73 O HETATM 2522 O HOH 140 22.453 -8.388 28.306 1.00 4.96 O HETATM 2523 O HOH 141 15.035 -13.308 23.210 1.00 12.62 O HETATM 2524 O HOH 142 16.637 -12.337 30.680 1.00 4.74 O HETATM 2525 O HOH 143 14.593 -8.927 29.819 1.00 5.74 O HETATM 2526 O HOH 144 11.771 -15.130 24.286 1.00 32.37 O HETATM 2527 O HOH 145 13.874 -17.157 24.779 1.00 31.46 O HETATM 2528 O HOH 146 13.197 -17.482 27.802 1.00 11.75 O HETATM 2529 O HOH 147 15.064 -14.940 25.585 1.00 12.55 O HETATM 2530 O HOH 148 12.581 -14.554 31.466 1.00 13.51 O HETATM 2531 O HOH 149 10.625 6.638 26.442 1.00 12.68 O HETATM 2532 O HOH 150 13.028 7.355 23.767 1.00 4.19 O HETATM 2533 O HOH 151 9.710 -1.979 -8.247 1.00 35.29 O HETATM 2534 O HOH 152 33.291 1.600 10.859 1.00 20.11 O HETATM 2535 O HOH 153 10.681 -0.289 6.901 1.00 5.06 O HETATM 2536 O HOH 154 13.222 -4.091 12.076 1.00 6.37 O HETATM 2537 O HOH 155 18.403 -4.822 -7.327 1.00 24.63 O HETATM 2538 O HOH 156 23.646 4.076 -3.951 1.00 12.77 O HETATM 2539 O HOH 157 24.915 4.641 -5.706 1.00 21.25 O HETATM 2540 O HOH 158 7.750 21.628 14.313 1.00 25.37 O HETATM 2541 O HOH 159 12.106 20.919 14.595 1.00 29.85 O HETATM 2542 O HOH 160 31.729 6.501 4.592 1.00 24.88 O HETATM 2543 O HOH 161 28.359 -2.041 13.965 1.00 26.44 O HETATM 2544 O HOH 162 28.840 0.711 14.391 1.00 35.20 O HETATM 2545 O HOH 163 9.905 -3.526 10.325 1.00 23.51 O HETATM 2546 O HOH 164 10.558 -6.414 8.571 1.00 27.19 O HETATM 2547 O HOH 165 35.159 0.668 8.799 1.00 26.95 O HETATM 2548 O HOH 166 31.235 -1.716 -0.162 1.00 30.94 O HETATM 2549 O HOH 167 29.143 5.380 15.282 1.00 25.65 O HETATM 2550 O HOH 168 19.292 -2.264 -6.382 1.00 15.46 O HETATM 2551 O HOH 169 21.950 3.397 -4.844 1.00 18.39 O HETATM 2552 O HOH 170 23.596 3.848 -1.995 1.00 4.21 O HETATM 2553 O HOH 171 25.817 8.423 16.883 1.00 7.96 O HETATM 2554 O HOH 172 25.405 0.175 -4.885 1.00 37.21 O HETATM 2555 O HOH 173 26.729 2.670 -1.789 1.00 28.67 O HETATM 2556 O HOH 174 28.988 -4.170 5.057 1.00 36.98 O HETATM 2557 O HOH 175 9.639 20.060 15.557 1.00 16.81 O HETATM 2558 O HOH 176 33.163 4.427 3.140 1.00 25.36 O HETATM 2559 O HOH 177 20.670 9.249 30.059 1.00 27.71 O HETATM 2560 O HOH 178 23.420 13.272 30.542 1.00 39.30 O HETATM 2561 O HOH 179 17.375 9.491 31.447 1.00 32.61 O HETATM 2562 O HOH 180 27.852 5.041 24.510 1.00 19.03 O HETATM 2563 O HOH 181 27.400 4.799 18.315 1.00 39.28 O HETATM 2564 O HOH 182 29.481 -6.759 9.910 1.00 25.92 O HETATM 2565 O HOH 183 29.216 -0.266 10.908 1.00 14.57 O HETATM 2566 O HOH 184 27.457 -3.413 11.314 1.00 21.85 O HETATM 2567 O HOH 185 33.446 -2.655 5.504 1.00 22.90 O HETATM 2568 O HOH 186 34.912 7.511 9.442 1.00 20.43 O HETATM 2569 O HOH 187 35.506 2.497 4.581 1.00 28.91 O HETATM 2570 O HOH 188 34.279 0.575 6.138 1.00 13.67 O HETATM 2571 O HOH 189 30.167 0.874 -0.619 1.00 19.24 O HETATM 2572 O HOH 190 27.871 7.588 0.504 1.00 27.91 O HETATM 2573 O HOH 191 29.067 6.529 -1.769 1.00 28.79 O HETATM 2574 O HOH 192 11.801 -9.513 0.984 1.00 18.04 O HETATM 2575 O HOH 193 7.853 -4.044 -8.747 1.00 19.99 O HETATM 2576 O HOH 194 7.952 -8.305 -9.937 1.00 14.11 O HETATM 2577 O HOH 195 7.188 -11.085 -2.361 1.00 32.09 O HETATM 2578 O HOH 196 7.873 -8.927 2.941 1.00 24.57 O HETATM 2579 O HOH 197 26.743 4.749 14.317 1.00 6.13 O HETATM 2580 O HOH 198 3.800 -9.672 3.363 1.00 35.03 O HETATM 2581 O HOH 199 -0.246 -7.694 2.479 1.00 27.96 O HETATM 2582 O HOH 200 -2.498 2.801 -3.033 1.00 19.36 O HETATM 2583 O HOH 201 1.691 -4.539 9.876 1.00 40.75 O HETATM 2584 O HOH 202 26.478 14.166 9.334 1.00 2.48 O HETATM 2585 O HOH 203 21.734 13.887 12.050 1.00 4.60 O HETATM 2586 O HOH 204 -5.306 7.029 9.249 1.00 18.39 O HETATM 2587 O HOH 205 -2.857 3.354 9.967 1.00 42.80 O HETATM 2588 O HOH 206 11.187 17.456 3.043 1.00 22.72 O HETATM 2589 O HOH 207 23.893 14.932 13.757 1.00 6.87 O HETATM 2590 O HOH 208 26.075 11.091 16.331 1.00 4.91 O HETATM 2591 O HOH 209 -2.387 6.816 -9.819 1.00 14.98 O HETATM 2592 O HOH 210 16.548 15.796 22.457 1.00 6.52 O HETATM 2593 O HOH 211 20.082 15.691 13.422 1.00 8.92 O HETATM 2594 O HOH 212 23.388 17.524 14.324 1.00 7.70 O HETATM 2595 O HOH 213 16.553 20.075 17.133 1.00 21.47 O HETATM 2596 O HOH 214 13.292 16.607 21.716 1.00 20.67 O HETATM 2597 O HOH 215 8.855 13.906 21.158 1.00 12.97 O HETATM 2598 O HOH 216 9.362 17.340 15.406 1.00 7.82 O HETATM 2599 O HOH 217 9.217 16.897 18.137 1.00 10.80 O HETATM 2600 O HOH 218 8.719 13.526 22.773 1.00 23.53 O HETATM 2601 O HOH 219 13.597 10.661 26.954 1.00 31.17 O HETATM 2602 O HOH 220 13.655 12.716 28.967 1.00 24.11 O HETATM 2603 O HOH 221 13.397 18.574 25.047 1.00 24.97 O HETATM 2604 O HOH 222 14.946 17.235 23.601 1.00 6.66 O HETATM 2605 O HOH 223 16.227 15.386 26.212 1.00 11.46 O HETATM 2606 O HOH 224 17.151 17.348 25.115 1.00 14.47 O HETATM 2607 O HOH 225 12.095 8.755 21.896 1.00 11.32 O HETATM 2608 O HOH 226 21.302 12.079 28.835 1.00 26.41 O HETATM 2609 O HOH 227 17.211 12.625 31.437 1.00 38.18 O HETATM 2610 O HOH 228 15.772 13.156 26.996 1.00 16.90 O HETATM 2611 O HOH 229 23.907 2.822 22.828 1.00 4.12 O HETATM 2612 O HOH 230 26.528 5.074 20.874 1.00 23.92 O HETATM 2613 O HOH 231 24.840 5.711 24.912 1.00 9.20 O HETATM 2614 O HOH 232 25.103 8.576 19.518 1.00 5.05 O HETATM 2615 O HOH 233 24.811 2.664 25.248 1.00 11.92 O HETATM 2616 O HOH 234 20.617 6.750 28.657 1.00 9.69 O HETATM 2617 O HOH 235 24.113 5.807 26.873 1.00 5.53 O HETATM 2618 O HOH 236 16.622 4.101 27.583 1.00 20.50 O HETATM 2619 O HOH 237 15.020 7.429 25.414 1.00 4.01 O HETATM 2620 O HOH 238 21.839 2.312 21.116 1.00 4.95 O HETATM 2621 O HOH 239 19.940 -4.330 9.966 1.00 6.91 O HETATM 2622 O HOH 240 19.772 -6.602 7.018 1.00 21.58 O HETATM 2623 O HOH 241 22.182 -3.668 6.608 1.00 21.98 O HETATM 2624 O HOH 242 16.551 -8.438 6.008 1.00 27.62 O HETATM 2625 O HOH 243 23.108 -3.961 4.184 1.00 33.01 O HETATM 2626 O HOH 244 19.595 -6.876 4.117 1.00 16.23 O HETATM 2627 O HOH 245 25.113 -3.267 2.125 1.00 28.00 O HETATM 2628 O HOH 246 17.570 -9.121 -0.315 1.00 25.71 O HETATM 2629 O HOH 247 23.763 -5.541 -1.761 1.00 29.78 O HETATM 2630 O HOH 248 15.986 -8.673 3.334 1.00 26.65 O HETATM 2631 O HOH 249 21.048 -8.383 -4.042 1.00 28.79 O HETATM 2632 O HOH 250 16.685 -9.767 -7.628 1.00 29.14 O HETATM 2633 O HOH 251 13.991 -9.474 -0.839 1.00 11.84 O HETATM 2634 O HOH 252 7.670 -5.755 -6.529 1.00 8.97 O HETATM 2635 O HOH 253 9.701 -6.171 -9.660 1.00 20.80 O HETATM 2636 O HOH 254 14.085 -7.395 -10.332 1.00 13.50 O HETATM 2637 O HOH 255 6.118 -7.559 -7.992 1.00 15.02 O HETATM 2638 O HOH 256 7.492 -11.315 -6.681 1.00 36.11 O HETATM 2639 O HOH 257 6.383 -8.851 -3.733 1.00 12.86 O HETATM 2640 O HOH 258 9.190 -8.403 0.708 1.00 17.35 O HETATM 2641 O HOH 259 13.314 -11.730 -2.432 1.00 27.72 O HETATM 2642 O HOH 260 -0.191 -5.752 -7.484 1.00 26.33 O HETATM 2643 O HOH 261 1.556 -3.050 -8.764 1.00 10.33 O HETATM 2644 O HOH 262 4.192 -5.734 -8.769 1.00 11.32 O HETATM 2645 O HOH 263 5.937 -7.404 3.944 1.00 37.44 O HETATM 2646 O HOH 264 2.318 -8.163 1.665 1.00 17.29 O HETATM 2647 O HOH 265 -2.474 -0.430 -3.584 1.00 17.39 O HETATM 2648 O HOH 266 -2.192 -3.210 -1.997 1.00 34.89 O HETATM 2649 O HOH 267 -2.792 -3.610 0.649 1.00 22.56 O HETATM 2650 O HOH 268 1.838 -8.800 -1.378 1.00 19.38 O HETATM 2651 O HOH 269 2.094 -8.683 -2.703 1.00 17.68 O HETATM 2652 O HOH 270 -0.465 -7.193 -4.942 1.00 22.09 O HETATM 2653 O HOH 271 -0.667 -5.002 6.666 1.00 21.29 O HETATM 2654 O HOH 272 0.566 -1.645 7.817 1.00 33.22 O HETATM 2655 O HOH 273 8.759 -1.920 7.510 1.00 14.18 O HETATM 2656 O HOH 274 6.141 -4.736 9.880 1.00 24.08 O HETATM 2657 O HOH 275 7.580 -2.235 9.909 1.00 18.86 O HETATM 2658 O HOH 276 3.390 -2.019 10.149 1.00 17.97 O HETATM 2659 O HOH 277 -5.245 2.972 2.745 1.00 18.38 O HETATM 2660 O HOH 278 -3.594 3.230 -0.482 1.00 15.19 O HETATM 2661 O HOH 279 -4.574 -1.100 1.187 1.00 30.54 O HETATM 2662 O HOH 280 -7.471 6.659 2.670 1.00 18.59 O HETATM 2663 O HOH 281 -5.130 5.345 3.873 1.00 9.52 O HETATM 2664 O HOH 282 -10.282 10.256 6.187 1.00 7.80 O HETATM 2665 O HOH 283 -4.824 4.823 5.232 1.00 10.96 O HETATM 2666 O HOH 284 -7.305 8.926 8.920 1.00 22.92 O HETATM 2667 O HOH 285 -4.001 4.980 7.390 1.00 15.91 O HETATM 2668 O HOH 286 2.694 6.568 10.120 1.00 8.23 O HETATM 2669 O HOH 287 5.556 14.515 4.803 1.00 15.87 O HETATM 2670 O HOH 288 3.091 14.173 7.855 1.00 29.85 O HETATM 2671 O HOH 289 9.461 15.062 3.945 1.00 15.90 O HETATM 2672 O HOH 290 8.038 10.358 -1.223 1.00 2.85 O HETATM 2673 O HOH 291 6.368 13.641 0.518 1.00 10.29 O HETATM 2674 O HOH 292 6.199 11.941 -1.199 1.00 3.97 O HETATM 2675 O HOH 293 4.289 13.285 2.489 1.00 9.07 O HETATM 2676 O HOH 294 8.902 3.797 -0.285 1.00 3.94 O HETATM 2677 O HOH 295 -0.671 -2.644 -6.091 1.00 21.51 O HETATM 2678 O HOH 296 2.624 -2.213 -9.130 1.00 13.91 O HETATM 2679 O HOH 297 -2.840 -2.416 -8.572 1.00 27.33 O HETATM 2680 O HOH 298 -5.770 2.798 -9.745 1.00 16.95 O HETATM 2681 O HOH 299 -3.311 0.253 -14.420 1.00 27.08 O HETATM 2682 O HOH 300 -3.945 6.042 -11.967 1.00 9.80 O HETATM 2683 O HOH 301 5.222 -1.500 -9.924 1.00 30.56 O HETATM 2684 O HOH 302 16.345 5.179 -3.566 1.00 14.17 O HETATM 2685 O HOH 303 11.046 0.567 -9.059 1.00 23.19 O HETATM 2686 O HOH 304 16.883 2.176 -6.010 1.00 19.03 O HETATM 2687 C BEZ A 305 11.300 4.472 23.328 1.00 0.06 C HETATM 2688 C1 BEZ A 305 12.111 3.473 24.057 1.00 0.01 C HETATM 2689 C6 BEZ A 305 12.249 2.202 23.485 1.00 -0.05 C HETATM 2690 C5 BEZ A 305 13.026 1.268 24.157 1.00 -0.06 C HETATM 2691 C4 BEZ A 305 13.655 1.565 25.341 1.00 -0.06 C HETATM 2692 C3 BEZ A 305 13.542 2.820 25.906 1.00 -0.06 C HETATM 2693 C2 BEZ A 305 12.767 3.776 25.250 1.00 -0.05 C HETATM 2694 H1 BEZ A 305 12.673 4.769 25.674 1.00 0.07 H HETATM 2695 H2 BEZ A 305 14.044 3.056 26.837 1.00 0.06 H HETATM 2696 H3 BEZ A 305 14.247 0.805 25.838 1.00 0.06 H HETATM 2697 H4 BEZ A 305 13.139 0.276 23.735 1.00 0.06 H HETATM 2698 H5 BEZ A 305 11.764 1.955 22.547 1.00 0.07 H HETATM 2699 O2 BEZ A 305 10.848 5.555 23.937 1.00 -0.56 O HETATM 2700 O1 BEZ A 305 10.997 4.285 22.163 1.00 -0.56 O CONECT 2687 2688 2699 2700 CONECT 2688 2687 2689 2693 CONECT 2689 2688 2690 2698 CONECT 2690 2689 2691 2697 CONECT 2691 2690 2692 2696 CONECT 2692 2691 2693 2695 CONECT 2693 2688 2692 2694 CONECT 2694 2693 CONECT 2695 2692 CONECT 2696 2691 CONECT 2697 2690 CONECT 2698 2689 CONECT 2699 2687 CONECT 2700 2687 MASTER 0 0 0 0 0 0 0 0 2698 2 14 12 END
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Structure:
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Related entries of code: 1gyx
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1gyy
RCSB PDB
PDBbind
76aa, >1GYY_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1kqb
RCSB PDB
PDBbind
BEZ
Entry Information
PDB ID
1gyx
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
hypothetical protein ydce
Ligand Name
BEZ
EC.Number
E.C.5.3.2.1
Resolution
1.35(Å)
Affinity (Kd/Ki/IC50)
Ki=3.3mM
Release Year
2002
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistryv41;pp.12010
Ligand Properties
Formula
C
7
H
6
O
2
Molecular Weight
122.121
Exact Mass
122.037
No. of atoms
15
No. of bonds
15
Polar Surface Area
37.3
LOGP Value
2.53 (
Computed with XLOGP3
)
1.38 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 1
Canonical SMILES
OC(=O)c1ccccc1
InChI String
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
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):
P31992
Entrez Gene ID
NCBI Entrez Gene ID:
945731
ASD
Information of known allosteric effects of PDB entries
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