Browse entries in the PDBbind-CN Database
HEADER 1TFQ_COMPLEX COMPND 1TFQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 117 MET SER ASP ALA VAL SER SER ASP ARG ASN PHE PRO ASN SEQRES 2 A 117 SER THR ASN LEU PRO ARG ASN PRO SER MET ALA ASP TYR SEQRES 3 A 117 GLU ALA ARG ILE PHE THR PHE GLY THR TRP ILE TYR SER SEQRES 4 A 117 VAL ASN LYS GLU GLN LEU ALA ARG ALA GLY PHE TYR ALA SEQRES 5 A 117 LEU GLY GLU GLY ASP LYS VAL LYS CYS PHE HIS CYS GLY SEQRES 6 A 117 GLY GLY LEU THR ASP TRP LYS PRO SER GLU ASP PRO TRP SEQRES 7 A 117 GLU GLN HIS ALA LYS TRP TYR PRO GLY CYS LYS TYR LEU SEQRES 8 A 117 LEU GLU GLN LYS GLY GLN GLU TYR ILE ASN ASN ILE HIS SEQRES 9 A 117 LEU THR HIS SER LEU GLU GLU CYS LEU VAL ARG THR THR HET ZN A 1 1 HET UNN A 119 71 ATOM 1 N MET A 240 14.907 24.119 19.978 1.00 17.95 N ATOM 2 CA MET A 240 15.608 24.097 18.668 1.00 17.89 C ATOM 3 C MET A 240 15.672 22.682 18.100 1.00 17.87 C ATOM 4 O MET A 240 16.685 21.995 18.232 1.00 18.20 O ATOM 5 CB MET A 240 17.020 24.653 18.861 1.00 18.13 C ATOM 6 CG MET A 240 17.055 26.153 19.104 1.00 18.07 C ATOM 7 SD MET A 240 18.002 27.038 17.850 1.00 18.48 S ATOM 8 CE MET A 240 16.966 28.476 17.595 1.00 18.40 C ATOM 9 HA MET A 240 15.056 24.711 17.957 1.00 0.00 H ATOM 10 HB2 MET A 240 17.473 24.154 19.718 1.00 0.00 H ATOM 11 HB3 MET A 240 17.602 24.435 17.966 1.00 0.00 H ATOM 12 HG2 MET A 240 17.507 26.338 20.078 1.00 0.00 H ATOM 13 HG3 MET A 240 16.033 26.531 19.101 1.00 0.00 H ATOM 14 HE1 MET A 240 15.981 28.157 17.254 1.00 0.00 H ATOM 15 HE2 MET A 240 16.867 29.022 18.533 1.00 0.00 H ATOM 16 HE3 MET A 240 17.421 29.121 16.844 1.00 0.00 H ATOM 17 HN3 MET A 240 15.416 23.513 20.652 1.00 0.00 H ATOM 18 HN2 MET A 240 13.937 23.765 19.856 1.00 0.00 H ATOM 19 HN1 MET A 240 14.879 25.094 20.339 1.00 0.00 H ATOM 20 N SER A 241 14.584 22.254 17.469 1.00 17.64 N ATOM 21 CA SER A 241 14.516 20.921 16.881 1.00 17.76 C ATOM 22 C SER A 241 15.395 20.829 15.638 1.00 17.40 C ATOM 23 O SER A 241 14.958 21.145 14.532 1.00 17.41 O ATOM 24 CB SER A 241 13.070 20.572 16.524 1.00 18.18 C ATOM 25 OG SER A 241 12.219 20.712 17.648 1.00 18.54 O ATOM 26 HA SER A 241 14.884 20.207 17.618 1.00 0.00 H ATOM 27 HB2 SER A 241 13.029 19.541 16.172 1.00 0.00 H ATOM 28 HB3 SER A 241 12.728 21.239 15.733 1.00 0.00 H ATOM 29 HG SER A 241 11.292 20.481 17.389 1.00 0.00 H ATOM 30 H SER A 241 13.761 22.885 17.392 1.00 0.00 H ATOM 31 N ASP A 242 16.637 20.395 15.829 1.00 17.21 N ATOM 32 CA ASP A 242 17.578 20.261 14.723 1.00 17.02 C ATOM 33 C ASP A 242 17.199 19.088 13.826 1.00 16.49 C ATOM 34 O ASP A 242 17.211 19.202 12.600 1.00 16.38 O ATOM 35 CB ASP A 242 18.999 20.074 15.255 1.00 17.27 C ATOM 36 CG ASP A 242 19.969 19.641 14.174 1.00 17.53 C ATOM 37 OD1 ASP A 242 20.079 20.354 13.155 1.00 17.77 O ATOM 38 OD2 ASP A 242 20.619 18.588 14.345 1.00 17.63 O ATOM 39 HA ASP A 242 17.537 21.175 14.131 1.00 0.00 H ATOM 40 HB2 ASP A 242 19.343 21.019 15.676 1.00 0.00 H ATOM 41 HB3 ASP A 242 18.983 19.314 16.036 1.00 0.00 H ATOM 42 H ASP A 242 16.945 20.145 16.790 1.00 0.00 H ATOM 43 N ALA A 243 16.864 17.960 14.445 1.00 16.31 N ATOM 44 CA ALA A 243 16.481 16.764 13.704 1.00 15.96 C ATOM 45 C ALA A 243 17.635 16.254 12.847 1.00 15.61 C ATOM 46 O ALA A 243 18.738 16.800 12.884 1.00 15.48 O ATOM 47 CB ALA A 243 15.262 17.047 12.839 1.00 15.93 C ATOM 48 HA ALA A 243 16.229 15.986 14.425 1.00 0.00 H ATOM 49 HB1 ALA A 243 14.431 17.354 13.474 1.00 0.00 H ATOM 50 HB2 ALA A 243 15.496 17.844 12.133 1.00 0.00 H ATOM 51 HB3 ALA A 243 14.989 16.145 12.292 1.00 0.00 H ATOM 52 H ALA A 243 16.875 17.930 15.485 1.00 0.00 H ATOM 53 N VAL A 244 17.375 15.203 12.076 1.00 15.61 N ATOM 54 CA VAL A 244 18.393 14.620 11.211 1.00 15.48 C ATOM 55 C VAL A 244 17.764 13.975 9.980 1.00 15.27 C ATOM 56 O VAL A 244 17.586 12.758 9.927 1.00 15.31 O ATOM 57 CB VAL A 244 19.228 13.564 11.958 1.00 15.91 C ATOM 58 CG1 VAL A 244 20.413 14.215 12.655 1.00 16.27 C ATOM 59 CG2 VAL A 244 18.364 12.807 12.955 1.00 16.09 C ATOM 60 HA VAL A 244 19.046 15.435 10.899 1.00 0.00 H ATOM 61 HB VAL A 244 19.612 12.850 11.230 1.00 0.00 H ATOM 62 HG11 VAL A 244 21.044 14.706 11.914 1.00 0.00 H ATOM 63 HG12 VAL A 244 20.051 14.952 13.372 1.00 0.00 H ATOM 64 HG13 VAL A 244 20.990 13.452 13.177 1.00 0.00 H ATOM 65 HG21 VAL A 244 17.949 13.508 13.680 1.00 0.00 H ATOM 66 HG22 VAL A 244 17.553 12.307 12.425 1.00 0.00 H ATOM 67 HG23 VAL A 244 18.973 12.066 13.472 1.00 0.00 H ATOM 68 H VAL A 244 16.422 14.787 12.090 1.00 0.00 H ATOM 69 N SER A 245 17.430 14.799 8.992 1.00 15.22 N ATOM 70 CA SER A 245 16.822 14.309 7.761 1.00 15.21 C ATOM 71 C SER A 245 16.996 15.317 6.630 1.00 14.92 C ATOM 72 O SER A 245 17.702 15.057 5.656 1.00 15.13 O ATOM 73 CB SER A 245 15.335 14.022 7.981 1.00 15.69 C ATOM 74 OG SER A 245 15.038 12.657 7.742 1.00 16.18 O ATOM 75 HA SER A 245 17.325 13.384 7.479 1.00 0.00 H ATOM 76 HB2 SER A 245 14.749 14.639 7.300 1.00 0.00 H ATOM 77 HB3 SER A 245 15.073 14.269 9.010 1.00 0.00 H ATOM 78 HG SER A 245 14.072 12.500 7.891 1.00 0.00 H ATOM 79 H SER A 245 17.607 15.818 9.100 1.00 0.00 H ATOM 80 N SER A 246 16.347 16.469 6.767 1.00 14.61 N ATOM 81 CA SER A 246 16.429 17.518 5.757 1.00 14.50 C ATOM 82 C SER A 246 17.485 18.553 6.132 1.00 14.13 C ATOM 83 O SER A 246 17.236 19.441 6.948 1.00 14.16 O ATOM 84 CB SER A 246 15.070 18.198 5.586 1.00 14.60 C ATOM 85 OG SER A 246 14.598 18.713 6.819 1.00 14.79 O ATOM 86 HA SER A 246 16.718 17.056 4.813 1.00 0.00 H ATOM 87 HB2 SER A 246 14.353 17.470 5.206 1.00 0.00 H ATOM 88 HB3 SER A 246 15.168 19.016 4.872 1.00 0.00 H ATOM 89 HG SER A 246 15.244 19.378 7.166 1.00 0.00 H ATOM 90 H SER A 246 15.766 16.626 7.615 1.00 0.00 H ATOM 91 N ASP A 247 18.664 18.434 5.531 1.00 13.98 N ATOM 92 CA ASP A 247 19.758 19.359 5.802 1.00 13.83 C ATOM 93 C ASP A 247 20.625 19.555 4.563 1.00 13.49 C ATOM 94 O ASP A 247 20.744 20.666 4.046 1.00 13.50 O ATOM 95 CB ASP A 247 20.613 18.846 6.962 1.00 13.98 C ATOM 96 CG ASP A 247 21.304 19.967 7.712 1.00 14.05 C ATOM 97 OD1 ASP A 247 21.463 21.061 7.130 1.00 14.06 O ATOM 98 OD2 ASP A 247 21.686 19.753 8.881 1.00 14.27 O ATOM 99 HA ASP A 247 19.326 20.322 6.077 1.00 0.00 H ATOM 100 HB2 ASP A 247 19.972 18.303 7.656 1.00 0.00 H ATOM 101 HB3 ASP A 247 21.371 18.170 6.566 1.00 0.00 H ATOM 102 H ASP A 247 18.810 17.662 4.850 1.00 0.00 H ATOM 103 N ARG A 248 21.228 18.469 4.091 1.00 13.39 N ATOM 104 CA ARG A 248 22.085 18.523 2.912 1.00 13.26 C ATOM 105 C ARG A 248 22.180 17.154 2.246 1.00 12.93 C ATOM 106 O ARG A 248 21.833 16.136 2.844 1.00 12.97 O ATOM 107 CB ARG A 248 23.482 19.017 3.292 1.00 13.59 C ATOM 108 CG ARG A 248 24.091 18.274 4.470 1.00 14.10 C ATOM 109 CD ARG A 248 25.570 18.586 4.620 1.00 14.47 C ATOM 110 NE ARG A 248 25.818 19.573 5.672 1.00 15.11 N ATOM 111 CZ ARG A 248 26.956 20.266 5.818 1.00 15.42 C ATOM 112 NH1 ARG A 248 27.987 20.104 4.987 1.00 15.17 N ATOM 113 NH2 ARG A 248 27.062 21.136 6.813 1.00 16.14 N ATOM 114 HA ARG A 248 21.641 19.222 2.203 1.00 0.00 H ATOM 115 HB2 ARG A 248 24.138 18.893 2.430 1.00 0.00 H ATOM 116 HB3 ARG A 248 23.416 20.074 3.548 1.00 0.00 H ATOM 117 HG2 ARG A 248 23.572 18.569 5.382 1.00 0.00 H ATOM 118 HG3 ARG A 248 23.969 17.202 4.315 1.00 0.00 H ATOM 119 HD2 ARG A 248 25.945 18.977 3.674 1.00 0.00 H ATOM 120 HD3 ARG A 248 26.101 17.667 4.867 1.00 0.00 H ATOM 121 HE ARG A 248 25.055 19.750 6.356 1.00 0.00 H ATOM 122 HH12 ARG A 248 28.858 20.656 5.125 1.00 0.00 H ATOM 123 HH11 ARG A 248 27.920 19.426 4.201 1.00 0.00 H ATOM 124 HH22 ARG A 248 27.940 21.680 6.937 1.00 0.00 H ATOM 125 HH21 ARG A 248 26.267 21.275 7.469 1.00 0.00 H ATOM 126 H ARG A 248 21.085 17.559 4.574 1.00 0.00 H ATOM 127 N ASN A 249 22.653 17.138 1.004 1.00 12.80 N ATOM 128 CA ASN A 249 22.795 15.894 0.256 1.00 12.70 C ATOM 129 C ASN A 249 24.106 15.196 0.603 1.00 12.20 C ATOM 130 O ASN A 249 24.899 15.701 1.397 1.00 11.93 O ATOM 131 CB ASN A 249 22.732 16.169 -1.247 1.00 13.00 C ATOM 132 CG ASN A 249 21.518 16.990 -1.635 1.00 13.20 C ATOM 133 OD1 ASN A 249 20.427 16.798 -1.097 1.00 13.22 O ATOM 134 ND2 ASN A 249 21.701 17.911 -2.574 1.00 13.56 N ATOM 135 HA ASN A 249 21.971 15.237 0.533 1.00 0.00 H ATOM 136 HB2 ASN A 249 23.630 16.711 -1.542 1.00 0.00 H ATOM 137 HB3 ASN A 249 22.694 15.217 -1.776 1.00 0.00 H ATOM 138 HD22 ASN A 249 22.641 18.039 -3.001 1.00 0.00 H ATOM 139 HD21 ASN A 249 20.905 18.505 -2.882 1.00 0.00 H ATOM 140 H ASN A 249 22.929 18.034 0.555 1.00 0.00 H ATOM 141 N PHE A 250 24.327 14.031 0.002 1.00 12.26 N ATOM 142 CA PHE A 250 25.542 13.263 0.246 1.00 11.99 C ATOM 143 C PHE A 250 25.673 12.905 1.724 1.00 11.68 C ATOM 144 O PHE A 250 26.510 13.461 2.435 1.00 11.66 O ATOM 145 CB PHE A 250 26.769 14.054 -0.209 1.00 12.19 C ATOM 146 CG PHE A 250 26.602 14.701 -1.554 1.00 12.51 C ATOM 147 CD1 PHE A 250 26.249 13.947 -2.661 1.00 12.57 C ATOM 148 CD2 PHE A 250 26.798 16.064 -1.710 1.00 12.97 C ATOM 149 CE1 PHE A 250 26.094 14.540 -3.900 1.00 13.08 C ATOM 150 CE2 PHE A 250 26.644 16.663 -2.946 1.00 13.46 C ATOM 151 CZ PHE A 250 26.292 15.899 -4.042 1.00 13.52 C ATOM 152 HA PHE A 250 25.479 12.339 -0.329 1.00 0.00 H ATOM 153 HB2 PHE A 250 26.969 14.833 0.526 1.00 0.00 H ATOM 154 HB3 PHE A 250 27.620 13.374 -0.257 1.00 0.00 H ATOM 155 HD2 PHE A 250 27.077 16.670 -0.848 1.00 0.00 H ATOM 156 HE2 PHE A 250 26.800 17.736 -3.056 1.00 0.00 H ATOM 157 HZ PHE A 250 26.171 16.369 -5.018 1.00 0.00 H ATOM 158 HE1 PHE A 250 25.816 13.936 -4.763 1.00 0.00 H ATOM 159 HD1 PHE A 250 26.092 12.874 -2.554 1.00 0.00 H ATOM 160 H PHE A 250 23.616 13.658 -0.659 1.00 0.00 H ATOM 161 N PRO A 251 24.843 11.967 2.205 1.00 11.63 N ATOM 162 CA PRO A 251 24.866 11.531 3.606 1.00 11.57 C ATOM 163 C PRO A 251 26.244 11.038 4.035 1.00 11.04 C ATOM 164 O PRO A 251 26.770 11.456 5.066 1.00 11.01 O ATOM 165 CB PRO A 251 23.853 10.383 3.644 1.00 11.84 C ATOM 166 CG PRO A 251 22.958 10.621 2.477 1.00 11.89 C ATOM 167 CD PRO A 251 23.818 11.257 1.421 1.00 11.90 C ATOM 168 HA PRO A 251 24.628 12.347 4.288 1.00 0.00 H ATOM 169 HD3 PRO A 251 24.270 10.502 0.778 1.00 0.00 H ATOM 170 HD2 PRO A 251 23.240 11.952 0.812 1.00 0.00 H ATOM 171 HG3 PRO A 251 22.142 11.288 2.754 1.00 0.00 H ATOM 172 HG2 PRO A 251 22.548 9.678 2.115 1.00 0.00 H ATOM 173 HB2 PRO A 251 24.359 9.422 3.550 1.00 0.00 H ATOM 174 HB3 PRO A 251 23.285 10.404 4.574 1.00 0.00 H ATOM 175 N ASN A 252 26.822 10.147 3.236 1.00 10.83 N ATOM 176 CA ASN A 252 28.139 9.596 3.533 1.00 10.53 C ATOM 177 C ASN A 252 28.861 9.193 2.251 1.00 10.01 C ATOM 178 O ASN A 252 29.931 9.716 1.939 1.00 10.17 O ATOM 179 CB ASN A 252 28.011 8.387 4.461 1.00 10.95 C ATOM 180 CG ASN A 252 28.629 8.636 5.823 1.00 11.49 C ATOM 181 OD1 ASN A 252 27.925 8.904 6.797 1.00 11.63 O ATOM 182 ND2 ASN A 252 29.952 8.550 5.898 1.00 11.99 N ATOM 183 HA ASN A 252 28.725 10.368 4.032 1.00 0.00 H ATOM 184 HB2 ASN A 252 26.954 8.157 4.593 1.00 0.00 H ATOM 185 HB3 ASN A 252 28.512 7.536 3.999 1.00 0.00 H ATOM 186 HD22 ASN A 252 30.507 8.321 5.049 1.00 0.00 H ATOM 187 HD21 ASN A 252 30.433 8.712 6.806 1.00 0.00 H ATOM 188 H ASN A 252 26.323 9.835 2.378 1.00 0.00 H ATOM 189 N SER A 253 28.269 8.260 1.512 1.00 9.59 N ATOM 190 CA SER A 253 28.855 7.787 0.264 1.00 9.29 C ATOM 191 C SER A 253 27.953 6.754 -0.403 1.00 8.54 C ATOM 192 O SER A 253 27.581 6.899 -1.568 1.00 8.62 O ATOM 193 CB SER A 253 30.237 7.184 0.521 1.00 9.77 C ATOM 194 OG SER A 253 30.645 6.364 -0.560 1.00 10.10 O ATOM 195 HA SER A 253 28.958 8.640 -0.406 1.00 0.00 H ATOM 196 HB2 SER A 253 30.200 6.583 1.430 1.00 0.00 H ATOM 197 HB3 SER A 253 30.959 7.990 0.649 1.00 0.00 H ATOM 198 HG SER A 253 31.540 5.988 -0.368 1.00 0.00 H ATOM 199 H SER A 253 27.365 7.857 1.832 1.00 0.00 H ATOM 200 N THR A 254 27.605 5.711 0.343 1.00 8.02 N ATOM 201 CA THR A 254 26.746 4.653 -0.175 1.00 7.42 C ATOM 202 C THR A 254 25.292 5.108 -0.250 1.00 6.97 C ATOM 203 O THR A 254 24.596 4.833 -1.227 1.00 7.23 O ATOM 204 CB THR A 254 26.829 3.385 0.695 1.00 7.57 C ATOM 205 OG1 THR A 254 27.575 3.656 1.888 1.00 8.15 O ATOM 206 CG2 THR A 254 27.486 2.246 -0.071 1.00 7.83 C ATOM 207 HA THR A 254 27.103 4.422 -1.179 1.00 0.00 H ATOM 208 HB THR A 254 25.815 3.087 0.961 1.00 0.00 H ATOM 209 HG1 THR A 254 27.622 2.835 2.440 1.00 0.00 H ATOM 210 HG23 THR A 254 26.916 2.043 -0.977 1.00 0.00 H ATOM 211 HG21 THR A 254 28.505 2.529 -0.337 1.00 0.00 H ATOM 212 HG22 THR A 254 27.507 1.354 0.554 1.00 0.00 H ATOM 213 H THR A 254 27.954 5.648 1.321 1.00 0.00 H ATOM 214 N ASN A 255 24.839 5.803 0.790 1.00 6.60 N ATOM 215 CA ASN A 255 23.466 6.294 0.842 1.00 6.42 C ATOM 216 C ASN A 255 23.168 7.211 -0.340 1.00 5.68 C ATOM 217 O ASN A 255 23.541 8.385 -0.338 1.00 5.64 O ATOM 218 CB ASN A 255 23.220 7.039 2.155 1.00 6.99 C ATOM 219 CG ASN A 255 23.201 6.111 3.353 1.00 7.40 C ATOM 220 OD1 ASN A 255 23.786 5.028 3.323 1.00 7.44 O ATOM 221 ND2 ASN A 255 22.525 6.530 4.416 1.00 8.03 N ATOM 222 HA ASN A 255 22.798 5.435 0.787 1.00 0.00 H ATOM 223 HB2 ASN A 255 24.013 7.774 2.294 1.00 0.00 H ATOM 224 HB3 ASN A 255 22.259 7.550 2.093 1.00 0.00 H ATOM 225 HD22 ASN A 255 22.046 7.453 4.397 1.00 0.00 H ATOM 226 HD21 ASN A 255 22.475 5.935 5.268 1.00 0.00 H ATOM 227 H ASN A 255 25.479 6.001 1.585 1.00 0.00 H ATOM 228 N LEU A 256 22.494 6.667 -1.348 1.00 5.43 N ATOM 229 CA LEU A 256 22.143 7.435 -2.538 1.00 4.99 C ATOM 230 C LEU A 256 20.859 8.228 -2.313 1.00 4.19 C ATOM 231 O LEU A 256 20.114 7.963 -1.370 1.00 4.35 O ATOM 232 CB LEU A 256 21.980 6.500 -3.738 1.00 5.75 C ATOM 233 CG LEU A 256 23.254 6.258 -4.548 1.00 6.70 C ATOM 234 CD1 LEU A 256 23.586 4.774 -4.590 1.00 7.49 C ATOM 235 CD2 LEU A 256 23.103 6.812 -5.956 1.00 7.11 C ATOM 236 HA LEU A 256 22.950 8.139 -2.742 1.00 0.00 H ATOM 237 HB2 LEU A 256 21.625 5.537 -3.371 1.00 0.00 H ATOM 238 HB3 LEU A 256 21.233 6.932 -4.404 1.00 0.00 H ATOM 239 HG LEU A 256 24.077 6.780 -4.060 1.00 0.00 H ATOM 240 HD21 LEU A 256 22.268 6.317 -6.452 1.00 0.00 H ATOM 241 HD22 LEU A 256 22.913 7.884 -5.905 1.00 0.00 H ATOM 242 HD23 LEU A 256 24.020 6.630 -6.517 1.00 0.00 H ATOM 243 HD11 LEU A 256 23.737 4.408 -3.574 1.00 0.00 H ATOM 244 HD12 LEU A 256 22.762 4.232 -5.055 1.00 0.00 H ATOM 245 HD13 LEU A 256 24.496 4.623 -5.171 1.00 0.00 H ATOM 246 H LEU A 256 22.210 5.669 -1.287 1.00 0.00 H ATOM 247 N PRO A 257 20.585 9.219 -3.181 1.00 3.69 N ATOM 248 CA PRO A 257 19.384 10.058 -3.075 1.00 3.32 C ATOM 249 C PRO A 257 18.100 9.234 -3.032 1.00 2.73 C ATOM 250 O PRO A 257 17.308 9.351 -2.096 1.00 3.02 O ATOM 251 CB PRO A 257 19.428 10.912 -4.345 1.00 3.67 C ATOM 252 CG PRO A 257 20.864 10.936 -4.738 1.00 3.96 C ATOM 253 CD PRO A 257 21.426 9.603 -4.330 1.00 4.03 C ATOM 254 HA PRO A 257 19.379 10.641 -2.154 1.00 0.00 H ATOM 255 HD3 PRO A 257 21.338 8.877 -5.139 1.00 0.00 H ATOM 256 HD2 PRO A 257 22.472 9.693 -4.036 1.00 0.00 H ATOM 257 HG3 PRO A 257 21.385 11.742 -4.221 1.00 0.00 H ATOM 258 HG2 PRO A 257 20.960 11.075 -5.815 1.00 0.00 H ATOM 259 HB2 PRO A 257 18.822 10.462 -5.132 1.00 0.00 H ATOM 260 HB3 PRO A 257 19.068 11.921 -4.142 1.00 0.00 H ATOM 261 N ARG A 258 17.901 8.398 -4.046 1.00 2.35 N ATOM 262 CA ARG A 258 16.714 7.553 -4.117 1.00 2.04 C ATOM 263 C ARG A 258 16.841 6.523 -5.236 1.00 1.45 C ATOM 264 O ARG A 258 16.872 5.319 -4.979 1.00 1.92 O ATOM 265 CB ARG A 258 15.461 8.409 -4.325 1.00 2.65 C ATOM 266 CG ARG A 258 14.163 7.646 -4.114 1.00 3.27 C ATOM 267 CD ARG A 258 13.762 7.626 -2.648 1.00 3.90 C ATOM 268 NE ARG A 258 12.635 6.726 -2.399 1.00 4.55 N ATOM 269 CZ ARG A 258 12.202 6.360 -1.186 1.00 5.20 C ATOM 270 NH1 ARG A 258 12.786 6.802 -0.070 1.00 5.43 N ATOM 271 NH2 ARG A 258 11.166 5.538 -1.087 1.00 5.94 N ATOM 272 HA ARG A 258 16.623 7.019 -3.171 1.00 0.00 H ATOM 273 HB2 ARG A 258 15.491 9.241 -3.622 1.00 0.00 H ATOM 274 HB3 ARG A 258 15.472 8.796 -5.344 1.00 0.00 H ATOM 275 HG2 ARG A 258 13.372 8.125 -4.692 1.00 0.00 H ATOM 276 HG3 ARG A 258 14.294 6.621 -4.460 1.00 0.00 H ATOM 277 HD2 ARG A 258 13.480 8.635 -2.346 1.00 0.00 H ATOM 278 HD3 ARG A 258 14.614 7.295 -2.054 1.00 0.00 H ATOM 279 HE ARG A 258 12.133 6.342 -3.225 1.00 0.00 H ATOM 280 HH12 ARG A 258 12.428 6.501 0.859 1.00 0.00 H ATOM 281 HH11 ARG A 258 13.599 7.448 -0.129 1.00 0.00 H ATOM 282 HH22 ARG A 258 10.821 5.247 -0.150 1.00 0.00 H ATOM 283 HH21 ARG A 258 10.699 5.185 -1.946 1.00 0.00 H ATOM 284 H ARG A 258 18.608 8.345 -4.807 1.00 0.00 H ATOM 285 N ASN A 259 16.922 7.001 -6.477 1.00 1.02 N ATOM 286 CA ASN A 259 17.051 6.119 -7.633 1.00 0.62 C ATOM 287 C ASN A 259 15.891 5.128 -7.704 1.00 0.54 C ATOM 288 O ASN A 259 16.058 3.944 -7.404 1.00 0.60 O ATOM 289 CB ASN A 259 18.379 5.363 -7.573 1.00 0.99 C ATOM 290 CG ASN A 259 19.556 6.282 -7.313 1.00 1.32 C ATOM 291 OD1 ASN A 259 19.696 6.839 -6.225 1.00 2.06 O ATOM 292 ND2 ASN A 259 20.411 6.446 -8.317 1.00 1.81 N ATOM 293 HA ASN A 259 17.028 6.736 -8.531 1.00 0.00 H ATOM 294 HB2 ASN A 259 18.327 4.626 -6.772 1.00 0.00 H ATOM 295 HB3 ASN A 259 18.536 4.854 -8.524 1.00 0.00 H ATOM 296 HD22 ASN A 259 20.253 5.955 -9.220 1.00 0.00 H ATOM 297 HD21 ASN A 259 21.238 7.065 -8.200 1.00 0.00 H ATOM 298 H ASN A 259 16.893 8.030 -6.626 1.00 0.00 H ATOM 299 N PRO A 260 14.696 5.602 -8.101 1.00 0.48 N ATOM 300 CA PRO A 260 13.500 4.756 -8.210 1.00 0.48 C ATOM 301 C PRO A 260 13.734 3.531 -9.090 1.00 0.51 C ATOM 302 O PRO A 260 13.568 2.391 -8.644 1.00 0.51 O ATOM 303 CB PRO A 260 12.459 5.685 -8.843 1.00 0.61 C ATOM 304 CG PRO A 260 12.916 7.059 -8.496 1.00 0.57 C ATOM 305 CD PRO A 260 14.417 7.001 -8.470 1.00 0.51 C ATOM 306 HA PRO A 260 13.196 4.355 -7.243 1.00 0.00 H ATOM 307 HD3 PRO A 260 14.834 7.238 -9.449 1.00 0.00 H ATOM 308 HD2 PRO A 260 14.822 7.689 -7.728 1.00 0.00 H ATOM 309 HG3 PRO A 260 12.531 7.351 -7.519 1.00 0.00 H ATOM 310 HG2 PRO A 260 12.577 7.772 -9.247 1.00 0.00 H ATOM 311 HB2 PRO A 260 12.431 5.551 -9.924 1.00 0.00 H ATOM 312 HB3 PRO A 260 11.469 5.493 -8.428 1.00 0.00 H ATOM 313 N SER A 261 14.133 3.767 -10.339 1.00 0.61 N ATOM 314 CA SER A 261 14.400 2.681 -11.281 1.00 0.72 C ATOM 315 C SER A 261 15.805 2.119 -11.078 1.00 0.71 C ATOM 316 O SER A 261 16.657 2.225 -11.959 1.00 0.81 O ATOM 317 CB SER A 261 14.238 3.175 -12.720 1.00 0.84 C ATOM 318 OG SER A 261 12.914 3.620 -12.961 1.00 0.89 O ATOM 319 HA SER A 261 13.679 1.885 -11.095 1.00 0.00 H ATOM 320 HB2 SER A 261 14.470 2.359 -13.405 1.00 0.00 H ATOM 321 HB3 SER A 261 14.928 4.001 -12.893 1.00 0.00 H ATOM 322 HG SER A 261 12.838 3.933 -13.897 1.00 0.00 H ATOM 323 H SER A 261 14.258 4.751 -10.653 1.00 0.00 H ATOM 324 N MET A 262 16.024 1.518 -9.912 1.00 0.65 N ATOM 325 CA MET A 262 17.308 0.923 -9.551 1.00 0.70 C ATOM 326 C MET A 262 17.146 0.092 -8.285 1.00 0.61 C ATOM 327 O MET A 262 17.547 -1.071 -8.237 1.00 0.89 O ATOM 328 CB MET A 262 18.371 2.003 -9.321 1.00 0.83 C ATOM 329 CG MET A 262 19.174 2.358 -10.563 1.00 0.97 C ATOM 330 SD MET A 262 20.953 2.239 -10.297 1.00 1.21 S ATOM 331 CE MET A 262 21.274 0.582 -10.896 1.00 1.84 C ATOM 332 HA MET A 262 17.635 0.288 -10.374 1.00 0.00 H ATOM 333 HB2 MET A 262 17.872 2.905 -8.966 1.00 0.00 H ATOM 334 HB3 MET A 262 19.062 1.647 -8.557 1.00 0.00 H ATOM 335 HG2 MET A 262 18.932 3.380 -10.855 1.00 0.00 H ATOM 336 HG3 MET A 262 18.895 1.676 -11.366 1.00 0.00 H ATOM 337 HE1 MET A 262 20.696 -0.133 -10.310 1.00 0.00 H ATOM 338 HE2 MET A 262 20.984 0.513 -11.944 1.00 0.00 H ATOM 339 HE3 MET A 262 22.337 0.361 -10.797 1.00 0.00 H ATOM 340 H MET A 262 15.245 1.469 -9.225 1.00 0.00 H ATOM 341 N ALA A 263 16.541 0.705 -7.268 1.00 0.50 N ATOM 342 CA ALA A 263 16.301 0.036 -5.995 1.00 0.42 C ATOM 343 C ALA A 263 14.855 0.218 -5.515 1.00 0.61 C ATOM 344 O ALA A 263 14.596 0.182 -4.312 1.00 1.62 O ATOM 345 CB ALA A 263 17.272 0.553 -4.944 1.00 0.73 C ATOM 346 HA ALA A 263 16.463 -1.031 -6.147 1.00 0.00 H ATOM 347 HB1 ALA A 263 18.294 0.355 -5.267 1.00 0.00 H ATOM 348 HB2 ALA A 263 17.131 1.626 -4.818 1.00 0.00 H ATOM 349 HB3 ALA A 263 17.084 0.047 -3.997 1.00 0.00 H ATOM 350 H ALA A 263 16.231 1.691 -7.386 1.00 0.00 H ATOM 351 N ASP A 264 13.912 0.407 -6.450 1.00 0.35 N ATOM 352 CA ASP A 264 12.506 0.581 -6.094 1.00 0.35 C ATOM 353 C ASP A 264 11.610 -0.210 -7.041 1.00 0.28 C ATOM 354 O ASP A 264 10.865 -1.093 -6.615 1.00 0.49 O ATOM 355 CB ASP A 264 12.127 2.062 -6.131 1.00 0.77 C ATOM 356 CG ASP A 264 11.231 2.459 -4.975 1.00 1.14 C ATOM 357 OD1 ASP A 264 10.010 2.209 -5.058 1.00 1.96 O ATOM 358 OD2 ASP A 264 11.749 3.020 -3.987 1.00 1.82 O ATOM 359 HA ASP A 264 12.361 0.204 -5.081 1.00 0.00 H ATOM 360 HB2 ASP A 264 13.039 2.658 -6.088 1.00 0.00 H ATOM 361 HB3 ASP A 264 11.604 2.266 -7.065 1.00 0.00 H ATOM 362 H ASP A 264 14.188 0.430 -7.452 1.00 0.00 H ATOM 363 N TYR A 265 11.692 0.107 -8.328 1.00 0.31 N ATOM 364 CA TYR A 265 10.894 -0.578 -9.339 1.00 0.34 C ATOM 365 C TYR A 265 11.383 -2.008 -9.540 1.00 0.29 C ATOM 366 O TYR A 265 10.618 -2.963 -9.402 1.00 0.28 O ATOM 367 CB TYR A 265 10.953 0.185 -10.665 1.00 0.45 C ATOM 368 CG TYR A 265 10.835 -0.703 -11.885 1.00 0.41 C ATOM 369 CD1 TYR A 265 9.668 -1.409 -12.148 1.00 1.28 C ATOM 370 CD2 TYR A 265 11.896 -0.835 -12.772 1.00 1.25 C ATOM 371 CE1 TYR A 265 9.562 -2.223 -13.260 1.00 1.30 C ATOM 372 CE2 TYR A 265 11.797 -1.645 -13.887 1.00 1.31 C ATOM 373 CZ TYR A 265 10.629 -2.337 -14.126 1.00 0.62 C ATOM 374 OH TYR A 265 10.527 -3.146 -15.235 1.00 0.79 O ATOM 375 HA TYR A 265 9.861 -0.612 -8.992 1.00 0.00 H ATOM 376 HB3 TYR A 265 11.904 0.715 -10.715 1.00 0.00 H ATOM 377 HB2 TYR A 265 10.136 0.906 -10.684 1.00 0.00 H ATOM 378 HD2 TYR A 265 12.822 -0.291 -12.585 1.00 0.00 H ATOM 379 HE2 TYR A 265 12.638 -1.736 -14.574 1.00 0.00 H ATOM 380 HE1 TYR A 265 8.640 -2.772 -13.451 1.00 0.00 H ATOM 381 HD1 TYR A 265 8.822 -1.320 -11.466 1.00 0.00 H ATOM 382 HH TYR A 265 9.630 -3.565 -15.255 1.00 0.00 H ATOM 383 H TYR A 265 12.342 0.863 -8.623 1.00 0.00 H ATOM 384 N GLU A 266 12.664 -2.145 -9.860 1.00 0.31 N ATOM 385 CA GLU A 266 13.271 -3.447 -10.080 1.00 0.31 C ATOM 386 C GLU A 266 13.457 -4.196 -8.766 1.00 0.27 C ATOM 387 O GLU A 266 13.350 -5.422 -8.729 1.00 0.28 O ATOM 388 CB GLU A 266 14.619 -3.290 -10.783 1.00 0.38 C ATOM 389 CG GLU A 266 14.499 -2.929 -12.254 1.00 0.45 C ATOM 390 CD GLU A 266 15.727 -3.322 -13.053 1.00 0.56 C ATOM 391 OE1 GLU A 266 16.070 -4.523 -13.060 1.00 1.20 O ATOM 392 OE2 GLU A 266 16.344 -2.429 -13.670 1.00 1.27 O ATOM 393 HA GLU A 266 12.600 -4.027 -10.714 1.00 0.00 H ATOM 394 HB2 GLU A 266 15.181 -2.503 -10.280 1.00 0.00 H ATOM 395 HB3 GLU A 266 15.162 -4.232 -10.702 1.00 0.00 H ATOM 396 HG2 GLU A 266 13.632 -3.442 -12.670 1.00 0.00 H ATOM 397 HG3 GLU A 266 14.357 -1.852 -12.339 1.00 0.00 H ATOM 398 H GLU A 266 13.252 -1.293 -9.956 1.00 0.00 H ATOM 399 N ALA A 267 13.738 -3.471 -7.687 1.00 0.30 N ATOM 400 CA ALA A 267 13.936 -4.099 -6.391 1.00 0.31 C ATOM 401 C ALA A 267 12.656 -4.768 -5.890 1.00 0.26 C ATOM 402 O ALA A 267 12.658 -5.949 -5.525 1.00 0.29 O ATOM 403 CB ALA A 267 14.430 -3.076 -5.380 1.00 0.37 C ATOM 404 HA ALA A 267 14.691 -4.876 -6.509 1.00 0.00 H ATOM 405 HB1 ALA A 267 15.376 -2.657 -5.722 1.00 0.00 H ATOM 406 HB2 ALA A 267 13.693 -2.279 -5.282 1.00 0.00 H ATOM 407 HB3 ALA A 267 14.574 -3.561 -4.415 1.00 0.00 H ATOM 408 H ALA A 267 13.817 -2.438 -7.772 1.00 0.00 H ATOM 409 N ARG A 268 11.562 -4.008 -5.878 1.00 0.27 N ATOM 410 CA ARG A 268 10.276 -4.527 -5.422 1.00 0.27 C ATOM 411 C ARG A 268 9.872 -5.733 -6.252 1.00 0.23 C ATOM 412 O ARG A 268 9.687 -6.824 -5.719 1.00 0.24 O ATOM 413 CB ARG A 268 9.202 -3.444 -5.508 1.00 0.35 C ATOM 414 CG ARG A 268 9.325 -2.379 -4.430 1.00 0.57 C ATOM 415 CD ARG A 268 9.089 -2.956 -3.043 1.00 0.71 C ATOM 416 NE ARG A 268 10.246 -2.769 -2.169 1.00 0.98 N ATOM 417 CZ ARG A 268 10.669 -1.587 -1.700 1.00 0.98 C ATOM 418 NH1 ARG A 268 10.043 -0.448 -2.006 1.00 1.18 N ATOM 419 NH2 ARG A 268 11.735 -1.544 -0.913 1.00 1.79 N ATOM 420 HA ARG A 268 10.376 -4.835 -4.381 1.00 0.00 H ATOM 421 HB2 ARG A 268 9.277 -2.960 -6.482 1.00 0.00 H ATOM 422 HB3 ARG A 268 8.225 -3.919 -5.414 1.00 0.00 H ATOM 423 HG2 ARG A 268 10.326 -1.950 -4.469 1.00 0.00 H ATOM 424 HG3 ARG A 268 8.588 -1.598 -4.618 1.00 0.00 H ATOM 425 HD2 ARG A 268 8.886 -4.023 -3.135 1.00 0.00 H ATOM 426 HD3 ARG A 268 8.227 -2.460 -2.597 1.00 0.00 H ATOM 427 HE ARG A 268 10.781 -3.616 -1.890 1.00 0.00 H ATOM 428 HH12 ARG A 268 10.393 0.455 -1.628 1.00 0.00 H ATOM 429 HH11 ARG A 268 9.205 -0.464 -2.622 1.00 0.00 H ATOM 430 HH22 ARG A 268 12.072 -0.632 -0.543 1.00 0.00 H ATOM 431 HH21 ARG A 268 12.234 -2.422 -0.665 1.00 0.00 H ATOM 432 H ARG A 268 11.626 -3.022 -6.201 1.00 0.00 H ATOM 433 N ILE A 269 9.754 -5.517 -7.559 1.00 0.24 N ATOM 434 CA ILE A 269 9.395 -6.563 -8.507 1.00 0.25 C ATOM 435 C ILE A 269 10.261 -7.803 -8.333 1.00 0.23 C ATOM 436 O ILE A 269 9.757 -8.925 -8.345 1.00 0.29 O ATOM 437 CB ILE A 269 9.564 -6.011 -9.921 1.00 0.29 C ATOM 438 CG1 ILE A 269 8.267 -5.359 -10.364 1.00 0.35 C ATOM 439 CG2 ILE A 269 10.017 -7.069 -10.919 1.00 0.32 C ATOM 440 CD1 ILE A 269 7.312 -6.331 -10.998 1.00 0.60 C ATOM 441 HA ILE A 269 8.361 -6.859 -8.328 1.00 0.00 H ATOM 442 HB ILE A 269 10.359 -5.266 -9.896 1.00 0.00 H ATOM 443 HG12 ILE A 269 7.785 -4.915 -9.493 1.00 0.00 H ATOM 444 HG13 ILE A 269 8.499 -4.577 -11.087 1.00 0.00 H ATOM 445 HD11 ILE A 269 7.778 -6.776 -11.877 1.00 0.00 H ATOM 446 HD12 ILE A 269 7.064 -7.114 -10.282 1.00 0.00 H ATOM 447 HD13 ILE A 269 6.404 -5.806 -11.294 1.00 0.00 H ATOM 448 HG21 ILE A 269 10.977 -7.477 -10.604 1.00 0.00 H ATOM 449 HG22 ILE A 269 9.277 -7.869 -10.960 1.00 0.00 H ATOM 450 HG23 ILE A 269 10.119 -6.616 -11.905 1.00 0.00 H ATOM 451 H ILE A 269 9.926 -4.557 -7.921 1.00 0.00 H ATOM 452 N PHE A 270 11.561 -7.582 -8.165 1.00 0.19 N ATOM 453 CA PHE A 270 12.509 -8.668 -7.970 1.00 0.21 C ATOM 454 C PHE A 270 12.088 -9.534 -6.789 1.00 0.21 C ATOM 455 O PHE A 270 12.313 -10.744 -6.791 1.00 0.29 O ATOM 456 CB PHE A 270 13.919 -8.119 -7.743 1.00 0.26 C ATOM 457 CG PHE A 270 14.925 -9.177 -7.390 1.00 0.46 C ATOM 458 CD1 PHE A 270 15.292 -10.139 -8.317 1.00 1.22 C ATOM 459 CD2 PHE A 270 15.503 -9.209 -6.131 1.00 1.33 C ATOM 460 CE1 PHE A 270 16.217 -11.114 -7.995 1.00 1.35 C ATOM 461 CE2 PHE A 270 16.429 -10.182 -5.803 1.00 1.53 C ATOM 462 CZ PHE A 270 16.786 -11.136 -6.736 1.00 1.05 C ATOM 463 HA PHE A 270 12.516 -9.281 -8.871 1.00 0.00 H ATOM 464 HB2 PHE A 270 14.247 -7.622 -8.656 1.00 0.00 H ATOM 465 HB3 PHE A 270 13.880 -7.394 -6.930 1.00 0.00 H ATOM 466 HD2 PHE A 270 15.225 -8.459 -5.391 1.00 0.00 H ATOM 467 HE2 PHE A 270 16.877 -10.196 -4.809 1.00 0.00 H ATOM 468 HZ PHE A 270 17.515 -11.905 -6.480 1.00 0.00 H ATOM 469 HE1 PHE A 270 16.497 -11.865 -8.734 1.00 0.00 H ATOM 470 HD1 PHE A 270 14.846 -10.127 -9.312 1.00 0.00 H ATOM 471 H PHE A 270 11.911 -6.603 -8.173 1.00 0.00 H ATOM 472 N THR A 271 11.449 -8.922 -5.786 1.00 0.19 N ATOM 473 CA THR A 271 10.989 -9.678 -4.639 1.00 0.21 C ATOM 474 C THR A 271 9.691 -10.415 -4.958 1.00 0.24 C ATOM 475 O THR A 271 9.450 -11.497 -4.424 1.00 0.36 O ATOM 476 CB THR A 271 10.783 -8.794 -3.390 1.00 0.22 C ATOM 477 OG1 THR A 271 9.510 -8.140 -3.443 1.00 0.22 O ATOM 478 CG2 THR A 271 11.888 -7.754 -3.264 1.00 0.29 C ATOM 479 HA THR A 271 11.775 -10.399 -4.413 1.00 0.00 H ATOM 480 HB THR A 271 10.817 -9.444 -2.516 1.00 0.00 H ATOM 481 HG1 THR A 271 9.466 -7.570 -4.252 1.00 0.00 H ATOM 482 HG23 THR A 271 12.855 -8.256 -3.224 1.00 0.00 H ATOM 483 HG21 THR A 271 11.858 -7.088 -4.126 1.00 0.00 H ATOM 484 HG22 THR A 271 11.739 -7.176 -2.352 1.00 0.00 H ATOM 485 H THR A 271 11.281 -7.897 -5.830 1.00 0.00 H ATOM 486 N PHE A 272 8.852 -9.853 -5.840 1.00 0.23 N ATOM 487 CA PHE A 272 7.604 -10.525 -6.186 1.00 0.29 C ATOM 488 C PHE A 272 7.871 -11.674 -7.153 1.00 0.38 C ATOM 489 O PHE A 272 7.578 -12.833 -6.856 1.00 0.57 O ATOM 490 CB PHE A 272 6.614 -9.533 -6.789 1.00 0.28 C ATOM 491 CG PHE A 272 6.089 -8.542 -5.791 1.00 0.24 C ATOM 492 CD1 PHE A 272 5.053 -8.881 -4.935 1.00 1.20 C ATOM 493 CD2 PHE A 272 6.627 -7.268 -5.713 1.00 1.21 C ATOM 494 CE1 PHE A 272 4.566 -7.967 -4.020 1.00 1.22 C ATOM 495 CE2 PHE A 272 6.145 -6.350 -4.800 1.00 1.21 C ATOM 496 CZ PHE A 272 5.114 -6.700 -3.952 1.00 0.29 C ATOM 497 HA PHE A 272 7.166 -10.936 -5.276 1.00 0.00 H ATOM 498 HB2 PHE A 272 7.114 -8.988 -7.590 1.00 0.00 H ATOM 499 HB3 PHE A 272 5.772 -10.090 -7.201 1.00 0.00 H ATOM 500 HD2 PHE A 272 7.441 -6.986 -6.381 1.00 0.00 H ATOM 501 HE2 PHE A 272 6.578 -5.351 -4.750 1.00 0.00 H ATOM 502 HZ PHE A 272 4.732 -5.978 -3.230 1.00 0.00 H ATOM 503 HE1 PHE A 272 3.750 -8.245 -3.352 1.00 0.00 H ATOM 504 HD1 PHE A 272 4.618 -9.879 -4.984 1.00 0.00 H ATOM 505 H PHE A 272 9.090 -8.940 -6.277 1.00 0.00 H ATOM 506 N GLY A 273 8.443 -11.333 -8.302 1.00 0.50 N ATOM 507 CA GLY A 273 8.774 -12.320 -9.318 1.00 0.60 C ATOM 508 C GLY A 273 8.041 -12.083 -10.623 1.00 0.74 C ATOM 509 O GLY A 273 7.086 -11.307 -10.671 1.00 1.61 O ATOM 510 HA3 GLY A 273 8.509 -13.309 -8.943 1.00 0.00 H ATOM 511 HA2 GLY A 273 9.847 -12.280 -9.508 1.00 0.00 H ATOM 512 H GLY A 273 8.660 -10.332 -8.480 1.00 0.00 H ATOM 513 N THR A 274 8.484 -12.767 -11.680 1.00 0.70 N ATOM 514 CA THR A 274 7.857 -12.652 -12.997 1.00 0.71 C ATOM 515 C THR A 274 6.354 -12.948 -12.933 1.00 0.80 C ATOM 516 O THR A 274 5.580 -12.413 -13.728 1.00 1.61 O ATOM 517 CB THR A 274 8.511 -13.607 -14.013 1.00 0.80 C ATOM 518 OG1 THR A 274 9.900 -13.773 -13.706 1.00 0.96 O ATOM 519 CG2 THR A 274 8.361 -13.075 -15.430 1.00 0.85 C ATOM 520 HA THR A 274 8.004 -11.622 -13.323 1.00 0.00 H ATOM 521 HB THR A 274 8.007 -14.571 -13.948 1.00 0.00 H ATOM 522 HG1 THR A 274 10.311 -14.388 -14.364 1.00 0.00 H ATOM 523 HG23 THR A 274 7.303 -12.950 -15.660 1.00 0.00 H ATOM 524 HG21 THR A 274 8.868 -12.113 -15.511 1.00 0.00 H ATOM 525 HG22 THR A 274 8.805 -13.782 -16.131 1.00 0.00 H ATOM 526 H THR A 274 9.300 -13.401 -11.564 1.00 0.00 H ATOM 527 N TRP A 275 5.959 -13.800 -11.975 1.00 0.47 N ATOM 528 CA TRP A 275 4.567 -14.184 -11.763 1.00 0.42 C ATOM 529 C TRP A 275 3.658 -12.946 -11.685 1.00 0.37 C ATOM 530 O TRP A 275 4.129 -11.846 -11.410 1.00 0.36 O ATOM 531 CB TRP A 275 4.510 -15.018 -10.480 1.00 0.42 C ATOM 532 CG TRP A 275 3.162 -15.134 -9.859 1.00 0.37 C ATOM 533 CD1 TRP A 275 2.112 -15.878 -10.312 1.00 0.41 C ATOM 534 CD2 TRP A 275 2.726 -14.503 -8.653 1.00 0.31 C ATOM 535 NE1 TRP A 275 1.042 -15.744 -9.464 1.00 0.37 N ATOM 536 CE2 TRP A 275 1.392 -14.906 -8.439 1.00 0.31 C ATOM 537 CE3 TRP A 275 3.329 -13.632 -7.731 1.00 0.28 C ATOM 538 CZ2 TRP A 275 0.652 -14.475 -7.347 1.00 0.27 C ATOM 539 CZ3 TRP A 275 2.584 -13.208 -6.649 1.00 0.24 C ATOM 540 CH2 TRP A 275 1.261 -13.629 -6.467 1.00 0.24 C ATOM 541 HA TRP A 275 4.200 -14.775 -12.602 1.00 0.00 H ATOM 542 HB2 TRP A 275 4.861 -16.023 -10.715 1.00 0.00 H ATOM 543 HB3 TRP A 275 5.179 -14.562 -9.751 1.00 0.00 H ATOM 544 HE1 TRP A 275 0.116 -16.204 -9.580 1.00 0.00 H ATOM 545 HD1 TRP A 275 2.122 -16.489 -11.215 1.00 0.00 H ATOM 546 HZ2 TRP A 275 -0.378 -14.800 -7.198 1.00 0.00 H ATOM 547 HH2 TRP A 275 0.704 -13.272 -5.601 1.00 0.00 H ATOM 548 HZ3 TRP A 275 3.034 -12.532 -5.922 1.00 0.00 H ATOM 549 HE3 TRP A 275 4.358 -13.300 -7.866 1.00 0.00 H ATOM 550 H TRP A 275 6.683 -14.209 -11.350 1.00 0.00 H ATOM 551 N ILE A 276 2.365 -13.127 -11.959 1.00 0.38 N ATOM 552 CA ILE A 276 1.410 -12.020 -11.952 1.00 0.35 C ATOM 553 C ILE A 276 0.025 -12.486 -11.501 1.00 0.39 C ATOM 554 O ILE A 276 -0.226 -13.685 -11.384 1.00 0.64 O ATOM 555 CB ILE A 276 1.312 -11.378 -13.356 1.00 0.39 C ATOM 556 CG1 ILE A 276 0.976 -9.886 -13.262 1.00 0.47 C ATOM 557 CG2 ILE A 276 0.277 -12.103 -14.205 1.00 0.64 C ATOM 558 CD1 ILE A 276 1.680 -9.042 -14.301 1.00 0.99 C ATOM 559 HA ILE A 276 1.773 -11.277 -11.242 1.00 0.00 H ATOM 560 HB ILE A 276 2.286 -11.474 -13.835 1.00 0.00 H ATOM 561 HG12 ILE A 276 -0.100 -9.766 -13.391 1.00 0.00 H ATOM 562 HG13 ILE A 276 1.265 -9.529 -12.274 1.00 0.00 H ATOM 563 HD11 ILE A 276 2.758 -9.142 -14.179 1.00 0.00 H ATOM 564 HD12 ILE A 276 1.393 -9.380 -15.297 1.00 0.00 H ATOM 565 HD13 ILE A 276 1.394 -7.998 -14.173 1.00 0.00 H ATOM 566 HG21 ILE A 276 0.566 -13.149 -14.313 1.00 0.00 H ATOM 567 HG22 ILE A 276 -0.697 -12.042 -13.719 1.00 0.00 H ATOM 568 HG23 ILE A 276 0.224 -11.636 -15.188 1.00 0.00 H ATOM 569 H ILE A 276 2.026 -14.084 -12.184 1.00 0.00 H ATOM 570 N TYR A 277 -0.864 -11.531 -11.222 1.00 0.29 N ATOM 571 CA TYR A 277 -2.207 -11.853 -10.754 1.00 0.31 C ATOM 572 C TYR A 277 -3.229 -10.835 -11.261 1.00 0.38 C ATOM 573 O TYR A 277 -4.248 -11.211 -11.840 1.00 0.84 O ATOM 574 CB TYR A 277 -2.237 -11.911 -9.217 1.00 0.31 C ATOM 575 CG TYR A 277 -1.187 -11.046 -8.540 1.00 0.28 C ATOM 576 CD1 TYR A 277 0.143 -11.447 -8.477 1.00 1.23 C ATOM 577 CD2 TYR A 277 -1.525 -9.824 -7.975 1.00 1.19 C ATOM 578 CE1 TYR A 277 1.099 -10.665 -7.879 1.00 1.22 C ATOM 579 CE2 TYR A 277 -0.569 -9.032 -7.367 1.00 1.21 C ATOM 580 CZ TYR A 277 0.743 -9.457 -7.322 1.00 0.27 C ATOM 581 OH TYR A 277 1.699 -8.672 -6.720 1.00 0.29 O ATOM 582 HA TYR A 277 -2.476 -12.831 -11.153 1.00 0.00 H ATOM 583 HB3 TYR A 277 -2.078 -12.945 -8.911 1.00 0.00 H ATOM 584 HB2 TYR A 277 -3.220 -11.581 -8.881 1.00 0.00 H ATOM 585 HD2 TYR A 277 -2.560 -9.484 -8.011 1.00 0.00 H ATOM 586 HE2 TYR A 277 -0.850 -8.076 -6.925 1.00 0.00 H ATOM 587 HE1 TYR A 277 2.136 -10.999 -7.845 1.00 0.00 H ATOM 588 HD1 TYR A 277 0.433 -12.404 -8.912 1.00 0.00 H ATOM 589 HH TYR A 277 2.578 -9.123 -6.776 1.00 0.00 H ATOM 590 H TYR A 277 -0.593 -10.534 -11.341 1.00 0.00 H ATOM 591 N SER A 278 -2.950 -9.549 -11.037 1.00 0.49 N ATOM 592 CA SER A 278 -3.848 -8.477 -11.471 1.00 0.53 C ATOM 593 C SER A 278 -3.089 -7.404 -12.256 1.00 0.46 C ATOM 594 O SER A 278 -3.217 -7.322 -13.478 1.00 0.61 O ATOM 595 CB SER A 278 -4.552 -7.852 -10.264 1.00 0.55 C ATOM 596 OG SER A 278 -3.616 -7.439 -9.283 1.00 1.36 O ATOM 597 HA SER A 278 -4.598 -8.912 -12.132 1.00 0.00 H ATOM 598 HB2 SER A 278 -5.227 -8.587 -9.825 1.00 0.00 H ATOM 599 HB3 SER A 278 -5.126 -6.986 -10.595 1.00 0.00 H ATOM 600 HG SER A 278 -4.098 -7.040 -8.516 1.00 0.00 H ATOM 601 H SER A 278 -2.070 -9.302 -10.540 1.00 0.00 H ATOM 602 N VAL A 279 -2.293 -6.595 -11.551 1.00 0.35 N ATOM 603 CA VAL A 279 -1.506 -5.538 -12.183 1.00 0.40 C ATOM 604 C VAL A 279 -0.026 -5.787 -11.953 1.00 0.55 C ATOM 605 O VAL A 279 0.340 -6.713 -11.226 1.00 1.39 O ATOM 606 CB VAL A 279 -1.882 -4.134 -11.635 1.00 0.36 C ATOM 607 CG1 VAL A 279 -3.339 -4.112 -11.192 1.00 0.50 C ATOM 608 CG2 VAL A 279 -0.963 -3.694 -10.488 1.00 0.47 C ATOM 609 HA VAL A 279 -1.727 -5.557 -13.250 1.00 0.00 H ATOM 610 HB VAL A 279 -1.745 -3.420 -12.447 1.00 0.00 H ATOM 611 HG11 VAL A 279 -3.980 -4.346 -12.042 1.00 0.00 H ATOM 612 HG12 VAL A 279 -3.490 -4.853 -10.407 1.00 0.00 H ATOM 613 HG13 VAL A 279 -3.587 -3.121 -10.811 1.00 0.00 H ATOM 614 HG21 VAL A 279 -1.039 -4.409 -9.669 1.00 0.00 H ATOM 615 HG22 VAL A 279 0.067 -3.655 -10.844 1.00 0.00 H ATOM 616 HG23 VAL A 279 -1.266 -2.707 -10.139 1.00 0.00 H ATOM 617 H VAL A 279 -2.232 -6.721 -10.521 1.00 0.00 H ATOM 618 N ASN A 280 0.819 -4.953 -12.549 1.00 0.42 N ATOM 619 CA ASN A 280 2.253 -5.082 -12.368 1.00 0.36 C ATOM 620 C ASN A 280 2.587 -4.968 -10.885 1.00 0.26 C ATOM 621 O ASN A 280 2.166 -4.015 -10.215 1.00 0.26 O ATOM 622 CB ASN A 280 2.996 -4.006 -13.163 1.00 0.43 C ATOM 623 CG ASN A 280 2.662 -4.044 -14.641 1.00 0.71 C ATOM 624 OD1 ASN A 280 1.728 -3.384 -15.096 1.00 1.41 O ATOM 625 ND2 ASN A 280 3.427 -4.820 -15.400 1.00 1.36 N ATOM 626 HA ASN A 280 2.572 -6.057 -12.737 1.00 0.00 H ATOM 627 HB2 ASN A 280 2.723 -3.028 -12.767 1.00 0.00 H ATOM 628 HB3 ASN A 280 4.068 -4.159 -13.042 1.00 0.00 H ATOM 629 HD22 ASN A 280 4.206 -5.360 -14.972 1.00 0.00 H ATOM 630 HD21 ASN A 280 3.247 -4.887 -16.422 1.00 0.00 H ATOM 631 H ASN A 280 0.446 -4.195 -13.156 1.00 0.00 H ATOM 632 N LYS A 281 3.323 -5.954 -10.375 1.00 0.25 N ATOM 633 CA LYS A 281 3.706 -5.980 -8.963 1.00 0.24 C ATOM 634 C LYS A 281 4.352 -4.663 -8.533 1.00 0.19 C ATOM 635 O LYS A 281 4.197 -4.240 -7.387 1.00 0.21 O ATOM 636 CB LYS A 281 4.644 -7.147 -8.666 1.00 0.33 C ATOM 637 CG LYS A 281 4.121 -8.499 -9.128 1.00 0.62 C ATOM 638 CD LYS A 281 5.155 -9.242 -9.961 1.00 0.55 C ATOM 639 CE LYS A 281 5.056 -8.893 -11.441 1.00 0.90 C ATOM 640 NZ LYS A 281 3.715 -9.201 -12.005 1.00 1.41 N ATOM 641 HA LYS A 281 2.791 -6.115 -8.386 1.00 0.00 H ATOM 642 HB2 LYS A 281 5.594 -6.958 -9.166 1.00 0.00 H ATOM 643 HB3 LYS A 281 4.804 -7.192 -7.589 1.00 0.00 H ATOM 644 HG2 LYS A 281 3.872 -9.100 -8.254 1.00 0.00 H ATOM 645 HG3 LYS A 281 3.225 -8.346 -9.729 1.00 0.00 H ATOM 646 HD2 LYS A 281 6.150 -8.979 -9.603 1.00 0.00 H ATOM 647 HD3 LYS A 281 4.999 -10.314 -9.841 1.00 0.00 H ATOM 648 HE2 LYS A 281 5.806 -9.465 -11.987 1.00 0.00 H ATOM 649 HE3 LYS A 281 5.252 -7.828 -11.564 1.00 0.00 H ATOM 650 HZ1 LYS A 281 3.521 -10.217 -11.899 1.00 0.00 H ATOM 651 HZ2 LYS A 281 2.992 -8.654 -11.495 1.00 0.00 H ATOM 652 HZ3 LYS A 281 3.697 -8.946 -13.013 1.00 0.00 H ATOM 653 H LYS A 281 3.634 -6.727 -10.998 1.00 0.00 H ATOM 654 N GLU A 282 5.047 -4.002 -9.459 1.00 0.20 N ATOM 655 CA GLU A 282 5.671 -2.711 -9.161 1.00 0.23 C ATOM 656 C GLU A 282 4.621 -1.709 -8.711 1.00 0.23 C ATOM 657 O GLU A 282 4.830 -0.980 -7.740 1.00 0.28 O ATOM 658 CB GLU A 282 6.449 -2.120 -10.347 1.00 0.30 C ATOM 659 CG GLU A 282 5.962 -2.515 -11.730 1.00 0.34 C ATOM 660 CD GLU A 282 6.121 -1.406 -12.753 1.00 0.49 C ATOM 661 OE1 GLU A 282 5.792 -0.245 -12.429 1.00 1.21 O ATOM 662 OE2 GLU A 282 6.569 -1.698 -13.881 1.00 1.27 O ATOM 663 HA GLU A 282 6.389 -2.902 -8.363 1.00 0.00 H ATOM 664 HB2 GLU A 282 6.395 -1.034 -10.273 1.00 0.00 H ATOM 665 HB3 GLU A 282 7.488 -2.438 -10.256 1.00 0.00 H ATOM 666 HG2 GLU A 282 6.532 -3.382 -12.065 1.00 0.00 H ATOM 667 HG3 GLU A 282 4.907 -2.779 -11.665 1.00 0.00 H ATOM 668 H GLU A 282 5.148 -4.410 -10.410 1.00 0.00 H ATOM 669 N GLN A 283 3.485 -1.687 -9.403 1.00 0.19 N ATOM 670 CA GLN A 283 2.399 -0.784 -9.044 1.00 0.20 C ATOM 671 C GLN A 283 1.943 -1.080 -7.620 1.00 0.18 C ATOM 672 O GLN A 283 1.771 -0.169 -6.803 1.00 0.19 O ATOM 673 CB GLN A 283 1.227 -0.939 -10.015 1.00 0.22 C ATOM 674 CG GLN A 283 0.421 0.335 -10.205 1.00 0.28 C ATOM 675 CD GLN A 283 -0.475 0.281 -11.428 1.00 0.71 C ATOM 676 OE1 GLN A 283 -0.120 0.781 -12.494 1.00 1.51 O ATOM 677 NE2 GLN A 283 -1.645 -0.329 -11.278 1.00 1.45 N ATOM 678 HA GLN A 283 2.758 0.243 -9.104 1.00 0.00 H ATOM 679 HB2 GLN A 283 1.620 -1.246 -10.984 1.00 0.00 H ATOM 680 HB3 GLN A 283 0.562 -1.714 -9.632 1.00 0.00 H ATOM 681 HG2 GLN A 283 -0.200 0.490 -9.323 1.00 0.00 H ATOM 682 HG3 GLN A 283 1.111 1.172 -10.314 1.00 0.00 H ATOM 683 HE22 GLN A 283 -1.904 -0.738 -10.357 1.00 0.00 H ATOM 684 HE21 GLN A 283 -2.302 -0.398 -12.081 1.00 0.00 H ATOM 685 H GLN A 283 3.370 -2.326 -10.215 1.00 0.00 H ATOM 686 N LEU A 284 1.774 -2.369 -7.326 1.00 0.16 N ATOM 687 CA LEU A 284 1.366 -2.799 -5.994 1.00 0.17 C ATOM 688 C LEU A 284 2.369 -2.318 -4.948 1.00 0.18 C ATOM 689 O LEU A 284 1.987 -1.829 -3.885 1.00 0.22 O ATOM 690 CB LEU A 284 1.250 -4.324 -5.934 1.00 0.18 C ATOM 691 CG LEU A 284 -0.080 -4.896 -6.423 1.00 0.17 C ATOM 692 CD1 LEU A 284 0.132 -5.740 -7.669 1.00 0.20 C ATOM 693 CD2 LEU A 284 -0.741 -5.720 -5.328 1.00 0.21 C ATOM 694 HA LEU A 284 0.391 -2.361 -5.780 1.00 0.00 H ATOM 695 HB2 LEU A 284 2.045 -4.747 -6.548 1.00 0.00 H ATOM 696 HB3 LEU A 284 1.389 -4.632 -4.898 1.00 0.00 H ATOM 697 HG LEU A 284 -0.741 -4.066 -6.675 1.00 0.00 H ATOM 698 HD21 LEU A 284 -0.083 -6.542 -5.047 1.00 0.00 H ATOM 699 HD22 LEU A 284 -0.925 -5.087 -4.460 1.00 0.00 H ATOM 700 HD23 LEU A 284 -1.687 -6.119 -5.696 1.00 0.00 H ATOM 701 HD11 LEU A 284 0.564 -5.122 -8.456 1.00 0.00 H ATOM 702 HD12 LEU A 284 0.809 -6.562 -7.438 1.00 0.00 H ATOM 703 HD13 LEU A 284 -0.826 -6.139 -8.003 1.00 0.00 H ATOM 704 H LEU A 284 1.937 -3.084 -8.063 1.00 0.00 H ATOM 705 N ALA A 285 3.655 -2.462 -5.261 1.00 0.19 N ATOM 706 CA ALA A 285 4.719 -2.048 -4.354 1.00 0.23 C ATOM 707 C ALA A 285 4.745 -0.533 -4.154 1.00 0.25 C ATOM 708 O ALA A 285 5.002 -0.058 -3.047 1.00 0.30 O ATOM 709 CB ALA A 285 6.062 -2.530 -4.870 1.00 0.27 C ATOM 710 HA ALA A 285 4.518 -2.503 -3.384 1.00 0.00 H ATOM 711 HB1 ALA A 285 6.054 -3.618 -4.940 1.00 0.00 H ATOM 712 HB2 ALA A 285 6.246 -2.103 -5.856 1.00 0.00 H ATOM 713 HB3 ALA A 285 6.848 -2.214 -4.184 1.00 0.00 H ATOM 714 H ALA A 285 3.908 -2.882 -6.178 1.00 0.00 H ATOM 715 N ARG A 286 4.485 0.217 -5.229 1.00 0.23 N ATOM 716 CA ARG A 286 4.479 1.677 -5.175 1.00 0.26 C ATOM 717 C ARG A 286 3.525 2.168 -4.096 1.00 0.25 C ATOM 718 O ARG A 286 3.854 3.075 -3.330 1.00 0.31 O ATOM 719 CB ARG A 286 4.081 2.260 -6.532 1.00 0.27 C ATOM 720 CG ARG A 286 5.242 2.384 -7.505 1.00 0.31 C ATOM 721 CD ARG A 286 4.961 3.423 -8.579 1.00 0.58 C ATOM 722 NE ARG A 286 6.175 3.817 -9.293 1.00 1.14 N ATOM 723 CZ ARG A 286 6.207 4.627 -10.359 1.00 1.68 C ATOM 724 NH1 ARG A 286 5.093 5.155 -10.872 1.00 2.13 N ATOM 725 NH2 ARG A 286 7.373 4.914 -10.922 1.00 2.51 N ATOM 726 HA ARG A 286 5.486 2.014 -4.930 1.00 0.00 H ATOM 727 HB2 ARG A 286 3.325 1.613 -6.977 1.00 0.00 H ATOM 728 HB3 ARG A 286 3.659 3.252 -6.371 1.00 0.00 H ATOM 729 HG2 ARG A 286 6.136 2.676 -6.954 1.00 0.00 H ATOM 730 HG3 ARG A 286 5.410 1.418 -7.982 1.00 0.00 H ATOM 731 HD2 ARG A 286 4.527 4.306 -8.110 1.00 0.00 H ATOM 732 HD3 ARG A 286 4.251 3.007 -9.294 1.00 0.00 H ATOM 733 HE ARG A 286 7.081 3.440 -8.947 1.00 0.00 H ATOM 734 HH12 ARG A 286 5.148 5.781 -11.701 1.00 0.00 H ATOM 735 HH11 ARG A 286 4.170 4.940 -10.443 1.00 0.00 H ATOM 736 HH22 ARG A 286 7.410 5.542 -11.750 1.00 0.00 H ATOM 737 HH21 ARG A 286 8.250 4.511 -10.535 1.00 0.00 H ATOM 738 H ARG A 286 4.280 -0.254 -6.133 1.00 0.00 H ATOM 739 N ALA A 287 2.351 1.547 -4.028 1.00 0.21 N ATOM 740 CA ALA A 287 1.358 1.904 -3.022 1.00 0.22 C ATOM 741 C ALA A 287 1.932 1.740 -1.617 1.00 0.25 C ATOM 742 O ALA A 287 1.705 2.573 -0.739 1.00 0.38 O ATOM 743 CB ALA A 287 0.116 1.044 -3.182 1.00 0.22 C ATOM 744 HA ALA A 287 1.085 2.950 -3.164 1.00 0.00 H ATOM 745 HB1 ALA A 287 -0.308 1.201 -4.174 1.00 0.00 H ATOM 746 HB2 ALA A 287 0.385 -0.006 -3.062 1.00 0.00 H ATOM 747 HB3 ALA A 287 -0.617 1.322 -2.424 1.00 0.00 H ATOM 748 H ALA A 287 2.136 0.790 -4.708 1.00 0.00 H ATOM 749 N GLY A 288 2.679 0.657 -1.414 1.00 0.25 N ATOM 750 CA GLY A 288 3.279 0.391 -0.120 1.00 0.27 C ATOM 751 C GLY A 288 3.320 -1.091 0.191 1.00 0.26 C ATOM 752 O GLY A 288 2.854 -1.521 1.247 1.00 0.31 O ATOM 753 HA3 GLY A 288 2.696 0.897 0.650 1.00 0.00 H ATOM 754 HA2 GLY A 288 4.297 0.780 -0.117 1.00 0.00 H ATOM 755 H GLY A 288 2.835 -0.010 -2.196 1.00 0.00 H ATOM 756 N PHE A 289 3.869 -1.873 -0.739 1.00 0.26 N ATOM 757 CA PHE A 289 3.961 -3.321 -0.573 1.00 0.29 C ATOM 758 C PHE A 289 5.356 -3.838 -0.925 1.00 0.28 C ATOM 759 O PHE A 289 6.068 -3.243 -1.733 1.00 0.34 O ATOM 760 CB PHE A 289 2.915 -4.014 -1.448 1.00 0.36 C ATOM 761 CG PHE A 289 1.556 -4.093 -0.812 1.00 0.39 C ATOM 762 CD1 PHE A 289 1.381 -4.735 0.404 1.00 1.31 C ATOM 763 CD2 PHE A 289 0.453 -3.527 -1.431 1.00 1.28 C ATOM 764 CE1 PHE A 289 0.132 -4.809 0.991 1.00 1.49 C ATOM 765 CE2 PHE A 289 -0.799 -3.598 -0.849 1.00 1.45 C ATOM 766 CZ PHE A 289 -0.959 -4.240 0.364 1.00 1.06 C ATOM 767 HA PHE A 289 3.771 -3.550 0.476 1.00 0.00 H ATOM 768 HB2 PHE A 289 2.827 -3.461 -2.383 1.00 0.00 H ATOM 769 HB3 PHE A 289 3.257 -5.027 -1.658 1.00 0.00 H ATOM 770 HD2 PHE A 289 0.574 -3.020 -2.388 1.00 0.00 H ATOM 771 HE2 PHE A 289 -1.658 -3.148 -1.346 1.00 0.00 H ATOM 772 HZ PHE A 289 -1.945 -4.297 0.825 1.00 0.00 H ATOM 773 HE1 PHE A 289 0.008 -5.316 1.948 1.00 0.00 H ATOM 774 HD1 PHE A 289 2.238 -5.187 0.903 1.00 0.00 H ATOM 775 H PHE A 289 4.242 -1.439 -1.607 1.00 0.00 H ATOM 776 N TYR A 290 5.736 -4.953 -0.306 1.00 0.24 N ATOM 777 CA TYR A 290 7.043 -5.565 -0.543 1.00 0.26 C ATOM 778 C TYR A 290 6.994 -7.070 -0.277 1.00 0.22 C ATOM 779 O TYR A 290 6.591 -7.500 0.806 1.00 0.22 O ATOM 780 CB TYR A 290 8.094 -4.902 0.354 1.00 0.30 C ATOM 781 CG TYR A 290 9.224 -5.817 0.774 1.00 0.36 C ATOM 782 CD1 TYR A 290 10.352 -5.974 -0.021 1.00 1.29 C ATOM 783 CD2 TYR A 290 9.165 -6.516 1.975 1.00 1.21 C ATOM 784 CE1 TYR A 290 11.389 -6.801 0.367 1.00 1.34 C ATOM 785 CE2 TYR A 290 10.197 -7.346 2.369 1.00 1.23 C ATOM 786 CZ TYR A 290 11.306 -7.485 1.562 1.00 0.56 C ATOM 787 OH TYR A 290 12.337 -8.309 1.951 1.00 0.67 O ATOM 788 HA TYR A 290 7.315 -5.414 -1.588 1.00 0.00 H ATOM 789 HB3 TYR A 290 7.596 -4.540 1.253 1.00 0.00 H ATOM 790 HB2 TYR A 290 8.522 -4.058 -0.188 1.00 0.00 H ATOM 791 HD2 TYR A 290 8.290 -6.407 2.616 1.00 0.00 H ATOM 792 HE2 TYR A 290 10.135 -7.888 3.313 1.00 0.00 H ATOM 793 HE1 TYR A 290 12.268 -6.912 -0.268 1.00 0.00 H ATOM 794 HD1 TYR A 290 10.420 -5.436 -0.967 1.00 0.00 H ATOM 795 HH TYR A 290 13.048 -8.294 1.262 1.00 0.00 H ATOM 796 H TYR A 290 5.083 -5.403 0.367 1.00 0.00 H ATOM 797 N ALA A 291 7.409 -7.873 -1.261 1.00 0.20 N ATOM 798 CA ALA A 291 7.402 -9.323 -1.098 1.00 0.18 C ATOM 799 C ALA A 291 8.526 -9.759 -0.164 1.00 0.21 C ATOM 800 O ALA A 291 9.581 -9.126 -0.118 1.00 0.27 O ATOM 801 CB ALA A 291 7.520 -10.018 -2.448 1.00 0.21 C ATOM 802 HA ALA A 291 6.452 -9.615 -0.651 1.00 0.00 H ATOM 803 HB1 ALA A 291 6.679 -9.730 -3.078 1.00 0.00 H ATOM 804 HB2 ALA A 291 8.453 -9.722 -2.927 1.00 0.00 H ATOM 805 HB3 ALA A 291 7.513 -11.098 -2.301 1.00 0.00 H ATOM 806 H ALA A 291 7.742 -7.459 -2.155 1.00 0.00 H ATOM 807 N LEU A 292 8.292 -10.833 0.590 1.00 0.22 N ATOM 808 CA LEU A 292 9.288 -11.337 1.537 1.00 0.29 C ATOM 809 C LEU A 292 10.041 -12.549 0.986 1.00 0.32 C ATOM 810 O LEU A 292 10.334 -13.492 1.721 1.00 0.43 O ATOM 811 CB LEU A 292 8.613 -11.705 2.861 1.00 0.32 C ATOM 812 CG LEU A 292 8.085 -10.519 3.670 1.00 0.38 C ATOM 813 CD1 LEU A 292 6.771 -10.018 3.090 1.00 1.09 C ATOM 814 CD2 LEU A 292 7.911 -10.908 5.130 1.00 1.31 C ATOM 815 HA LEU A 292 10.015 -10.542 1.702 1.00 0.00 H ATOM 816 HB2 LEU A 292 7.774 -12.365 2.641 1.00 0.00 H ATOM 817 HB3 LEU A 292 9.340 -12.236 3.475 1.00 0.00 H ATOM 818 HG LEU A 292 8.814 -9.711 3.613 1.00 0.00 H ATOM 819 HD21 LEU A 292 7.201 -11.732 5.203 1.00 0.00 H ATOM 820 HD22 LEU A 292 8.873 -11.218 5.539 1.00 0.00 H ATOM 821 HD23 LEU A 292 7.535 -10.052 5.690 1.00 0.00 H ATOM 822 HD11 LEU A 292 6.928 -9.701 2.059 1.00 0.00 H ATOM 823 HD12 LEU A 292 6.034 -10.821 3.117 1.00 0.00 H ATOM 824 HD13 LEU A 292 6.413 -9.174 3.680 1.00 0.00 H ATOM 825 H LEU A 292 7.380 -11.325 0.503 1.00 0.00 H ATOM 826 N GLY A 293 10.356 -12.523 -0.307 1.00 0.30 N ATOM 827 CA GLY A 293 11.073 -13.626 -0.919 1.00 0.36 C ATOM 828 C GLY A 293 10.140 -14.623 -1.571 1.00 0.48 C ATOM 829 O GLY A 293 10.245 -14.895 -2.767 1.00 0.84 O ATOM 830 HA3 GLY A 293 11.653 -14.138 -0.151 1.00 0.00 H ATOM 831 HA2 GLY A 293 11.748 -13.229 -1.677 1.00 0.00 H ATOM 832 H GLY A 293 10.085 -11.702 -0.885 1.00 0.00 H ATOM 833 N GLU A 294 9.221 -15.163 -0.782 1.00 0.32 N ATOM 834 CA GLU A 294 8.257 -16.130 -1.279 1.00 0.41 C ATOM 835 C GLU A 294 7.217 -15.445 -2.157 1.00 0.40 C ATOM 836 O GLU A 294 6.750 -14.350 -1.841 1.00 0.43 O ATOM 837 CB GLU A 294 7.570 -16.828 -0.107 1.00 0.55 C ATOM 838 CG GLU A 294 8.280 -18.091 0.352 1.00 0.64 C ATOM 839 CD GLU A 294 7.856 -19.316 -0.434 1.00 0.99 C ATOM 840 OE1 GLU A 294 6.657 -19.662 -0.393 1.00 1.70 O ATOM 841 OE2 GLU A 294 8.724 -19.930 -1.090 1.00 1.63 O ATOM 842 HA GLU A 294 8.785 -16.871 -1.879 1.00 0.00 H ATOM 843 HB2 GLU A 294 7.527 -16.133 0.731 1.00 0.00 H ATOM 844 HB3 GLU A 294 6.557 -17.093 -0.410 1.00 0.00 H ATOM 845 HG2 GLU A 294 9.354 -17.952 0.230 1.00 0.00 H ATOM 846 HG3 GLU A 294 8.054 -18.256 1.405 1.00 0.00 H ATOM 847 H GLU A 294 9.189 -14.887 0.220 1.00 0.00 H ATOM 848 N GLY A 295 6.858 -16.092 -3.259 1.00 0.45 N ATOM 849 CA GLY A 295 5.876 -15.526 -4.163 1.00 0.51 C ATOM 850 C GLY A 295 4.540 -15.287 -3.488 1.00 0.59 C ATOM 851 O GLY A 295 4.160 -16.025 -2.579 1.00 1.20 O ATOM 852 HA3 GLY A 295 5.730 -16.213 -4.996 1.00 0.00 H ATOM 853 HA2 GLY A 295 6.253 -14.575 -4.540 1.00 0.00 H ATOM 854 H GLY A 295 7.286 -17.015 -3.476 1.00 0.00 H ATOM 855 N ASP A 296 3.836 -14.244 -3.930 1.00 0.35 N ATOM 856 CA ASP A 296 2.516 -13.859 -3.390 1.00 0.32 C ATOM 857 C ASP A 296 2.601 -13.236 -1.989 1.00 0.25 C ATOM 858 O ASP A 296 2.120 -12.121 -1.798 1.00 0.32 O ATOM 859 CB ASP A 296 1.513 -15.028 -3.409 1.00 0.42 C ATOM 860 CG ASP A 296 0.663 -15.094 -2.155 1.00 0.64 C ATOM 861 OD1 ASP A 296 -0.157 -14.175 -1.946 1.00 1.35 O ATOM 862 OD2 ASP A 296 0.816 -16.064 -1.383 1.00 1.21 O ATOM 863 HA ASP A 296 2.141 -13.087 -4.062 1.00 0.00 H ATOM 864 HB2 ASP A 296 0.855 -14.909 -4.270 1.00 0.00 H ATOM 865 HB3 ASP A 296 2.068 -15.962 -3.504 1.00 0.00 H ATOM 866 H ASP A 296 4.239 -13.670 -4.698 1.00 0.00 H ATOM 867 N LYS A 297 3.187 -13.948 -1.014 1.00 0.22 N ATOM 868 CA LYS A 297 3.304 -13.439 0.353 1.00 0.21 C ATOM 869 C LYS A 297 3.966 -12.062 0.377 1.00 0.19 C ATOM 870 O LYS A 297 5.189 -11.937 0.271 1.00 0.21 O ATOM 871 CB LYS A 297 4.097 -14.427 1.212 1.00 0.26 C ATOM 872 CG LYS A 297 4.620 -13.841 2.514 1.00 0.33 C ATOM 873 CD LYS A 297 5.143 -14.931 3.435 1.00 0.65 C ATOM 874 CE LYS A 297 4.781 -14.661 4.885 1.00 0.55 C ATOM 875 NZ LYS A 297 5.684 -15.380 5.826 1.00 1.08 N ATOM 876 HA LYS A 297 2.300 -13.333 0.765 1.00 0.00 H ATOM 877 HB2 LYS A 297 3.448 -15.269 1.452 1.00 0.00 H ATOM 878 HB3 LYS A 297 4.948 -14.780 0.630 1.00 0.00 H ATOM 879 HG2 LYS A 297 5.428 -13.145 2.292 1.00 0.00 H ATOM 880 HG3 LYS A 297 3.811 -13.309 3.015 1.00 0.00 H ATOM 881 HD2 LYS A 297 4.711 -15.886 3.134 1.00 0.00 H ATOM 882 HD3 LYS A 297 6.228 -14.980 3.345 1.00 0.00 H ATOM 883 HE2 LYS A 297 3.756 -14.989 5.060 1.00 0.00 H ATOM 884 HE3 LYS A 297 4.856 -13.590 5.074 1.00 0.00 H ATOM 885 HZ1 LYS A 297 5.614 -16.404 5.657 1.00 0.00 H ATOM 886 HZ2 LYS A 297 6.664 -15.068 5.671 1.00 0.00 H ATOM 887 HZ3 LYS A 297 5.402 -15.168 6.805 1.00 0.00 H ATOM 888 H LYS A 297 3.569 -14.889 -1.236 1.00 0.00 H ATOM 889 N VAL A 298 3.133 -11.033 0.508 1.00 0.19 N ATOM 890 CA VAL A 298 3.599 -9.652 0.541 1.00 0.19 C ATOM 891 C VAL A 298 2.953 -8.901 1.698 1.00 0.19 C ATOM 892 O VAL A 298 1.775 -9.109 1.992 1.00 0.21 O ATOM 893 CB VAL A 298 3.283 -8.921 -0.781 1.00 0.22 C ATOM 894 CG1 VAL A 298 1.833 -9.134 -1.193 1.00 0.30 C ATOM 895 CG2 VAL A 298 3.587 -7.441 -0.656 1.00 0.32 C ATOM 896 HA VAL A 298 4.680 -9.674 0.677 1.00 0.00 H ATOM 897 HB VAL A 298 3.920 -9.343 -1.559 1.00 0.00 H ATOM 898 HG11 VAL A 298 1.648 -10.199 -1.331 1.00 0.00 H ATOM 899 HG12 VAL A 298 1.175 -8.748 -0.415 1.00 0.00 H ATOM 900 HG13 VAL A 298 1.641 -8.607 -2.128 1.00 0.00 H ATOM 901 HG21 VAL A 298 2.978 -7.012 0.140 1.00 0.00 H ATOM 902 HG22 VAL A 298 4.643 -7.307 -0.420 1.00 0.00 H ATOM 903 HG23 VAL A 298 3.358 -6.943 -1.598 1.00 0.00 H ATOM 904 H VAL A 298 2.113 -11.220 0.590 1.00 0.00 H ATOM 905 N LYS A 299 3.729 -8.040 2.358 1.00 0.23 N ATOM 906 CA LYS A 299 3.227 -7.270 3.497 1.00 0.25 C ATOM 907 C LYS A 299 3.319 -5.765 3.247 1.00 0.25 C ATOM 908 O LYS A 299 4.122 -5.303 2.434 1.00 0.24 O ATOM 909 CB LYS A 299 4.007 -7.637 4.761 1.00 0.29 C ATOM 910 CG LYS A 299 3.807 -9.079 5.205 1.00 0.35 C ATOM 911 CD LYS A 299 4.378 -9.319 6.593 1.00 1.06 C ATOM 912 CE LYS A 299 3.303 -9.220 7.663 1.00 1.01 C ATOM 913 NZ LYS A 299 3.743 -9.824 8.951 1.00 1.79 N ATOM 914 HA LYS A 299 2.175 -7.522 3.630 1.00 0.00 H ATOM 915 HB2 LYS A 299 5.068 -7.480 4.569 1.00 0.00 H ATOM 916 HB3 LYS A 299 3.684 -6.980 5.568 1.00 0.00 H ATOM 917 HG2 LYS A 299 2.740 -9.301 5.217 1.00 0.00 H ATOM 918 HG3 LYS A 299 4.306 -9.740 4.497 1.00 0.00 H ATOM 919 HD2 LYS A 299 4.821 -10.314 6.627 1.00 0.00 H ATOM 920 HD3 LYS A 299 5.147 -8.573 6.794 1.00 0.00 H ATOM 921 HE2 LYS A 299 2.411 -9.741 7.316 1.00 0.00 H ATOM 922 HE3 LYS A 299 3.067 -8.169 7.829 1.00 0.00 H ATOM 923 HZ1 LYS A 299 3.964 -10.829 8.803 1.00 0.00 H ATOM 924 HZ2 LYS A 299 4.590 -9.328 9.294 1.00 0.00 H ATOM 925 HZ3 LYS A 299 2.980 -9.735 9.653 1.00 0.00 H ATOM 926 H LYS A 299 4.716 -7.913 2.056 1.00 0.00 H ATOM 927 N CYS A 300 2.484 -5.011 3.961 1.00 0.29 N ATOM 928 CA CYS A 300 2.449 -3.555 3.841 1.00 0.30 C ATOM 929 C CYS A 300 3.612 -2.919 4.599 1.00 0.31 C ATOM 930 O CYS A 300 4.155 -3.513 5.530 1.00 0.49 O ATOM 931 CB CYS A 300 1.123 -3.011 4.375 1.00 0.41 C ATOM 932 SG CYS A 300 0.349 -1.738 3.323 1.00 0.31 S ATOM 933 HA CYS A 300 2.542 -3.300 2.785 1.00 0.00 H ATOM 934 HB2 CYS A 300 1.304 -2.577 5.358 1.00 0.00 H ATOM 935 HB3 CYS A 300 0.427 -3.844 4.470 1.00 0.00 H ATOM 936 HG CYS A 300 -0.834 -1.323 3.900 1.00 0.00 H ATOM 937 H CYS A 300 1.834 -5.475 4.627 1.00 0.00 H ATOM 938 N PHE A 301 3.993 -1.712 4.192 1.00 0.26 N ATOM 939 CA PHE A 301 5.098 -1.003 4.832 1.00 0.30 C ATOM 940 C PHE A 301 4.599 -0.059 5.924 1.00 0.48 C ATOM 941 O PHE A 301 3.703 0.752 5.690 1.00 1.54 O ATOM 942 CB PHE A 301 5.891 -0.206 3.794 1.00 0.37 C ATOM 943 CG PHE A 301 7.029 -0.970 3.178 1.00 0.63 C ATOM 944 CD1 PHE A 301 8.034 -1.504 3.970 1.00 1.44 C ATOM 945 CD2 PHE A 301 7.097 -1.149 1.806 1.00 1.42 C ATOM 946 CE1 PHE A 301 9.083 -2.203 3.405 1.00 1.69 C ATOM 947 CE2 PHE A 301 8.145 -1.845 1.235 1.00 1.66 C ATOM 948 CZ PHE A 301 9.139 -2.374 2.036 1.00 1.37 C ATOM 949 HA PHE A 301 5.744 -1.751 5.291 1.00 0.00 H ATOM 950 HB2 PHE A 301 5.209 0.095 2.999 1.00 0.00 H ATOM 951 HB3 PHE A 301 6.296 0.682 4.279 1.00 0.00 H ATOM 952 HD2 PHE A 301 6.315 -0.736 1.169 1.00 0.00 H ATOM 953 HE2 PHE A 301 8.188 -1.977 0.154 1.00 0.00 H ATOM 954 HZ PHE A 301 9.966 -2.925 1.588 1.00 0.00 H ATOM 955 HE1 PHE A 301 9.866 -2.619 4.039 1.00 0.00 H ATOM 956 HD1 PHE A 301 7.996 -1.371 5.051 1.00 0.00 H ATOM 957 H PHE A 301 3.492 -1.262 3.399 1.00 0.00 H ATOM 958 N HIS A 302 5.205 -0.171 7.110 1.00 0.72 N ATOM 959 CA HIS A 302 4.865 0.669 8.265 1.00 0.63 C ATOM 960 C HIS A 302 3.496 0.322 8.858 1.00 0.43 C ATOM 961 O HIS A 302 3.414 -0.152 9.991 1.00 0.36 O ATOM 962 CB HIS A 302 4.925 2.156 7.896 1.00 0.77 C ATOM 963 CG HIS A 302 6.109 2.513 7.052 1.00 0.94 C ATOM 964 ND1 HIS A 302 6.001 2.959 5.752 1.00 1.54 N ATOM 965 CD2 HIS A 302 7.435 2.489 7.330 1.00 1.49 C ATOM 966 CE1 HIS A 302 7.207 3.193 5.266 1.00 1.48 C ATOM 967 NE2 HIS A 302 8.094 2.916 6.204 1.00 1.37 N ATOM 968 HA HIS A 302 5.612 0.464 9.032 1.00 0.00 H ATOM 969 HB2 HIS A 302 4.019 2.413 7.347 1.00 0.00 H ATOM 970 HB3 HIS A 302 4.968 2.739 8.816 1.00 0.00 H ATOM 971 HD2 HIS A 302 7.893 2.187 8.272 1.00 0.00 H ATOM 972 HE1 HIS A 302 7.431 3.553 4.262 1.00 0.00 H ATOM 973 H HIS A 302 5.952 -0.886 7.220 1.00 0.00 H ATOM 974 N CYS A 303 2.427 0.574 8.102 1.00 0.48 N ATOM 975 CA CYS A 303 1.068 0.298 8.567 1.00 0.41 C ATOM 976 C CYS A 303 0.886 -1.159 9.008 1.00 0.29 C ATOM 977 O CYS A 303 0.076 -1.442 9.891 1.00 0.45 O ATOM 978 CB CYS A 303 0.057 0.666 7.476 1.00 0.63 C ATOM 979 SG CYS A 303 -0.531 -0.730 6.465 1.00 0.24 S ATOM 980 HA CYS A 303 0.889 0.916 9.447 1.00 0.00 H ATOM 981 HB2 CYS A 303 0.526 1.391 6.811 1.00 0.00 H ATOM 982 HB3 CYS A 303 -0.808 1.123 7.957 1.00 0.00 H ATOM 983 HG CYS A 303 -1.431 -0.269 5.526 1.00 0.00 H ATOM 984 H CYS A 303 2.564 0.979 7.154 1.00 0.00 H ATOM 985 N GLY A 304 1.641 -2.081 8.409 1.00 0.37 N ATOM 986 CA GLY A 304 1.530 -3.477 8.787 1.00 0.33 C ATOM 987 C GLY A 304 0.457 -4.212 8.010 1.00 0.32 C ATOM 988 O GLY A 304 0.010 -3.748 6.963 1.00 0.42 O ATOM 989 HA3 GLY A 304 1.291 -3.533 9.849 1.00 0.00 H ATOM 990 HA2 GLY A 304 2.488 -3.965 8.605 1.00 0.00 H ATOM 991 H GLY A 304 2.313 -1.798 7.667 1.00 0.00 H ATOM 992 N GLY A 305 0.047 -5.367 8.520 1.00 0.35 N ATOM 993 CA GLY A 305 -0.971 -6.149 7.848 1.00 0.42 C ATOM 994 C GLY A 305 -0.426 -6.865 6.630 1.00 0.32 C ATOM 995 O GLY A 305 -0.036 -6.229 5.650 1.00 0.28 O ATOM 996 HA3 GLY A 305 -1.776 -5.484 7.535 1.00 0.00 H ATOM 997 HA2 GLY A 305 -1.364 -6.889 8.545 1.00 0.00 H ATOM 998 H GLY A 305 0.460 -5.713 9.409 1.00 0.00 H ATOM 999 N GLY A 306 -0.390 -8.191 6.692 1.00 0.34 N ATOM 1000 CA GLY A 306 0.120 -8.968 5.581 1.00 0.30 C ATOM 1001 C GLY A 306 -0.968 -9.389 4.614 1.00 0.27 C ATOM 1002 O GLY A 306 -1.995 -9.930 5.025 1.00 0.31 O ATOM 1003 HA3 GLY A 306 0.603 -9.863 5.973 1.00 0.00 H ATOM 1004 HA2 GLY A 306 0.853 -8.367 5.042 1.00 0.00 H ATOM 1005 H GLY A 306 -0.731 -8.676 7.546 1.00 0.00 H ATOM 1006 N LEU A 307 -0.737 -9.144 3.328 1.00 0.23 N ATOM 1007 CA LEU A 307 -1.695 -9.501 2.288 1.00 0.23 C ATOM 1008 C LEU A 307 -1.230 -10.736 1.523 1.00 0.23 C ATOM 1009 O LEU A 307 -0.066 -10.837 1.131 1.00 0.27 O ATOM 1010 CB LEU A 307 -1.886 -8.331 1.320 1.00 0.25 C ATOM 1011 CG LEU A 307 -2.979 -7.336 1.715 1.00 0.29 C ATOM 1012 CD1 LEU A 307 -4.354 -7.973 1.581 1.00 0.41 C ATOM 1013 CD2 LEU A 307 -2.756 -6.837 3.134 1.00 0.27 C ATOM 1014 HA LEU A 307 -2.647 -9.728 2.767 1.00 0.00 H ATOM 1015 HB2 LEU A 307 -0.943 -7.789 1.254 1.00 0.00 H ATOM 1016 HB3 LEU A 307 -2.138 -8.739 0.341 1.00 0.00 H ATOM 1017 HG LEU A 307 -2.930 -6.482 1.039 1.00 0.00 H ATOM 1018 HD21 LEU A 307 -2.779 -7.682 3.823 1.00 0.00 H ATOM 1019 HD22 LEU A 307 -1.787 -6.343 3.196 1.00 0.00 H ATOM 1020 HD23 LEU A 307 -3.543 -6.130 3.397 1.00 0.00 H ATOM 1021 HD11 LEU A 307 -4.511 -8.281 0.547 1.00 0.00 H ATOM 1022 HD12 LEU A 307 -4.415 -8.844 2.234 1.00 0.00 H ATOM 1023 HD13 LEU A 307 -5.118 -7.249 1.866 1.00 0.00 H ATOM 1024 H LEU A 307 0.155 -8.683 3.055 1.00 0.00 H ATOM 1025 N THR A 308 -2.150 -11.671 1.311 1.00 0.25 N ATOM 1026 CA THR A 308 -1.844 -12.901 0.591 1.00 0.29 C ATOM 1027 C THR A 308 -3.064 -13.391 -0.184 1.00 0.30 C ATOM 1028 O THR A 308 -4.201 -13.108 0.191 1.00 0.39 O ATOM 1029 CB THR A 308 -1.366 -14.011 1.547 1.00 0.33 C ATOM 1030 OG1 THR A 308 -1.095 -15.209 0.810 1.00 0.38 O ATOM 1031 CG2 THR A 308 -2.410 -14.293 2.617 1.00 0.35 C ATOM 1032 HA THR A 308 -1.039 -12.673 -0.108 1.00 0.00 H ATOM 1033 HB THR A 308 -0.453 -13.670 2.035 1.00 0.00 H ATOM 1034 HG1 THR A 308 -0.389 -15.030 0.139 1.00 0.00 H ATOM 1035 HG23 THR A 308 -2.613 -13.379 3.175 1.00 0.00 H ATOM 1036 HG21 THR A 308 -3.328 -14.643 2.144 1.00 0.00 H ATOM 1037 HG22 THR A 308 -2.035 -15.059 3.296 1.00 0.00 H ATOM 1038 H THR A 308 -3.115 -11.521 1.669 1.00 0.00 H ATOM 1039 N ASP A 309 -2.823 -14.119 -1.269 1.00 0.29 N ATOM 1040 CA ASP A 309 -3.908 -14.635 -2.096 1.00 0.31 C ATOM 1041 C ASP A 309 -4.744 -13.488 -2.653 1.00 0.43 C ATOM 1042 O ASP A 309 -5.916 -13.335 -2.308 1.00 1.04 O ATOM 1043 CB ASP A 309 -4.793 -15.583 -1.285 1.00 0.37 C ATOM 1044 CG ASP A 309 -5.657 -16.462 -2.167 1.00 0.41 C ATOM 1045 OD1 ASP A 309 -5.094 -17.278 -2.927 1.00 1.12 O ATOM 1046 OD2 ASP A 309 -6.898 -16.334 -2.099 1.00 1.26 O ATOM 1047 HA ASP A 309 -3.472 -15.188 -2.928 1.00 0.00 H ATOM 1048 HB2 ASP A 309 -4.155 -16.220 -0.673 1.00 0.00 H ATOM 1049 HB3 ASP A 309 -5.441 -14.991 -0.638 1.00 0.00 H ATOM 1050 H ASP A 309 -1.839 -14.326 -1.535 1.00 0.00 H ATOM 1051 N TRP A 310 -4.127 -12.679 -3.507 1.00 0.33 N ATOM 1052 CA TRP A 310 -4.804 -11.534 -4.107 1.00 0.26 C ATOM 1053 C TRP A 310 -5.996 -11.968 -4.952 1.00 0.27 C ATOM 1054 O TRP A 310 -6.229 -13.160 -5.154 1.00 0.42 O ATOM 1055 CB TRP A 310 -3.826 -10.732 -4.965 1.00 0.21 C ATOM 1056 CG TRP A 310 -3.061 -9.709 -4.185 1.00 0.19 C ATOM 1057 CD1 TRP A 310 -1.867 -9.888 -3.548 1.00 0.23 C ATOM 1058 CD2 TRP A 310 -3.441 -8.348 -3.953 1.00 0.17 C ATOM 1059 NE1 TRP A 310 -1.480 -8.722 -2.935 1.00 0.24 N ATOM 1060 CE2 TRP A 310 -2.429 -7.761 -3.169 1.00 0.20 C ATOM 1061 CE3 TRP A 310 -4.537 -7.566 -4.333 1.00 0.17 C ATOM 1062 CZ2 TRP A 310 -2.481 -6.433 -2.759 1.00 0.21 C ATOM 1063 CZ3 TRP A 310 -4.587 -6.247 -3.925 1.00 0.19 C ATOM 1064 CH2 TRP A 310 -3.564 -5.692 -3.145 1.00 0.21 C ATOM 1065 HA TRP A 310 -5.174 -10.907 -3.296 1.00 0.00 H ATOM 1066 HB2 TRP A 310 -3.117 -11.423 -5.420 1.00 0.00 H ATOM 1067 HB3 TRP A 310 -4.388 -10.222 -5.748 1.00 0.00 H ATOM 1068 HE1 TRP A 310 -0.609 -8.589 -2.383 1.00 0.00 H ATOM 1069 HD1 TRP A 310 -1.303 -10.821 -3.529 1.00 0.00 H ATOM 1070 HZ2 TRP A 310 -1.687 -5.998 -2.152 1.00 0.00 H ATOM 1071 HH2 TRP A 310 -3.633 -4.648 -2.839 1.00 0.00 H ATOM 1072 HZ3 TRP A 310 -5.436 -5.628 -4.215 1.00 0.00 H ATOM 1073 HE3 TRP A 310 -5.337 -7.990 -4.940 1.00 0.00 H ATOM 1074 H TRP A 310 -3.135 -12.867 -3.755 1.00 0.00 H ATOM 1075 N LYS A 311 -6.743 -10.980 -5.439 1.00 0.32 N ATOM 1076 CA LYS A 311 -7.920 -11.224 -6.268 1.00 0.39 C ATOM 1077 C LYS A 311 -7.703 -10.642 -7.671 1.00 0.39 C ATOM 1078 O LYS A 311 -7.132 -9.559 -7.798 1.00 0.45 O ATOM 1079 CB LYS A 311 -9.145 -10.569 -5.619 1.00 0.56 C ATOM 1080 CG LYS A 311 -10.454 -11.289 -5.895 1.00 0.69 C ATOM 1081 CD LYS A 311 -11.606 -10.665 -5.123 1.00 1.19 C ATOM 1082 CE LYS A 311 -12.893 -11.454 -5.309 1.00 1.63 C ATOM 1083 NZ LYS A 311 -13.539 -11.777 -4.007 1.00 1.82 N ATOM 1084 HA LYS A 311 -8.084 -12.298 -6.353 1.00 0.00 H ATOM 1085 HB2 LYS A 311 -8.989 -10.544 -4.541 1.00 0.00 H ATOM 1086 HB3 LYS A 311 -9.229 -9.550 -5.996 1.00 0.00 H ATOM 1087 HG2 LYS A 311 -10.671 -11.234 -6.962 1.00 0.00 H ATOM 1088 HG3 LYS A 311 -10.353 -12.333 -5.599 1.00 0.00 H ATOM 1089 HD2 LYS A 311 -11.353 -10.644 -4.063 1.00 0.00 H ATOM 1090 HD3 LYS A 311 -11.760 -9.646 -5.478 1.00 0.00 H ATOM 1091 HE2 LYS A 311 -12.665 -12.384 -5.830 1.00 0.00 H ATOM 1092 HE3 LYS A 311 -13.585 -10.864 -5.909 1.00 0.00 H ATOM 1093 HZ1 LYS A 311 -12.888 -12.346 -3.430 1.00 0.00 H ATOM 1094 HZ2 LYS A 311 -13.767 -10.895 -3.506 1.00 0.00 H ATOM 1095 HZ3 LYS A 311 -14.412 -12.315 -4.179 1.00 0.00 H ATOM 1096 H LYS A 311 -6.479 -9.998 -5.221 1.00 0.00 H ATOM 1097 N PRO A 312 -8.145 -11.334 -8.751 1.00 0.46 N ATOM 1098 CA PRO A 312 -7.973 -10.836 -10.124 1.00 0.58 C ATOM 1099 C PRO A 312 -8.562 -9.440 -10.306 1.00 0.69 C ATOM 1100 O PRO A 312 -9.706 -9.185 -9.931 1.00 1.67 O ATOM 1101 CB PRO A 312 -8.731 -11.854 -10.989 1.00 0.74 C ATOM 1102 CG PRO A 312 -9.582 -12.625 -10.038 1.00 0.67 C ATOM 1103 CD PRO A 312 -8.834 -12.636 -8.738 1.00 0.54 C ATOM 1104 HA PRO A 312 -6.920 -10.744 -10.389 1.00 0.00 H ATOM 1105 HD3 PRO A 312 -9.517 -12.712 -7.892 1.00 0.00 H ATOM 1106 HD2 PRO A 312 -8.120 -13.459 -8.702 1.00 0.00 H ATOM 1107 HG3 PRO A 312 -9.730 -13.642 -10.400 1.00 0.00 H ATOM 1108 HG2 PRO A 312 -10.550 -12.140 -9.915 1.00 0.00 H ATOM 1109 HB2 PRO A 312 -9.350 -11.343 -11.727 1.00 0.00 H ATOM 1110 HB3 PRO A 312 -8.032 -12.517 -11.499 1.00 0.00 H ATOM 1111 N SER A 313 -7.768 -8.538 -10.874 1.00 0.55 N ATOM 1112 CA SER A 313 -8.206 -7.165 -11.094 1.00 0.44 C ATOM 1113 C SER A 313 -8.508 -6.481 -9.764 1.00 0.37 C ATOM 1114 O SER A 313 -9.638 -6.519 -9.279 1.00 0.45 O ATOM 1115 CB SER A 313 -9.446 -7.138 -11.990 1.00 0.47 C ATOM 1116 OG SER A 313 -9.623 -5.861 -12.579 1.00 1.02 O ATOM 1117 HA SER A 313 -7.401 -6.624 -11.591 1.00 0.00 H ATOM 1118 HB2 SER A 313 -10.324 -7.378 -11.390 1.00 0.00 H ATOM 1119 HB3 SER A 313 -9.332 -7.881 -12.779 1.00 0.00 H ATOM 1120 HG SER A 313 -10.430 -5.872 -13.152 1.00 0.00 H ATOM 1121 H SER A 313 -6.811 -8.819 -11.169 1.00 0.00 H ATOM 1122 N GLU A 314 -7.488 -5.861 -9.176 1.00 0.26 N ATOM 1123 CA GLU A 314 -7.646 -5.175 -7.898 1.00 0.24 C ATOM 1124 C GLU A 314 -6.511 -4.183 -7.674 1.00 0.30 C ATOM 1125 O GLU A 314 -5.355 -4.469 -7.988 1.00 0.67 O ATOM 1126 CB GLU A 314 -7.686 -6.188 -6.752 1.00 0.27 C ATOM 1127 CG GLU A 314 -9.087 -6.676 -6.421 1.00 0.33 C ATOM 1128 CD GLU A 314 -9.242 -7.058 -4.962 1.00 0.65 C ATOM 1129 OE1 GLU A 314 -8.329 -7.716 -4.420 1.00 1.21 O ATOM 1130 OE2 GLU A 314 -10.277 -6.700 -4.361 1.00 1.49 O ATOM 1131 HA GLU A 314 -8.588 -4.627 -7.921 1.00 0.00 H ATOM 1132 HB2 GLU A 314 -7.078 -7.048 -7.031 1.00 0.00 H ATOM 1133 HB3 GLU A 314 -7.265 -5.720 -5.863 1.00 0.00 H ATOM 1134 HG2 GLU A 314 -9.797 -5.882 -6.652 1.00 0.00 H ATOM 1135 HG3 GLU A 314 -9.307 -7.549 -7.036 1.00 0.00 H ATOM 1136 H GLU A 314 -6.556 -5.865 -9.638 1.00 0.00 H ATOM 1137 N ASP A 315 -6.847 -3.017 -7.130 1.00 0.24 N ATOM 1138 CA ASP A 315 -5.850 -1.986 -6.868 1.00 0.21 C ATOM 1139 C ASP A 315 -5.361 -2.056 -5.418 1.00 0.19 C ATOM 1140 O ASP A 315 -6.101 -2.481 -4.529 1.00 0.22 O ATOM 1141 CB ASP A 315 -6.433 -0.601 -7.154 1.00 0.22 C ATOM 1142 CG ASP A 315 -6.621 -0.347 -8.637 1.00 0.24 C ATOM 1143 OD1 ASP A 315 -7.376 -1.107 -9.279 1.00 1.06 O ATOM 1144 OD2 ASP A 315 -6.012 0.611 -9.158 1.00 1.08 O ATOM 1145 HA ASP A 315 -5.001 -2.160 -7.529 1.00 0.00 H ATOM 1146 HB2 ASP A 315 -7.401 -0.519 -6.659 1.00 0.00 H ATOM 1147 HB3 ASP A 315 -5.756 0.153 -6.752 1.00 0.00 H ATOM 1148 H ASP A 315 -7.842 -2.837 -6.886 1.00 0.00 H ATOM 1149 N PRO A 316 -4.109 -1.633 -5.152 1.00 0.16 N ATOM 1150 CA PRO A 316 -3.544 -1.653 -3.799 1.00 0.17 C ATOM 1151 C PRO A 316 -4.076 -0.522 -2.921 1.00 0.17 C ATOM 1152 O PRO A 316 -4.272 -0.703 -1.719 1.00 0.23 O ATOM 1153 CB PRO A 316 -2.050 -1.474 -4.050 1.00 0.18 C ATOM 1154 CG PRO A 316 -1.984 -0.653 -5.289 1.00 0.18 C ATOM 1155 CD PRO A 316 -3.146 -1.097 -6.137 1.00 0.16 C ATOM 1156 HA PRO A 316 -3.801 -2.566 -3.262 1.00 0.00 H ATOM 1157 HD3 PRO A 316 -3.574 -0.256 -6.683 1.00 0.00 H ATOM 1158 HD2 PRO A 316 -2.841 -1.869 -6.843 1.00 0.00 H ATOM 1159 HG3 PRO A 316 -1.044 -0.828 -5.811 1.00 0.00 H ATOM 1160 HG2 PRO A 316 -2.072 0.406 -5.048 1.00 0.00 H ATOM 1161 HB2 PRO A 316 -1.577 -0.955 -3.216 1.00 0.00 H ATOM 1162 HB3 PRO A 316 -1.564 -2.438 -4.199 1.00 0.00 H ATOM 1163 N TRP A 317 -4.299 0.644 -3.529 1.00 0.16 N ATOM 1164 CA TRP A 317 -4.803 1.810 -2.810 1.00 0.17 C ATOM 1165 C TRP A 317 -6.110 1.495 -2.090 1.00 0.16 C ATOM 1166 O TRP A 317 -6.230 1.700 -0.883 1.00 0.22 O ATOM 1167 CB TRP A 317 -5.026 2.967 -3.784 1.00 0.20 C ATOM 1168 CG TRP A 317 -3.924 3.980 -3.778 1.00 0.20 C ATOM 1169 CD1 TRP A 317 -2.654 3.816 -4.252 1.00 0.27 C ATOM 1170 CD2 TRP A 317 -3.997 5.317 -3.276 1.00 0.24 C ATOM 1171 NE1 TRP A 317 -1.932 4.972 -4.075 1.00 0.33 N ATOM 1172 CE2 TRP A 317 -2.735 5.908 -3.477 1.00 0.31 C ATOM 1173 CE3 TRP A 317 -5.007 6.072 -2.676 1.00 0.31 C ATOM 1174 CZ2 TRP A 317 -2.460 7.220 -3.100 1.00 0.41 C ATOM 1175 CZ3 TRP A 317 -4.733 7.373 -2.302 1.00 0.41 C ATOM 1176 CH2 TRP A 317 -3.469 7.935 -2.515 1.00 0.45 C ATOM 1177 HA TRP A 317 -4.058 2.091 -2.065 1.00 0.00 H ATOM 1178 HB2 TRP A 317 -5.112 2.558 -4.791 1.00 0.00 H ATOM 1179 HB3 TRP A 317 -5.956 3.468 -3.516 1.00 0.00 H ATOM 1180 HE1 TRP A 317 -0.939 5.113 -4.350 1.00 0.00 H ATOM 1181 HD1 TRP A 317 -2.269 2.902 -4.705 1.00 0.00 H ATOM 1182 HZ2 TRP A 317 -1.477 7.661 -3.265 1.00 0.00 H ATOM 1183 HH2 TRP A 317 -3.285 8.965 -2.208 1.00 0.00 H ATOM 1184 HZ3 TRP A 317 -5.514 7.972 -1.833 1.00 0.00 H ATOM 1185 HE3 TRP A 317 -5.994 5.642 -2.506 1.00 0.00 H ATOM 1186 H TRP A 317 -4.108 0.725 -4.548 1.00 0.00 H ATOM 1187 N GLU A 318 -7.088 1.006 -2.842 1.00 0.16 N ATOM 1188 CA GLU A 318 -8.393 0.674 -2.282 1.00 0.17 C ATOM 1189 C GLU A 318 -8.323 -0.555 -1.376 1.00 0.14 C ATOM 1190 O GLU A 318 -8.969 -0.598 -0.329 1.00 0.16 O ATOM 1191 CB GLU A 318 -9.402 0.431 -3.406 1.00 0.23 C ATOM 1192 CG GLU A 318 -9.912 1.709 -4.053 1.00 0.27 C ATOM 1193 CD GLU A 318 -10.638 1.451 -5.358 1.00 0.65 C ATOM 1194 OE1 GLU A 318 -9.962 1.153 -6.365 1.00 1.36 O ATOM 1195 OE2 GLU A 318 -11.883 1.549 -5.374 1.00 1.47 O ATOM 1196 HA GLU A 318 -8.717 1.521 -1.676 1.00 0.00 H ATOM 1197 HB2 GLU A 318 -8.923 -0.177 -4.174 1.00 0.00 H ATOM 1198 HB3 GLU A 318 -10.254 -0.111 -2.994 1.00 0.00 H ATOM 1199 HG2 GLU A 318 -10.598 2.201 -3.363 1.00 0.00 H ATOM 1200 HG3 GLU A 318 -9.063 2.364 -4.249 1.00 0.00 H ATOM 1201 H GLU A 318 -6.919 0.856 -3.857 1.00 0.00 H ATOM 1202 N GLN A 319 -7.551 -1.559 -1.789 1.00 0.14 N ATOM 1203 CA GLN A 319 -7.420 -2.791 -1.015 1.00 0.15 C ATOM 1204 C GLN A 319 -6.916 -2.524 0.403 1.00 0.14 C ATOM 1205 O GLN A 319 -7.636 -2.749 1.376 1.00 0.17 O ATOM 1206 CB GLN A 319 -6.480 -3.770 -1.722 1.00 0.22 C ATOM 1207 CG GLN A 319 -6.288 -5.075 -0.966 1.00 0.47 C ATOM 1208 CD GLN A 319 -7.602 -5.751 -0.627 1.00 1.23 C ATOM 1209 OE1 GLN A 319 -8.256 -5.406 0.356 1.00 2.09 O ATOM 1210 NE2 GLN A 319 -7.996 -6.722 -1.444 1.00 1.72 N ATOM 1211 HA GLN A 319 -8.414 -3.231 -0.940 1.00 0.00 H ATOM 1212 HB2 GLN A 319 -6.893 -3.997 -2.705 1.00 0.00 H ATOM 1213 HB3 GLN A 319 -5.507 -3.292 -1.839 1.00 0.00 H ATOM 1214 HG2 GLN A 319 -5.696 -5.752 -1.582 1.00 0.00 H ATOM 1215 HG3 GLN A 319 -5.753 -4.867 -0.039 1.00 0.00 H ATOM 1216 HE22 GLN A 319 -7.411 -6.981 -2.264 1.00 0.00 H ATOM 1217 HE21 GLN A 319 -8.889 -7.223 -1.263 1.00 0.00 H ATOM 1218 H GLN A 319 -7.029 -1.463 -2.684 1.00 0.00 H ATOM 1219 N HIS A 320 -5.675 -2.057 0.516 1.00 0.16 N ATOM 1220 CA HIS A 320 -5.076 -1.776 1.820 1.00 0.19 C ATOM 1221 C HIS A 320 -5.906 -0.769 2.614 1.00 0.19 C ATOM 1222 O HIS A 320 -6.072 -0.913 3.826 1.00 0.22 O ATOM 1223 CB HIS A 320 -3.644 -1.255 1.653 1.00 0.25 C ATOM 1224 CG HIS A 320 -3.322 -0.098 2.549 1.00 0.22 C ATOM 1225 ND1 HIS A 320 -2.828 -0.284 3.820 1.00 0.23 N ATOM 1226 CD2 HIS A 320 -3.466 1.230 2.320 1.00 0.25 C ATOM 1227 CE1 HIS A 320 -2.690 0.926 4.332 1.00 0.27 C ATOM 1228 NE2 HIS A 320 -3.062 1.876 3.460 1.00 0.29 N ATOM 1229 HA HIS A 320 -5.054 -2.712 2.378 1.00 0.00 H ATOM 1230 HB2 HIS A 320 -2.952 -2.068 1.876 1.00 0.00 H ATOM 1231 HB3 HIS A 320 -3.510 -0.939 0.619 1.00 0.00 H ATOM 1232 HD2 HIS A 320 -3.833 1.695 1.405 1.00 0.00 H ATOM 1233 HE1 HIS A 320 -2.320 1.128 5.337 1.00 0.00 H ATOM 1234 H HIS A 320 -5.117 -1.888 -0.345 1.00 0.00 H ATOM 1235 N ALA A 321 -6.416 0.254 1.932 1.00 0.18 N ATOM 1236 CA ALA A 321 -7.220 1.288 2.582 1.00 0.20 C ATOM 1237 C ALA A 321 -8.428 0.707 3.320 1.00 0.20 C ATOM 1238 O ALA A 321 -8.837 1.229 4.355 1.00 0.25 O ATOM 1239 CB ALA A 321 -7.679 2.316 1.560 1.00 0.21 C ATOM 1240 HA ALA A 321 -6.585 1.770 3.326 1.00 0.00 H ATOM 1241 HB1 ALA A 321 -6.808 2.779 1.096 1.00 0.00 H ATOM 1242 HB2 ALA A 321 -8.280 1.823 0.796 1.00 0.00 H ATOM 1243 HB3 ALA A 321 -8.276 3.080 2.058 1.00 0.00 H ATOM 1244 H ALA A 321 -6.238 0.320 0.909 1.00 0.00 H ATOM 1245 N LYS A 322 -9.008 -0.362 2.782 1.00 0.19 N ATOM 1246 CA LYS A 322 -10.175 -0.986 3.398 1.00 0.22 C ATOM 1247 C LYS A 322 -9.785 -1.892 4.566 1.00 0.22 C ATOM 1248 O LYS A 322 -10.377 -1.818 5.643 1.00 0.28 O ATOM 1249 CB LYS A 322 -10.953 -1.792 2.356 1.00 0.23 C ATOM 1250 CG LYS A 322 -12.227 -2.418 2.898 1.00 0.28 C ATOM 1251 CD LYS A 322 -12.049 -3.904 3.162 1.00 1.17 C ATOM 1252 CE LYS A 322 -12.976 -4.388 4.265 1.00 1.84 C ATOM 1253 NZ LYS A 322 -12.556 -5.712 4.802 1.00 2.54 N ATOM 1254 HA LYS A 322 -10.805 -0.187 3.789 1.00 0.00 H ATOM 1255 HB2 LYS A 322 -11.218 -1.128 1.534 1.00 0.00 H ATOM 1256 HB3 LYS A 322 -10.308 -2.589 1.984 1.00 0.00 H ATOM 1257 HG2 LYS A 322 -12.497 -1.922 3.830 1.00 0.00 H ATOM 1258 HG3 LYS A 322 -13.027 -2.281 2.170 1.00 0.00 H ATOM 1259 HD2 LYS A 322 -12.268 -4.455 2.248 1.00 0.00 H ATOM 1260 HD3 LYS A 322 -11.017 -4.090 3.459 1.00 0.00 H ATOM 1261 HE2 LYS A 322 -13.986 -4.474 3.864 1.00 0.00 H ATOM 1262 HE3 LYS A 322 -12.969 -3.660 5.076 1.00 0.00 H ATOM 1263 HZ1 LYS A 322 -12.566 -6.415 4.035 1.00 0.00 H ATOM 1264 HZ2 LYS A 322 -11.595 -5.637 5.193 1.00 0.00 H ATOM 1265 HZ3 LYS A 322 -13.214 -6.005 5.552 1.00 0.00 H ATOM 1266 H LYS A 322 -8.622 -0.762 1.903 1.00 0.00 H ATOM 1267 N TRP A 323 -8.799 -2.757 4.345 1.00 0.24 N ATOM 1268 CA TRP A 323 -8.349 -3.688 5.378 1.00 0.26 C ATOM 1269 C TRP A 323 -7.775 -2.957 6.592 1.00 0.30 C ATOM 1270 O TRP A 323 -8.097 -3.286 7.733 1.00 0.34 O ATOM 1271 CB TRP A 323 -7.298 -4.642 4.806 1.00 0.26 C ATOM 1272 CG TRP A 323 -7.862 -5.960 4.367 1.00 0.27 C ATOM 1273 CD1 TRP A 323 -7.700 -6.555 3.148 1.00 0.29 C ATOM 1274 CD2 TRP A 323 -8.677 -6.847 5.141 1.00 0.33 C ATOM 1275 NE1 TRP A 323 -8.364 -7.758 3.118 1.00 0.31 N ATOM 1276 CE2 TRP A 323 -8.972 -7.959 4.329 1.00 0.34 C ATOM 1277 CE3 TRP A 323 -9.186 -6.811 6.443 1.00 0.42 C ATOM 1278 CZ2 TRP A 323 -9.752 -9.022 4.777 1.00 0.42 C ATOM 1279 CZ3 TRP A 323 -9.960 -7.867 6.886 1.00 0.53 C ATOM 1280 CH2 TRP A 323 -10.237 -8.960 6.055 1.00 0.52 C ATOM 1281 HA TRP A 323 -9.219 -4.255 5.708 1.00 0.00 H ATOM 1282 HB2 TRP A 323 -6.829 -4.164 3.946 1.00 0.00 H ATOM 1283 HB3 TRP A 323 -6.546 -4.827 5.573 1.00 0.00 H ATOM 1284 HE1 TRP A 323 -8.399 -8.409 2.308 1.00 0.00 H ATOM 1285 HD1 TRP A 323 -7.128 -6.137 2.320 1.00 0.00 H ATOM 1286 HZ2 TRP A 323 -9.969 -9.874 4.132 1.00 0.00 H ATOM 1287 HH2 TRP A 323 -10.851 -9.777 6.434 1.00 0.00 H ATOM 1288 HZ3 TRP A 323 -10.362 -7.849 7.899 1.00 0.00 H ATOM 1289 HE3 TRP A 323 -8.976 -5.965 7.097 1.00 0.00 H ATOM 1290 H TRP A 323 -8.337 -2.771 3.414 1.00 0.00 H ATOM 1291 N TYR A 324 -6.918 -1.973 6.340 1.00 0.29 N ATOM 1292 CA TYR A 324 -6.293 -1.207 7.414 1.00 0.34 C ATOM 1293 C TYR A 324 -5.743 0.123 6.890 1.00 0.30 C ATOM 1294 O TYR A 324 -4.576 0.204 6.509 1.00 0.29 O ATOM 1295 CB TYR A 324 -5.158 -2.018 8.041 1.00 0.39 C ATOM 1296 CG TYR A 324 -5.599 -2.881 9.202 1.00 0.50 C ATOM 1297 CD1 TYR A 324 -5.950 -2.313 10.420 1.00 1.31 C ATOM 1298 CD2 TYR A 324 -5.664 -4.264 9.080 1.00 1.31 C ATOM 1299 CE1 TYR A 324 -6.354 -3.098 11.484 1.00 1.36 C ATOM 1300 CE2 TYR A 324 -6.067 -5.055 10.139 1.00 1.37 C ATOM 1301 CZ TYR A 324 -6.411 -4.468 11.338 1.00 0.72 C ATOM 1302 OH TYR A 324 -6.812 -5.252 12.395 1.00 0.83 O ATOM 1303 HA TYR A 324 -7.052 -0.996 8.167 1.00 0.00 H ATOM 1304 HB3 TYR A 324 -4.395 -1.325 8.397 1.00 0.00 H ATOM 1305 HB2 TYR A 324 -4.731 -2.664 7.274 1.00 0.00 H ATOM 1306 HD2 TYR A 324 -5.393 -4.732 8.134 1.00 0.00 H ATOM 1307 HE2 TYR A 324 -6.113 -6.138 10.027 1.00 0.00 H ATOM 1308 HE1 TYR A 324 -6.626 -2.636 12.433 1.00 0.00 H ATOM 1309 HD1 TYR A 324 -5.906 -1.230 10.539 1.00 0.00 H ATOM 1310 HH TYR A 324 -7.020 -4.675 13.172 1.00 0.00 H ATOM 1311 H TYR A 324 -6.687 -1.743 5.352 1.00 0.00 H ATOM 1312 N PRO A 325 -6.569 1.190 6.859 1.00 0.35 N ATOM 1313 CA PRO A 325 -6.130 2.501 6.372 1.00 0.38 C ATOM 1314 C PRO A 325 -5.199 3.204 7.355 1.00 0.40 C ATOM 1315 O PRO A 325 -5.643 3.998 8.184 1.00 0.47 O ATOM 1316 CB PRO A 325 -7.435 3.283 6.224 1.00 0.47 C ATOM 1317 CG PRO A 325 -8.367 2.658 7.204 1.00 0.47 C ATOM 1318 CD PRO A 325 -7.981 1.206 7.290 1.00 0.42 C ATOM 1319 HA PRO A 325 -5.559 2.419 5.447 1.00 0.00 H ATOM 1320 HD3 PRO A 325 -8.080 0.838 8.311 1.00 0.00 H ATOM 1321 HD2 PRO A 325 -8.597 0.600 6.625 1.00 0.00 H ATOM 1322 HG3 PRO A 325 -9.397 2.755 6.860 1.00 0.00 H ATOM 1323 HG2 PRO A 325 -8.264 3.134 8.179 1.00 0.00 H ATOM 1324 HB2 PRO A 325 -7.281 4.336 6.458 1.00 0.00 H ATOM 1325 HB3 PRO A 325 -7.825 3.191 5.210 1.00 0.00 H ATOM 1326 N GLY A 326 -3.907 2.910 7.256 1.00 0.35 N ATOM 1327 CA GLY A 326 -2.940 3.527 8.145 1.00 0.37 C ATOM 1328 C GLY A 326 -1.545 3.619 7.546 1.00 0.34 C ATOM 1329 O GLY A 326 -0.552 3.499 8.264 1.00 0.47 O ATOM 1330 HA3 GLY A 326 -2.886 2.938 9.060 1.00 0.00 H ATOM 1331 HA2 GLY A 326 -3.282 4.534 8.383 1.00 0.00 H ATOM 1332 H GLY A 326 -3.586 2.232 6.535 1.00 0.00 H ATOM 1333 N CYS A 327 -1.462 3.841 6.235 1.00 0.31 N ATOM 1334 CA CYS A 327 -0.169 3.956 5.565 1.00 0.30 C ATOM 1335 C CYS A 327 0.282 5.412 5.532 1.00 0.29 C ATOM 1336 O CYS A 327 -0.539 6.322 5.430 1.00 0.37 O ATOM 1337 CB CYS A 327 -0.247 3.395 4.142 1.00 0.31 C ATOM 1338 SG CYS A 327 0.118 1.611 4.017 1.00 0.36 S ATOM 1339 HA CYS A 327 0.562 3.374 6.127 1.00 0.00 H ATOM 1340 HB2 CYS A 327 0.469 3.935 3.522 1.00 0.00 H ATOM 1341 HB3 CYS A 327 -1.255 3.565 3.762 1.00 0.00 H ATOM 1342 HG CYS A 327 -0.787 0.903 4.781 1.00 0.00 H ATOM 1343 H CYS A 327 -2.335 3.934 5.678 1.00 0.00 H ATOM 1344 N LYS A 328 1.589 5.630 5.632 1.00 0.26 N ATOM 1345 CA LYS A 328 2.141 6.981 5.625 1.00 0.27 C ATOM 1346 C LYS A 328 1.977 7.648 4.261 1.00 0.29 C ATOM 1347 O LYS A 328 1.222 8.609 4.116 1.00 0.29 O ATOM 1348 CB LYS A 328 3.621 6.949 6.013 1.00 0.29 C ATOM 1349 CG LYS A 328 3.856 6.896 7.513 1.00 0.32 C ATOM 1350 CD LYS A 328 4.907 7.905 7.948 1.00 0.46 C ATOM 1351 CE LYS A 328 5.164 7.831 9.445 1.00 0.94 C ATOM 1352 NZ LYS A 328 6.552 7.386 9.749 1.00 1.73 N ATOM 1353 HA LYS A 328 1.586 7.569 6.357 1.00 0.00 H ATOM 1354 HB2 LYS A 328 4.077 6.068 5.561 1.00 0.00 H ATOM 1355 HB3 LYS A 328 4.100 7.846 5.620 1.00 0.00 H ATOM 1356 HG2 LYS A 328 2.920 7.115 8.027 1.00 0.00 H ATOM 1357 HG3 LYS A 328 4.192 5.895 7.784 1.00 0.00 H ATOM 1358 HD2 LYS A 328 5.837 7.699 7.418 1.00 0.00 H ATOM 1359 HD3 LYS A 328 4.561 8.908 7.697 1.00 0.00 H ATOM 1360 HE2 LYS A 328 4.462 7.125 9.889 1.00 0.00 H ATOM 1361 HE3 LYS A 328 5.007 8.819 9.879 1.00 0.00 H ATOM 1362 HZ1 LYS A 328 6.708 6.441 9.344 1.00 0.00 H ATOM 1363 HZ2 LYS A 328 7.229 8.058 9.335 1.00 0.00 H ATOM 1364 HZ3 LYS A 328 6.685 7.349 10.780 1.00 0.00 H ATOM 1365 H LYS A 328 2.234 4.819 5.717 1.00 0.00 H ATOM 1366 N TYR A 329 2.696 7.138 3.267 1.00 0.35 N ATOM 1367 CA TYR A 329 2.640 7.690 1.916 1.00 0.40 C ATOM 1368 C TYR A 329 1.221 7.653 1.350 1.00 0.37 C ATOM 1369 O TYR A 329 0.791 8.589 0.676 1.00 0.44 O ATOM 1370 CB TYR A 329 3.586 6.919 0.994 1.00 0.49 C ATOM 1371 CG TYR A 329 3.792 7.578 -0.352 1.00 0.59 C ATOM 1372 CD1 TYR A 329 4.770 8.548 -0.529 1.00 1.32 C ATOM 1373 CD2 TYR A 329 3.007 7.229 -1.445 1.00 1.36 C ATOM 1374 CE1 TYR A 329 4.961 9.152 -1.758 1.00 1.37 C ATOM 1375 CE2 TYR A 329 3.193 7.829 -2.676 1.00 1.42 C ATOM 1376 CZ TYR A 329 4.170 8.789 -2.827 1.00 0.81 C ATOM 1377 OH TYR A 329 4.358 9.388 -4.052 1.00 0.92 O ATOM 1378 HA TYR A 329 2.953 8.733 1.971 1.00 0.00 H ATOM 1379 HB3 TYR A 329 3.173 5.924 0.831 1.00 0.00 H ATOM 1380 HB2 TYR A 329 4.554 6.833 1.487 1.00 0.00 H ATOM 1381 HD2 TYR A 329 2.233 6.470 -1.329 1.00 0.00 H ATOM 1382 HE2 TYR A 329 2.570 7.544 -3.524 1.00 0.00 H ATOM 1383 HE1 TYR A 329 5.733 9.911 -1.881 1.00 0.00 H ATOM 1384 HD1 TYR A 329 5.397 8.838 0.314 1.00 0.00 H ATOM 1385 HH TYR A 329 5.093 10.048 -3.986 1.00 0.00 H ATOM 1386 H TYR A 329 3.315 6.324 3.456 1.00 0.00 H ATOM 1387 N LEU A 330 0.504 6.565 1.615 1.00 0.32 N ATOM 1388 CA LEU A 330 -0.859 6.403 1.118 1.00 0.31 C ATOM 1389 C LEU A 330 -1.763 7.539 1.600 1.00 0.30 C ATOM 1390 O LEU A 330 -2.353 8.257 0.794 1.00 0.37 O ATOM 1391 CB LEU A 330 -1.420 5.051 1.570 1.00 0.33 C ATOM 1392 CG LEU A 330 -2.421 4.394 0.613 1.00 0.36 C ATOM 1393 CD1 LEU A 330 -3.631 5.287 0.390 1.00 0.81 C ATOM 1394 CD2 LEU A 330 -1.751 4.058 -0.711 1.00 0.59 C ATOM 1395 HA LEU A 330 -0.832 6.436 0.029 1.00 0.00 H ATOM 1396 HB2 LEU A 330 -0.582 4.367 1.700 1.00 0.00 H ATOM 1397 HB3 LEU A 330 -1.919 5.198 2.528 1.00 0.00 H ATOM 1398 HG LEU A 330 -2.768 3.467 1.070 1.00 0.00 H ATOM 1399 HD21 LEU A 330 -1.372 4.972 -1.167 1.00 0.00 H ATOM 1400 HD22 LEU A 330 -0.925 3.369 -0.534 1.00 0.00 H ATOM 1401 HD23 LEU A 330 -2.478 3.592 -1.377 1.00 0.00 H ATOM 1402 HD11 LEU A 330 -4.127 5.469 1.343 1.00 0.00 H ATOM 1403 HD12 LEU A 330 -3.307 6.235 -0.040 1.00 0.00 H ATOM 1404 HD13 LEU A 330 -4.323 4.795 -0.293 1.00 0.00 H ATOM 1405 H LEU A 330 0.926 5.809 2.192 1.00 0.00 H ATOM 1406 N LEU A 331 -1.873 7.694 2.916 1.00 0.25 N ATOM 1407 CA LEU A 331 -2.712 8.742 3.494 1.00 0.27 C ATOM 1408 C LEU A 331 -2.228 10.128 3.082 1.00 0.27 C ATOM 1409 O LEU A 331 -3.026 10.999 2.743 1.00 0.33 O ATOM 1410 CB LEU A 331 -2.725 8.635 5.020 1.00 0.31 C ATOM 1411 CG LEU A 331 -3.706 7.611 5.592 1.00 0.34 C ATOM 1412 CD1 LEU A 331 -3.118 6.939 6.823 1.00 1.07 C ATOM 1413 CD2 LEU A 331 -5.032 8.276 5.930 1.00 1.09 C ATOM 1414 HA LEU A 331 -3.724 8.602 3.114 1.00 0.00 H ATOM 1415 HB2 LEU A 331 -1.722 8.361 5.348 1.00 0.00 H ATOM 1416 HB3 LEU A 331 -2.984 9.613 5.425 1.00 0.00 H ATOM 1417 HG LEU A 331 -3.886 6.847 4.836 1.00 0.00 H ATOM 1418 HD21 LEU A 331 -4.866 9.060 6.669 1.00 0.00 H ATOM 1419 HD22 LEU A 331 -5.459 8.711 5.027 1.00 0.00 H ATOM 1420 HD23 LEU A 331 -5.717 7.532 6.336 1.00 0.00 H ATOM 1421 HD11 LEU A 331 -2.193 6.430 6.551 1.00 0.00 H ATOM 1422 HD12 LEU A 331 -2.910 7.693 7.582 1.00 0.00 H ATOM 1423 HD13 LEU A 331 -3.831 6.214 7.215 1.00 0.00 H ATOM 1424 H LEU A 331 -1.350 7.055 3.548 1.00 0.00 H ATOM 1425 N GLU A 332 -0.919 10.324 3.126 1.00 0.27 N ATOM 1426 CA GLU A 332 -0.318 11.607 2.770 1.00 0.29 C ATOM 1427 C GLU A 332 -0.577 11.984 1.308 1.00 0.25 C ATOM 1428 O GLU A 332 -0.705 13.165 0.985 1.00 0.28 O ATOM 1429 CB GLU A 332 1.188 11.573 3.035 1.00 0.36 C ATOM 1430 CG GLU A 332 1.561 11.917 4.468 1.00 0.39 C ATOM 1431 CD GLU A 332 2.384 13.187 4.567 1.00 0.47 C ATOM 1432 OE1 GLU A 332 3.442 13.261 3.907 1.00 1.29 O ATOM 1433 OE2 GLU A 332 1.970 14.106 5.304 1.00 1.14 O ATOM 1434 HA GLU A 332 -0.787 12.367 3.394 1.00 0.00 H ATOM 1435 HB2 GLU A 332 1.555 10.571 2.814 1.00 0.00 H ATOM 1436 HB3 GLU A 332 1.671 12.290 2.371 1.00 0.00 H ATOM 1437 HG2 GLU A 332 0.646 12.048 5.046 1.00 0.00 H ATOM 1438 HG3 GLU A 332 2.139 11.093 4.886 1.00 0.00 H ATOM 1439 H GLU A 332 -0.301 9.542 3.423 1.00 0.00 H ATOM 1440 N GLN A 333 -0.631 10.986 0.424 1.00 0.24 N ATOM 1441 CA GLN A 333 -0.852 11.235 -1.000 1.00 0.22 C ATOM 1442 C GLN A 333 -2.144 12.012 -1.254 1.00 0.22 C ATOM 1443 O GLN A 333 -2.100 13.174 -1.659 1.00 0.27 O ATOM 1444 CB GLN A 333 -0.878 9.915 -1.772 1.00 0.24 C ATOM 1445 CG GLN A 333 0.493 9.462 -2.247 1.00 0.41 C ATOM 1446 CD GLN A 333 0.896 10.104 -3.560 1.00 0.79 C ATOM 1447 OE1 GLN A 333 0.500 9.649 -4.634 1.00 1.61 O ATOM 1448 NE2 GLN A 333 1.689 11.166 -3.481 1.00 1.42 N ATOM 1449 HA GLN A 333 -0.023 11.848 -1.353 1.00 0.00 H ATOM 1450 HB2 GLN A 333 -1.290 9.143 -1.122 1.00 0.00 H ATOM 1451 HB3 GLN A 333 -1.522 10.037 -2.643 1.00 0.00 H ATOM 1452 HG2 GLN A 333 1.230 9.725 -1.488 1.00 0.00 H ATOM 1453 HG3 GLN A 333 0.478 8.380 -2.377 1.00 0.00 H ATOM 1454 HE22 GLN A 333 1.999 11.516 -2.552 1.00 0.00 H ATOM 1455 HE21 GLN A 333 2.000 11.648 -4.348 1.00 0.00 H ATOM 1456 H GLN A 333 -0.513 10.007 0.756 1.00 0.00 H ATOM 1457 N LYS A 334 -3.290 11.367 -1.024 1.00 0.20 N ATOM 1458 CA LYS A 334 -4.591 12.008 -1.242 1.00 0.23 C ATOM 1459 C LYS A 334 -5.271 12.420 0.074 1.00 0.24 C ATOM 1460 O LYS A 334 -6.503 12.525 0.139 1.00 0.26 O ATOM 1461 CB LYS A 334 -5.508 11.081 -2.039 1.00 0.25 C ATOM 1462 CG LYS A 334 -4.942 10.674 -3.390 1.00 0.46 C ATOM 1463 CD LYS A 334 -5.493 11.545 -4.508 1.00 0.60 C ATOM 1464 CE LYS A 334 -4.446 11.808 -5.578 1.00 0.46 C ATOM 1465 NZ LYS A 334 -3.548 12.938 -5.210 1.00 0.90 N ATOM 1466 HA LYS A 334 -4.408 12.920 -1.810 1.00 0.00 H ATOM 1467 HB2 LYS A 334 -5.680 10.179 -1.452 1.00 0.00 H ATOM 1468 HB3 LYS A 334 -6.456 11.593 -2.203 1.00 0.00 H ATOM 1469 HG2 LYS A 334 -3.857 10.773 -3.365 1.00 0.00 H ATOM 1470 HG3 LYS A 334 -5.206 9.635 -3.587 1.00 0.00 H ATOM 1471 HD2 LYS A 334 -6.345 11.040 -4.963 1.00 0.00 H ATOM 1472 HD3 LYS A 334 -5.818 12.497 -4.088 1.00 0.00 H ATOM 1473 HE2 LYS A 334 -4.951 12.049 -6.514 1.00 0.00 H ATOM 1474 HE3 LYS A 334 -3.845 10.909 -5.712 1.00 0.00 H ATOM 1475 HZ1 LYS A 334 -4.113 13.802 -5.087 1.00 0.00 H ATOM 1476 HZ2 LYS A 334 -3.057 12.714 -4.321 1.00 0.00 H ATOM 1477 HZ3 LYS A 334 -2.849 13.084 -5.966 1.00 0.00 H ATOM 1478 H LYS A 334 -3.259 10.385 -0.682 1.00 0.00 H ATOM 1479 N GLY A 335 -4.471 12.676 1.113 1.00 0.26 N ATOM 1480 CA GLY A 335 -5.010 13.098 2.394 1.00 0.32 C ATOM 1481 C GLY A 335 -5.973 12.110 3.034 1.00 0.28 C ATOM 1482 O GLY A 335 -6.481 11.181 2.391 1.00 0.23 O ATOM 1483 HA3 GLY A 335 -5.538 14.040 2.247 1.00 0.00 H ATOM 1484 HA2 GLY A 335 -4.177 13.253 3.079 1.00 0.00 H ATOM 1485 H GLY A 335 -3.442 12.571 1.002 1.00 0.00 H ATOM 1486 N GLN A 336 -6.238 12.334 4.316 1.00 0.32 N ATOM 1487 CA GLN A 336 -7.158 11.494 5.066 1.00 0.32 C ATOM 1488 C GLN A 336 -8.545 11.498 4.422 1.00 0.28 C ATOM 1489 O GLN A 336 -9.271 10.507 4.509 1.00 0.26 O ATOM 1490 CB GLN A 336 -7.253 11.973 6.515 1.00 0.38 C ATOM 1491 CG GLN A 336 -6.392 11.173 7.479 1.00 1.34 C ATOM 1492 CD GLN A 336 -4.937 11.600 7.454 1.00 1.78 C ATOM 1493 OE1 GLN A 336 -4.383 11.896 6.395 1.00 2.31 O ATOM 1494 NE2 GLN A 336 -4.310 11.632 8.624 1.00 2.38 N ATOM 1495 HA GLN A 336 -6.774 10.474 5.054 1.00 0.00 H ATOM 1496 HB2 GLN A 336 -6.937 13.016 6.555 1.00 0.00 H ATOM 1497 HB3 GLN A 336 -8.292 11.897 6.836 1.00 0.00 H ATOM 1498 HG2 GLN A 336 -6.779 11.310 8.489 1.00 0.00 H ATOM 1499 HG3 GLN A 336 -6.451 10.119 7.208 1.00 0.00 H ATOM 1500 HE22 GLN A 336 -4.818 11.373 9.494 1.00 0.00 H ATOM 1501 HE21 GLN A 336 -3.311 11.916 8.671 1.00 0.00 H ATOM 1502 H GLN A 336 -5.775 13.132 4.796 1.00 0.00 H ATOM 1503 N GLU A 337 -8.914 12.612 3.780 1.00 0.29 N ATOM 1504 CA GLU A 337 -10.213 12.727 3.130 1.00 0.30 C ATOM 1505 C GLU A 337 -10.417 11.626 2.092 1.00 0.25 C ATOM 1506 O GLU A 337 -11.455 10.965 2.081 1.00 0.25 O ATOM 1507 CB GLU A 337 -10.354 14.097 2.466 1.00 0.34 C ATOM 1508 CG GLU A 337 -11.544 14.197 1.525 1.00 0.39 C ATOM 1509 CD GLU A 337 -12.162 15.581 1.511 1.00 0.61 C ATOM 1510 OE1 GLU A 337 -11.531 16.507 0.960 1.00 1.44 O ATOM 1511 OE2 GLU A 337 -13.277 15.739 2.051 1.00 1.22 O ATOM 1512 HA GLU A 337 -10.978 12.617 3.898 1.00 0.00 H ATOM 1513 HB2 GLU A 337 -10.468 14.849 3.247 1.00 0.00 H ATOM 1514 HB3 GLU A 337 -9.446 14.300 1.897 1.00 0.00 H ATOM 1515 HG2 GLU A 337 -11.213 13.952 0.516 1.00 0.00 H ATOM 1516 HG3 GLU A 337 -12.301 13.480 1.842 1.00 0.00 H ATOM 1517 H GLU A 337 -8.257 13.417 3.744 1.00 0.00 H ATOM 1518 N TYR A 338 -9.430 11.429 1.218 1.00 0.23 N ATOM 1519 CA TYR A 338 -9.540 10.402 0.188 1.00 0.21 C ATOM 1520 C TYR A 338 -9.596 9.008 0.802 1.00 0.19 C ATOM 1521 O TYR A 338 -10.420 8.182 0.406 1.00 0.19 O ATOM 1522 CB TYR A 338 -8.369 10.487 -0.787 1.00 0.22 C ATOM 1523 CG TYR A 338 -8.516 9.575 -1.987 1.00 0.28 C ATOM 1524 CD1 TYR A 338 -8.136 8.240 -1.920 1.00 1.29 C ATOM 1525 CD2 TYR A 338 -9.034 10.051 -3.184 1.00 1.19 C ATOM 1526 CE1 TYR A 338 -8.270 7.404 -3.014 1.00 1.40 C ATOM 1527 CE2 TYR A 338 -9.172 9.221 -4.282 1.00 1.20 C ATOM 1528 CZ TYR A 338 -8.788 7.900 -4.191 1.00 0.62 C ATOM 1529 OH TYR A 338 -8.923 7.072 -5.282 1.00 0.81 O ATOM 1530 HA TYR A 338 -10.469 10.580 -0.354 1.00 0.00 H ATOM 1531 HB3 TYR A 338 -7.457 10.215 -0.256 1.00 0.00 H ATOM 1532 HB2 TYR A 338 -8.289 11.515 -1.142 1.00 0.00 H ATOM 1533 HD2 TYR A 338 -9.337 11.095 -3.260 1.00 0.00 H ATOM 1534 HE2 TYR A 338 -9.582 9.609 -5.214 1.00 0.00 H ATOM 1535 HE1 TYR A 338 -7.968 6.359 -2.946 1.00 0.00 H ATOM 1536 HD1 TYR A 338 -7.726 7.845 -0.991 1.00 0.00 H ATOM 1537 HH TYR A 338 -8.603 6.165 -5.048 1.00 0.00 H ATOM 1538 H TYR A 338 -8.572 12.014 1.271 1.00 0.00 H ATOM 1539 N ILE A 339 -8.716 8.742 1.763 1.00 0.19 N ATOM 1540 CA ILE A 339 -8.686 7.429 2.409 1.00 0.20 C ATOM 1541 C ILE A 339 -10.020 7.117 3.089 1.00 0.21 C ATOM 1542 O ILE A 339 -10.523 5.995 3.004 1.00 0.29 O ATOM 1543 CB ILE A 339 -7.551 7.313 3.451 1.00 0.22 C ATOM 1544 CG1 ILE A 339 -6.213 7.786 2.868 1.00 0.33 C ATOM 1545 CG2 ILE A 339 -7.437 5.877 3.942 1.00 0.31 C ATOM 1546 CD1 ILE A 339 -5.985 7.368 1.431 1.00 0.39 C ATOM 1547 HA ILE A 339 -8.501 6.705 1.615 1.00 0.00 H ATOM 1548 HB ILE A 339 -7.796 7.959 4.294 1.00 0.00 H ATOM 1549 HG12 ILE A 339 -6.183 8.874 2.917 1.00 0.00 H ATOM 1550 HG13 ILE A 339 -5.409 7.374 3.477 1.00 0.00 H ATOM 1551 HD11 ILE A 339 -5.999 6.280 1.364 1.00 0.00 H ATOM 1552 HD12 ILE A 339 -6.774 7.782 0.804 1.00 0.00 H ATOM 1553 HD13 ILE A 339 -5.018 7.741 1.094 1.00 0.00 H ATOM 1554 HG21 ILE A 339 -8.378 5.576 4.402 1.00 0.00 H ATOM 1555 HG22 ILE A 339 -7.218 5.222 3.099 1.00 0.00 H ATOM 1556 HG23 ILE A 339 -6.634 5.808 4.676 1.00 0.00 H ATOM 1557 H ILE A 339 -8.041 9.476 2.059 1.00 0.00 H ATOM 1558 N ASN A 340 -10.589 8.115 3.757 1.00 0.25 N ATOM 1559 CA ASN A 340 -11.864 7.949 4.446 1.00 0.27 C ATOM 1560 C ASN A 340 -12.984 7.631 3.459 1.00 0.25 C ATOM 1561 O ASN A 340 -13.840 6.789 3.733 1.00 0.24 O ATOM 1562 CB ASN A 340 -12.211 9.212 5.238 1.00 0.34 C ATOM 1563 CG ASN A 340 -11.925 9.062 6.719 1.00 0.97 C ATOM 1564 OD1 ASN A 340 -10.839 9.400 7.190 1.00 1.57 O ATOM 1565 ND2 ASN A 340 -12.901 8.554 7.463 1.00 1.68 N ATOM 1566 HA ASN A 340 -11.765 7.111 5.136 1.00 0.00 H ATOM 1567 HB2 ASN A 340 -11.621 10.042 4.850 1.00 0.00 H ATOM 1568 HB3 ASN A 340 -13.271 9.428 5.106 1.00 0.00 H ATOM 1569 HD22 ASN A 340 -13.803 8.282 7.022 1.00 0.00 H ATOM 1570 HD21 ASN A 340 -12.763 8.428 8.486 1.00 0.00 H ATOM 1571 H ASN A 340 -10.113 9.039 3.789 1.00 0.00 H ATOM 1572 N ASN A 341 -12.972 8.310 2.312 1.00 0.25 N ATOM 1573 CA ASN A 341 -13.987 8.098 1.284 1.00 0.26 C ATOM 1574 C ASN A 341 -14.019 6.637 0.847 1.00 0.24 C ATOM 1575 O ASN A 341 -15.089 6.051 0.685 1.00 0.29 O ATOM 1576 CB ASN A 341 -13.716 8.998 0.077 1.00 0.28 C ATOM 1577 CG ASN A 341 -14.612 8.671 -1.101 1.00 0.36 C ATOM 1578 OD1 ASN A 341 -15.785 9.044 -1.127 1.00 0.94 O ATOM 1579 ND2 ASN A 341 -14.062 7.969 -2.085 1.00 0.99 N ATOM 1580 HA ASN A 341 -14.958 8.354 1.708 1.00 0.00 H ATOM 1581 HB2 ASN A 341 -13.885 10.035 0.368 1.00 0.00 H ATOM 1582 HB3 ASN A 341 -12.677 8.872 -0.228 1.00 0.00 H ATOM 1583 HD22 ASN A 341 -13.067 7.675 -2.021 1.00 0.00 H ATOM 1584 HD21 ASN A 341 -14.627 7.713 -2.920 1.00 0.00 H ATOM 1585 H ASN A 341 -12.220 9.009 2.145 1.00 0.00 H ATOM 1586 N ILE A 342 -12.839 6.051 0.667 1.00 0.19 N ATOM 1587 CA ILE A 342 -12.737 4.656 0.260 1.00 0.21 C ATOM 1588 C ILE A 342 -13.407 3.744 1.281 1.00 0.23 C ATOM 1589 O ILE A 342 -14.240 2.909 0.932 1.00 0.29 O ATOM 1590 CB ILE A 342 -11.268 4.222 0.094 1.00 0.20 C ATOM 1591 CG1 ILE A 342 -10.636 4.926 -1.107 1.00 0.32 C ATOM 1592 CG2 ILE A 342 -11.178 2.712 -0.062 1.00 0.23 C ATOM 1593 CD1 ILE A 342 -9.130 4.790 -1.160 1.00 0.19 C ATOM 1594 HA ILE A 342 -13.244 4.567 -0.701 1.00 0.00 H ATOM 1595 HB ILE A 342 -10.716 4.510 0.989 1.00 0.00 H ATOM 1596 HG12 ILE A 342 -11.054 4.498 -2.018 1.00 0.00 H ATOM 1597 HG13 ILE A 342 -10.886 5.986 -1.057 1.00 0.00 H ATOM 1598 HD11 ILE A 342 -8.695 5.224 -0.260 1.00 0.00 H ATOM 1599 HD12 ILE A 342 -8.864 3.735 -1.221 1.00 0.00 H ATOM 1600 HD13 ILE A 342 -8.750 5.313 -2.037 1.00 0.00 H ATOM 1601 HG21 ILE A 342 -11.594 2.231 0.823 1.00 0.00 H ATOM 1602 HG22 ILE A 342 -11.742 2.405 -0.943 1.00 0.00 H ATOM 1603 HG23 ILE A 342 -10.134 2.422 -0.178 1.00 0.00 H ATOM 1604 H ILE A 342 -11.970 6.601 0.820 1.00 0.00 H ATOM 1605 N HIS A 343 -13.036 3.914 2.547 1.00 0.24 N ATOM 1606 CA HIS A 343 -13.601 3.109 3.623 1.00 0.29 C ATOM 1607 C HIS A 343 -14.961 3.651 4.051 1.00 0.44 C ATOM 1608 O HIS A 343 -15.112 4.177 5.154 1.00 1.24 O ATOM 1609 CB HIS A 343 -12.650 3.082 4.821 1.00 0.37 C ATOM 1610 CG HIS A 343 -13.000 2.042 5.840 1.00 0.61 C ATOM 1611 ND1 HIS A 343 -12.857 2.239 7.197 1.00 1.39 N ATOM 1612 CD2 HIS A 343 -13.492 0.788 5.693 1.00 1.31 C ATOM 1613 CE1 HIS A 343 -13.244 1.152 7.841 1.00 1.38 C ATOM 1614 NE2 HIS A 343 -13.634 0.258 6.951 1.00 1.22 N ATOM 1615 HA HIS A 343 -13.735 2.093 3.251 1.00 0.00 H ATOM 1616 HB2 HIS A 343 -11.642 2.883 4.457 1.00 0.00 H ATOM 1617 HB3 HIS A 343 -12.674 4.059 5.303 1.00 0.00 H ATOM 1618 HD2 HIS A 343 -13.730 0.293 4.752 1.00 0.00 H ATOM 1619 HE1 HIS A 343 -13.242 1.016 8.923 1.00 0.00 H ATOM 1620 H HIS A 343 -12.326 4.639 2.775 1.00 0.00 H ATOM 1621 N LEU A 344 -15.948 3.520 3.171 1.00 1.09 N ATOM 1622 CA LEU A 344 -17.296 3.997 3.456 1.00 1.25 C ATOM 1623 C LEU A 344 -18.251 3.637 2.323 1.00 0.82 C ATOM 1624 O LEU A 344 -19.330 3.091 2.555 1.00 1.55 O ATOM 1625 CB LEU A 344 -17.289 5.512 3.671 1.00 1.98 C ATOM 1626 CG LEU A 344 -17.682 5.969 5.076 1.00 2.64 C ATOM 1627 CD1 LEU A 344 -16.878 7.195 5.482 1.00 3.42 C ATOM 1628 CD2 LEU A 344 -19.173 6.261 5.143 1.00 3.20 C ATOM 1629 HA LEU A 344 -17.642 3.509 4.367 1.00 0.00 H ATOM 1630 HB2 LEU A 344 -16.283 5.878 3.466 1.00 0.00 H ATOM 1631 HB3 LEU A 344 -17.988 5.957 2.963 1.00 0.00 H ATOM 1632 HG LEU A 344 -17.458 5.164 5.776 1.00 0.00 H ATOM 1633 HD21 LEU A 344 -19.420 7.049 4.431 1.00 0.00 H ATOM 1634 HD22 LEU A 344 -19.730 5.358 4.895 1.00 0.00 H ATOM 1635 HD23 LEU A 344 -19.434 6.585 6.151 1.00 0.00 H ATOM 1636 HD11 LEU A 344 -15.816 6.951 5.473 1.00 0.00 H ATOM 1637 HD12 LEU A 344 -17.072 8.005 4.778 1.00 0.00 H ATOM 1638 HD13 LEU A 344 -17.172 7.505 6.485 1.00 0.00 H ATOM 1639 H LEU A 344 -15.754 3.066 2.256 1.00 0.00 H ATOM 1640 N THR A 345 -17.845 3.945 1.095 1.00 0.70 N ATOM 1641 CA THR A 345 -18.662 3.654 -0.076 1.00 0.98 C ATOM 1642 C THR A 345 -17.797 3.208 -1.250 1.00 0.92 C ATOM 1643 O THR A 345 -16.592 3.457 -1.276 1.00 1.29 O ATOM 1644 CB THR A 345 -19.492 4.880 -0.502 1.00 1.71 C ATOM 1645 OG1 THR A 345 -18.913 6.075 0.035 1.00 2.38 O ATOM 1646 CG2 THR A 345 -20.931 4.750 -0.025 1.00 2.36 C ATOM 1647 HA THR A 345 -19.339 2.846 0.203 1.00 0.00 H ATOM 1648 HB THR A 345 -19.489 4.933 -1.591 1.00 0.00 H ATOM 1649 HG1 THR A 345 -19.453 6.856 -0.244 1.00 0.00 H ATOM 1650 HG23 THR A 345 -21.368 3.840 -0.436 1.00 0.00 H ATOM 1651 HG21 THR A 345 -20.949 4.704 1.064 1.00 0.00 H ATOM 1652 HG22 THR A 345 -21.504 5.614 -0.363 1.00 0.00 H ATOM 1653 H THR A 345 -16.921 4.405 0.967 1.00 0.00 H ATOM 1654 N HIS A 346 -18.420 2.547 -2.220 1.00 0.92 N ATOM 1655 CA HIS A 346 -17.706 2.066 -3.397 1.00 0.98 C ATOM 1656 C HIS A 346 -17.158 3.231 -4.216 1.00 0.80 C ATOM 1657 O HIS A 346 -17.815 4.263 -4.360 1.00 0.98 O ATOM 1658 CB HIS A 346 -18.629 1.208 -4.264 1.00 1.38 C ATOM 1659 CG HIS A 346 -19.419 1.998 -5.260 1.00 1.60 C ATOM 1660 ND1 HIS A 346 -19.065 2.106 -6.589 1.00 2.06 N ATOM 1661 CD2 HIS A 346 -20.555 2.722 -5.116 1.00 2.12 C ATOM 1662 CE1 HIS A 346 -19.946 2.862 -7.218 1.00 2.24 C ATOM 1663 NE2 HIS A 346 -20.861 3.248 -6.348 1.00 2.23 N ATOM 1664 HA HIS A 346 -16.867 1.458 -3.058 1.00 0.00 H ATOM 1665 HB2 HIS A 346 -18.020 0.483 -4.804 1.00 0.00 H ATOM 1666 HB3 HIS A 346 -19.325 0.682 -3.611 1.00 0.00 H ATOM 1667 HD2 HIS A 346 -21.121 2.861 -4.195 1.00 0.00 H ATOM 1668 HE1 HIS A 346 -19.922 3.123 -8.276 1.00 0.00 H ATOM 1669 H HIS A 346 -19.441 2.368 -2.138 1.00 0.00 H ATOM 1670 N SER A 347 -15.951 3.057 -4.748 1.00 0.71 N ATOM 1671 CA SER A 347 -15.306 4.089 -5.554 1.00 0.61 C ATOM 1672 C SER A 347 -14.684 3.489 -6.810 1.00 0.63 C ATOM 1673 O SER A 347 -14.640 2.269 -6.970 1.00 0.83 O ATOM 1674 CB SER A 347 -14.233 4.809 -4.734 1.00 0.65 C ATOM 1675 OG SER A 347 -13.779 5.975 -5.400 1.00 0.85 O ATOM 1676 HA SER A 347 -16.068 4.808 -5.856 1.00 0.00 H ATOM 1677 HB2 SER A 347 -13.390 4.135 -4.580 1.00 0.00 H ATOM 1678 HB3 SER A 347 -14.652 5.091 -3.768 1.00 0.00 H ATOM 1679 HG SER A 347 -13.087 6.420 -4.849 1.00 0.00 H ATOM 1680 H SER A 347 -15.452 2.159 -4.585 1.00 0.00 H ATOM 1681 N LEU A 348 -14.207 4.358 -7.702 1.00 0.78 N ATOM 1682 CA LEU A 348 -13.580 3.932 -8.957 1.00 0.89 C ATOM 1683 C LEU A 348 -14.540 3.108 -9.821 1.00 1.24 C ATOM 1684 O LEU A 348 -15.670 2.821 -9.425 1.00 1.53 O ATOM 1685 CB LEU A 348 -12.296 3.136 -8.683 1.00 0.56 C ATOM 1686 CG LEU A 348 -11.033 3.984 -8.525 1.00 0.59 C ATOM 1687 CD1 LEU A 348 -10.577 4.518 -9.874 1.00 0.71 C ATOM 1688 CD2 LEU A 348 -11.278 5.128 -7.552 1.00 1.37 C ATOM 1689 HA LEU A 348 -13.323 4.835 -9.512 1.00 0.00 H ATOM 1690 HB2 LEU A 348 -12.439 2.568 -7.764 1.00 0.00 H ATOM 1691 HB3 LEU A 348 -12.140 2.448 -9.514 1.00 0.00 H ATOM 1692 HG LEU A 348 -10.242 3.352 -8.121 1.00 0.00 H ATOM 1693 HD21 LEU A 348 -12.084 5.758 -7.929 1.00 0.00 H ATOM 1694 HD22 LEU A 348 -11.557 4.723 -6.579 1.00 0.00 H ATOM 1695 HD23 LEU A 348 -10.368 5.720 -7.453 1.00 0.00 H ATOM 1696 HD11 LEU A 348 -10.362 3.683 -10.540 1.00 0.00 H ATOM 1697 HD12 LEU A 348 -11.366 5.134 -10.305 1.00 0.00 H ATOM 1698 HD13 LEU A 348 -9.677 5.119 -9.740 1.00 0.00 H ATOM 1699 H LEU A 348 -14.283 5.375 -7.500 1.00 0.00 H ATOM 1700 N GLU A 349 -14.080 2.735 -11.011 1.00 1.82 N ATOM 1701 CA GLU A 349 -14.892 1.950 -11.934 1.00 2.27 C ATOM 1702 C GLU A 349 -16.177 2.690 -12.293 1.00 2.62 C ATOM 1703 O GLU A 349 -17.272 2.139 -12.189 1.00 3.21 O ATOM 1704 CB GLU A 349 -15.228 0.589 -11.322 1.00 3.06 C ATOM 1705 CG GLU A 349 -15.565 -0.475 -12.353 1.00 3.63 C ATOM 1706 CD GLU A 349 -14.333 -1.042 -13.030 1.00 4.45 C ATOM 1707 OE1 GLU A 349 -13.251 -0.431 -12.904 1.00 5.01 O ATOM 1708 OE2 GLU A 349 -14.449 -2.098 -13.687 1.00 4.90 O ATOM 1709 HA GLU A 349 -14.314 1.797 -12.846 1.00 0.00 H ATOM 1710 HB2 GLU A 349 -14.369 0.249 -10.744 1.00 0.00 H ATOM 1711 HB3 GLU A 349 -16.085 0.711 -10.659 1.00 0.00 H ATOM 1712 HG2 GLU A 349 -16.096 -1.287 -11.856 1.00 0.00 H ATOM 1713 HG3 GLU A 349 -16.209 -0.033 -13.113 1.00 0.00 H ATOM 1714 H GLU A 349 -13.117 3.010 -11.291 1.00 0.00 H ATOM 1715 N GLU A 350 -16.034 3.942 -12.716 1.00 2.94 N ATOM 1716 CA GLU A 350 -17.184 4.758 -13.090 1.00 3.74 C ATOM 1717 C GLU A 350 -16.857 5.643 -14.288 1.00 4.15 C ATOM 1718 O GLU A 350 -15.696 5.776 -14.676 1.00 4.50 O ATOM 1719 CB GLU A 350 -17.628 5.622 -11.909 1.00 4.41 C ATOM 1720 CG GLU A 350 -18.357 4.844 -10.826 1.00 4.80 C ATOM 1721 CD GLU A 350 -19.005 5.747 -9.795 1.00 5.69 C ATOM 1722 OE1 GLU A 350 -20.135 6.218 -10.043 1.00 6.11 O ATOM 1723 OE2 GLU A 350 -18.382 5.983 -8.738 1.00 6.26 O ATOM 1724 HA GLU A 350 -17.998 4.088 -13.368 1.00 0.00 H ATOM 1725 HB2 GLU A 350 -16.744 6.083 -11.467 1.00 0.00 H ATOM 1726 HB3 GLU A 350 -18.294 6.400 -12.282 1.00 0.00 H ATOM 1727 HG2 GLU A 350 -19.131 4.236 -11.294 1.00 0.00 H ATOM 1728 HG3 GLU A 350 -17.642 4.194 -10.321 1.00 0.00 H ATOM 1729 H GLU A 350 -15.079 4.350 -12.782 1.00 0.00 H ATOM 1730 N CYS A 351 -17.888 6.246 -14.871 1.00 4.60 N ATOM 1731 CA CYS A 351 -17.711 7.118 -16.026 1.00 5.37 C ATOM 1732 C CYS A 351 -17.071 6.361 -17.185 1.00 6.00 C ATOM 1733 O CYS A 351 -15.942 6.653 -17.581 1.00 6.19 O ATOM 1734 CB CYS A 351 -16.848 8.325 -15.652 1.00 5.79 C ATOM 1735 SG CYS A 351 -16.992 9.717 -16.796 1.00 6.39 S ATOM 1736 HA CYS A 351 -18.694 7.467 -16.342 1.00 0.00 H ATOM 1737 HB2 CYS A 351 -15.806 8.007 -15.629 1.00 0.00 H ATOM 1738 HB3 CYS A 351 -17.145 8.665 -14.660 1.00 0.00 H ATOM 1739 HG CYS A 351 -16.178 10.747 -16.370 1.00 0.00 H ATOM 1740 H CYS A 351 -18.845 6.092 -14.494 1.00 0.00 H ATOM 1741 N LEU A 352 -17.802 5.386 -17.722 1.00 6.65 N ATOM 1742 CA LEU A 352 -17.314 4.579 -18.837 1.00 7.51 C ATOM 1743 C LEU A 352 -18.385 4.439 -19.915 1.00 8.01 C ATOM 1744 O LEU A 352 -18.655 3.335 -20.387 1.00 8.17 O ATOM 1745 CB LEU A 352 -16.890 3.193 -18.344 1.00 8.12 C ATOM 1746 CG LEU A 352 -15.713 3.183 -17.367 1.00 8.63 C ATOM 1747 CD1 LEU A 352 -15.903 2.101 -16.316 1.00 8.95 C ATOM 1748 CD2 LEU A 352 -14.404 2.978 -18.114 1.00 9.52 C ATOM 1749 HA LEU A 352 -16.450 5.085 -19.268 1.00 0.00 H ATOM 1750 HB2 LEU A 352 -17.745 2.735 -17.847 1.00 0.00 H ATOM 1751 HB3 LEU A 352 -16.613 2.596 -19.213 1.00 0.00 H ATOM 1752 HG LEU A 352 -15.674 4.149 -16.863 1.00 0.00 H ATOM 1753 HD21 LEU A 352 -14.434 2.026 -18.643 1.00 0.00 H ATOM 1754 HD22 LEU A 352 -14.265 3.788 -18.830 1.00 0.00 H ATOM 1755 HD23 LEU A 352 -13.578 2.974 -17.403 1.00 0.00 H ATOM 1756 HD11 LEU A 352 -16.822 2.292 -15.762 1.00 0.00 H ATOM 1757 HD12 LEU A 352 -15.967 1.129 -16.805 1.00 0.00 H ATOM 1758 HD13 LEU A 352 -15.056 2.110 -15.630 1.00 0.00 H ATOM 1759 H LEU A 352 -18.748 5.194 -17.336 1.00 0.00 H ATOM 1760 N VAL A 353 -18.985 5.570 -20.291 1.00 8.52 N ATOM 1761 CA VAL A 353 -20.034 5.612 -21.313 1.00 9.24 C ATOM 1762 C VAL A 353 -21.348 5.008 -20.809 1.00 9.91 C ATOM 1763 O VAL A 353 -22.336 5.722 -20.639 1.00 10.34 O ATOM 1764 CB VAL A 353 -19.606 4.908 -22.621 1.00 9.65 C ATOM 1765 CG1 VAL A 353 -20.553 5.270 -23.754 1.00 10.11 C ATOM 1766 CG2 VAL A 353 -18.174 5.274 -22.980 1.00 9.79 C ATOM 1767 HA VAL A 353 -20.196 6.668 -21.530 1.00 0.00 H ATOM 1768 HB VAL A 353 -19.654 3.830 -22.465 1.00 0.00 H ATOM 1769 HG11 VAL A 353 -21.564 4.955 -23.496 1.00 0.00 H ATOM 1770 HG12 VAL A 353 -20.536 6.349 -23.909 1.00 0.00 H ATOM 1771 HG13 VAL A 353 -20.236 4.765 -24.666 1.00 0.00 H ATOM 1772 HG21 VAL A 353 -18.100 6.353 -23.117 1.00 0.00 H ATOM 1773 HG22 VAL A 353 -17.508 4.962 -22.175 1.00 0.00 H ATOM 1774 HG23 VAL A 353 -17.892 4.768 -23.904 1.00 0.00 H ATOM 1775 H VAL A 353 -18.695 6.461 -19.839 1.00 0.00 H ATOM 1776 N ARG A 354 -21.361 3.699 -20.570 1.00 10.23 N ATOM 1777 CA ARG A 354 -22.561 3.025 -20.087 1.00 11.06 C ATOM 1778 C ARG A 354 -22.234 1.621 -19.590 1.00 11.65 C ATOM 1779 O ARG A 354 -22.873 0.649 -19.993 1.00 11.81 O ATOM 1780 CB ARG A 354 -23.613 2.955 -21.195 1.00 11.36 C ATOM 1781 CG ARG A 354 -25.025 2.721 -20.681 1.00 12.01 C ATOM 1782 CD ARG A 354 -25.561 3.942 -19.951 1.00 12.42 C ATOM 1783 NE ARG A 354 -26.924 4.274 -20.366 1.00 12.78 N ATOM 1784 CZ ARG A 354 -27.252 4.840 -21.535 1.00 13.42 C ATOM 1785 NH1 ARG A 354 -26.327 5.157 -22.444 1.00 13.75 N ATOM 1786 NH2 ARG A 354 -28.526 5.094 -21.799 1.00 13.89 N ATOM 1787 HA ARG A 354 -22.960 3.602 -19.253 1.00 0.00 H ATOM 1788 HB2 ARG A 354 -23.598 3.896 -21.745 1.00 0.00 H ATOM 1789 HB3 ARG A 354 -23.351 2.138 -21.868 1.00 0.00 H ATOM 1790 HG2 ARG A 354 -25.677 2.498 -21.525 1.00 0.00 H ATOM 1791 HG3 ARG A 354 -25.017 1.873 -19.996 1.00 0.00 H ATOM 1792 HD2 ARG A 354 -24.912 4.792 -20.162 1.00 0.00 H ATOM 1793 HD3 ARG A 354 -25.558 3.741 -18.880 1.00 0.00 H ATOM 1794 HE ARG A 354 -27.696 4.054 -19.704 1.00 0.00 H ATOM 1795 HH12 ARG A 354 -26.611 5.596 -23.343 1.00 0.00 H ATOM 1796 HH11 ARG A 354 -25.323 4.965 -22.253 1.00 0.00 H ATOM 1797 HH22 ARG A 354 -28.792 5.533 -22.703 1.00 0.00 H ATOM 1798 HH21 ARG A 354 -29.259 4.854 -21.102 1.00 0.00 H ATOM 1799 H ARG A 354 -20.496 3.144 -20.731 1.00 0.00 H ATOM 1800 N THR A 355 -21.233 1.532 -18.713 1.00 12.17 N ATOM 1801 CA THR A 355 -20.797 0.257 -18.143 1.00 12.94 C ATOM 1802 C THR A 355 -20.477 -0.773 -19.227 1.00 13.51 C ATOM 1803 O THR A 355 -20.792 -1.955 -19.085 1.00 13.79 O ATOM 1804 CB THR A 355 -21.853 -0.324 -17.178 1.00 13.46 C ATOM 1805 OG1 THR A 355 -22.917 -0.944 -17.911 1.00 13.53 O ATOM 1806 CG2 THR A 355 -22.421 0.766 -16.281 1.00 13.87 C ATOM 1807 HA THR A 355 -19.885 0.468 -17.584 1.00 0.00 H ATOM 1808 HB THR A 355 -21.363 -1.074 -16.557 1.00 0.00 H ATOM 1809 HG1 THR A 355 -23.350 -0.271 -18.495 1.00 0.00 H ATOM 1810 HG23 THR A 355 -21.610 1.236 -15.725 1.00 0.00 H ATOM 1811 HG21 THR A 355 -22.924 1.514 -16.894 1.00 0.00 H ATOM 1812 HG22 THR A 355 -23.134 0.326 -15.584 1.00 0.00 H ATOM 1813 H THR A 355 -20.743 2.403 -18.423 1.00 0.00 H ATOM 1814 N THR A 356 -19.842 -0.316 -20.306 1.00 13.83 N ATOM 1815 CA THR A 356 -19.474 -1.193 -21.414 1.00 14.54 C ATOM 1816 C THR A 356 -20.695 -1.905 -21.988 1.00 15.31 C ATOM 1817 O THR A 356 -21.825 -1.440 -21.730 1.00 15.71 O ATOM 1818 CB THR A 356 -18.434 -2.246 -20.982 1.00 14.80 C ATOM 1819 OG1 THR A 356 -19.095 -3.416 -20.485 1.00 14.91 O ATOM 1820 CG2 THR A 356 -17.507 -1.688 -19.913 1.00 14.32 C ATOM 1821 HA THR A 356 -19.036 -0.556 -22.183 1.00 0.00 H ATOM 1822 OXT THR A 356 -20.510 -2.921 -22.691 1.00 15.63 O ATOM 1823 HB THR A 356 -17.837 -2.511 -21.855 1.00 0.00 H ATOM 1824 HG1 THR A 356 -19.654 -3.172 -19.705 1.00 0.00 H ATOM 1825 HG23 THR A 356 -17.007 -0.798 -20.296 1.00 0.00 H ATOM 1826 HG21 THR A 356 -18.089 -1.427 -19.029 1.00 0.00 H ATOM 1827 HG22 THR A 356 -16.763 -2.440 -19.650 1.00 0.00 H ATOM 1828 H THR A 356 -19.602 0.694 -20.360 1.00 0.00 H TER 1829 THR A 356 HETATM 1830 ZN ZN A 1 -0.705 -0.284 4.416 1.00 0.21 ZN HETATM 1831 C1 UNN A 2 -0.273 -13.416 5.858 1.00 -0.02 C HETATM 1832 C2 UNN A 2 -1.673 -13.930 6.146 1.00 0.07 C HETATM 1833 N5 UNN A 2 -2.654 -12.845 5.891 1.00 -0.27 N HETATM 1834 C10 UNN A 2 -3.962 -13.068 5.779 1.00 0.20 C HETATM 1835 C13 UNN A 2 -4.887 -11.886 5.609 1.00 0.13 C HETATM 1836 N15 UNN A 2 -5.997 -12.187 4.658 1.00 -0.25 N HETATM 1837 C17 UNN A 2 -5.934 -12.509 3.349 1.00 0.21 C HETATM 1838 C20 UNN A 2 -7.234 -12.705 2.583 1.00 0.14 C HETATM 1839 N22 UNN A 2 -7.058 -12.241 1.192 1.00 -0.26 N HETATM 1840 C24 UNN A 2 -7.739 -11.182 0.743 1.00 0.23 C HETATM 1841 C28 UNN A 2 -7.543 -10.707 -0.680 1.00 0.06 C HETATM 1842 N30 UNN A 2 -8.702 -9.911 -1.097 1.00 0.24 N HETATM 1843 CNM UNN A 2 -9.658 -10.771 -1.796 1.00 -0.04 C HETATM 1844 H37 UNN A 2 -10.527 -10.174 -2.109 1.00 0.08 H HETATM 1845 H38 UNN A 2 -9.989 -11.575 -1.122 1.00 0.08 H HETATM 1846 H39 UNN A 2 -9.177 -11.210 -2.682 1.00 0.08 H HETATM 1847 H32 UNN A 2 -8.399 -9.174 -1.714 1.00 0.20 H HETATM 1848 H33 UNN A 2 -9.143 -9.509 -0.285 1.00 0.20 H HETATM 1849 C31 UNN A 2 -6.281 -9.857 -0.778 1.00 -0.00 C HETATM 1850 H34 UNN A 2 -5.412 -10.454 -0.465 1.00 0.03 H HETATM 1851 H35 UNN A 2 -6.378 -8.979 -0.122 1.00 0.03 H HETATM 1852 H36 UNN A 2 -6.143 -9.524 -1.817 1.00 0.03 H HETATM 1853 H31 UNN A 2 -7.444 -11.580 -1.342 1.00 0.11 H HETATM 1854 O29 UNN A 2 -8.526 -10.589 1.485 1.00 -0.39 O HETATM 1855 H21 UNN A 2 -6.426 -12.721 0.583 1.00 0.19 H HETATM 1856 C23 UNN A 2 -7.664 -14.194 2.587 1.00 0.00 C HETATM 1857 C25 UNN A 2 -9.093 -14.287 3.116 1.00 -0.06 C HETATM 1858 H22 UNN A 2 -9.413 -15.339 3.125 1.00 0.02 H HETATM 1859 H23 UNN A 2 -9.763 -13.706 2.466 1.00 0.02 H HETATM 1860 H24 UNN A 2 -9.133 -13.883 4.138 1.00 0.02 H HETATM 1861 C26 UNN A 2 -6.742 -15.008 3.495 1.00 -0.06 C HETATM 1862 H25 UNN A 2 -5.710 -14.946 3.120 1.00 0.02 H HETATM 1863 H26 UNN A 2 -7.067 -16.059 3.501 1.00 0.02 H HETATM 1864 H27 UNN A 2 -6.785 -14.605 4.518 1.00 0.02 H HETATM 1865 C27 UNN A 2 -7.621 -14.766 1.172 1.00 -0.06 C HETATM 1866 H28 UNN A 2 -8.285 -14.180 0.519 1.00 0.02 H HETATM 1867 H29 UNN A 2 -7.956 -15.814 1.190 1.00 0.02 H HETATM 1868 H30 UNN A 2 -6.591 -14.717 0.788 1.00 0.02 H HETATM 1869 H20 UNN A 2 -8.023 -12.108 3.064 1.00 0.08 H HETATM 1870 O21 UNN A 2 -4.856 -12.627 2.748 1.00 -0.39 O HETATM 1871 C18 UNN A 2 -7.232 -12.052 5.430 1.00 0.04 C HETATM 1872 C19 UNN A 2 -6.960 -11.218 6.670 1.00 -0.03 C HETATM 1873 C16 UNN A 2 -5.486 -11.479 6.967 1.00 -0.01 C HETATM 1874 H14 UNN A 2 -5.000 -10.570 7.350 1.00 0.03 H HETATM 1875 H15 UNN A 2 -5.375 -12.291 7.700 1.00 0.03 H HETATM 1876 H18 UNN A 2 -7.137 -10.151 6.471 1.00 0.03 H HETATM 1877 H19 UNN A 2 -7.593 -11.544 7.508 1.00 0.03 H HETATM 1878 H16 UNN A 2 -7.590 -13.049 5.729 1.00 0.05 H HETATM 1879 H17 UNN A 2 -7.998 -11.557 4.815 1.00 0.05 H HETATM 1880 H13 UNN A 2 -4.303 -11.043 5.211 1.00 0.08 H HETATM 1881 O14 UNN A 2 -4.414 -14.216 5.830 1.00 -0.39 O HETATM 1882 H3 UNN A 2 -2.318 -11.908 5.800 1.00 0.19 H HETATM 1883 C6 UNN A 2 -1.835 -14.430 7.611 1.00 -0.02 C HETATM 1884 C11 UNN A 2 -0.627 -15.238 8.097 1.00 -0.04 C HETATM 1885 C7 UNN A 2 0.668 -14.435 7.997 1.00 -0.02 C HETATM 1886 C3 UNN A 2 0.814 -13.650 6.726 1.00 -0.04 C HETATM 1887 C8 UNN A 2 2.088 -13.144 6.410 1.00 -0.07 C HETATM 1888 C12 UNN A 2 2.282 -12.408 5.229 1.00 -0.08 C HETATM 1889 C9 UNN A 2 1.205 -12.174 4.363 1.00 -0.08 C HETATM 1890 C4 UNN A 2 -0.071 -12.676 4.672 1.00 -0.06 C HETATM 1891 H2 UNN A 2 -0.901 -12.495 3.999 1.00 0.05 H HETATM 1892 H9 UNN A 2 1.357 -11.605 3.453 1.00 0.05 H HETATM 1893 H12 UNN A 2 3.265 -12.021 4.987 1.00 0.05 H HETATM 1894 H8 UNN A 2 2.922 -13.322 7.079 1.00 0.05 H HETATM 1895 H6 UNN A 2 0.703 -13.732 8.842 1.00 0.04 H HETATM 1896 H7 UNN A 2 1.513 -15.135 8.068 1.00 0.04 H HETATM 1897 H10 UNN A 2 -0.533 -16.144 7.480 1.00 0.03 H HETATM 1898 H11 UNN A 2 -0.789 -15.524 9.147 1.00 0.03 H HETATM 1899 H4 UNN A 2 -2.730 -15.066 7.669 1.00 0.03 H HETATM 1900 H5 UNN A 2 -1.962 -13.557 8.269 1.00 0.03 H HETATM 1901 H1 UNN A 2 -1.881 -14.770 5.467 1.00 0.07 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 932 931 936 1830 CONECT 979 978 983 1830 CONECT 1225 1224 1227 1830 CONECT 1338 1337 1342 1830 CONECT 1830 932 979 1225 1338 CONECT 1831 1832 1886 1890 CONECT 1832 1831 1833 1883 1901 CONECT 1833 1832 1834 1882 CONECT 1834 1833 1835 1881 CONECT 1835 1834 1836 1873 1880 CONECT 1836 1835 1837 1871 CONECT 1837 1836 1838 1870 CONECT 1838 1837 1839 1856 1869 CONECT 1839 1838 1840 1855 CONECT 1840 1839 1841 1854 CONECT 1841 1840 1842 1849 1853 CONECT 1842 1841 1843 1847 1848 CONECT 1843 1842 1844 1845 1846 CONECT 1844 1843 CONECT 1845 1843 CONECT 1846 1843 CONECT 1847 1842 CONECT 1848 1842 CONECT 1849 1841 1850 1851 1852 CONECT 1850 1849 CONECT 1851 1849 CONECT 1852 1849 CONECT 1853 1841 CONECT 1854 1840 CONECT 1855 1839 CONECT 1856 1838 1857 1861 1865 CONECT 1857 1856 1858 1859 1860 CONECT 1858 1857 CONECT 1859 1857 CONECT 1860 1857 CONECT 1861 1856 1862 1863 1864 CONECT 1862 1861 CONECT 1863 1861 CONECT 1864 1861 CONECT 1865 1856 1866 1867 1868 CONECT 1866 1865 CONECT 1867 1865 CONECT 1868 1865 CONECT 1869 1838 CONECT 1870 1837 CONECT 1871 1836 1872 1878 1879 CONECT 1872 1871 1873 1876 1877 CONECT 1873 1835 1872 1874 1875 CONECT 1874 1873 CONECT 1875 1873 CONECT 1876 1872 CONECT 1877 1872 CONECT 1878 1871 CONECT 1879 1871 CONECT 1880 1835 CONECT 1881 1834 CONECT 1882 1833 CONECT 1883 1832 1884 1899 1900 CONECT 1884 1883 1885 1897 1898 CONECT 1885 1884 1886 1895 1896 CONECT 1886 1831 1885 1887 CONECT 1887 1886 1888 1894 CONECT 1888 1887 1889 1893 CONECT 1889 1888 1890 1892 CONECT 1890 1831 1889 1891 CONECT 1891 1890 CONECT 1892 1889 CONECT 1893 1888 CONECT 1894 1887 CONECT 1895 1885 CONECT 1896 1885 CONECT 1897 1884 CONECT 1898 1884 CONECT 1899 1883 CONECT 1900 1883 CONECT 1901 1832 MASTER 0 0 0 0 0 0 0 0 1900 1 80 9 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1tfq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
baculoviral iap repeat-containing protein 4
Ligand Name
998
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=0.012uM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
J.Med.Chem. v47 pp. 4417-26, 2004
Ligand Properties
Formula
C
2
5
H
3
9
N
4
O
3
Molecular Weight
443.602
Exact Mass
443.302
No. of atoms
71
No. of bonds
73
Polar Surface Area
95.12
LOGP Value
2.98 (
Computed with XLOGP3
)
2.00 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
Canonical SMILES
C[NH2+][C@H](C(=O)N[C@@H](C(C)(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCCc2c1cccc2)C
InChI String
InChI=1S/C25H38N4O3/c1-16(26-5)22(30)28-21(25(2,3)4)24(32)29-15-9-14-20(29)23(31)27-19-13-8-11-17-10-6-7-12-18(17)19/h6-7,10,12,16,19-21,26H,8-9,11,13-15H2,1-5H3,(H,27,31)(H,28,30)/p+1/t16-,19+,20-,21+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P98170
Entrez Gene ID
NCBI Entrez Gene ID:
331
ASD
Information of known allosteric effects of PDB entries
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