Browse entries in the PDBbind-CN Database
HEADER 1S5Q_COMPLEX COMPND 1S5Q_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 89 SER LEU GLN ASN ASN GLN PRO VAL GLU PHE ASN HIS ALA SEQRES 2 B 89 ILE ASN TYR VAL ASN LYS ILE LYS ASN ARG PHE GLN GLY SEQRES 3 B 89 GLN PRO ASP ILE TYR LYS ALA PHE LEU GLU ILE LEU HIS SEQRES 4 B 89 THR TYR GLN LYS GLU GLN ARG ASN ALA LYS GLU ALA GLY SEQRES 5 B 89 GLY ASN TYR THR PRO ALA LEU THR GLU GLN GLU VAL TYR SEQRES 6 B 89 ALA GLN VAL ALA ARG LEU PHE LYS ASN GLN GLU ASP LEU SEQRES 7 B 89 LEU SER GLU PHE GLY GLN PHE LEU PRO ASP ALA HET ARG A 90 275 ATOM 1 N SER B 295 -9.865 13.954 -3.681 1.00 0.00 N ATOM 2 CA SER B 295 -10.132 15.167 -2.865 1.00 0.00 C ATOM 3 C SER B 295 -9.633 14.981 -1.436 1.00 0.00 C ATOM 4 O SER B 295 -9.345 15.953 -0.738 1.00 0.00 O ATOM 5 CB SER B 295 -11.631 15.472 -2.856 1.00 0.00 C ATOM 6 OG SER B 295 -11.914 16.619 -2.073 1.00 0.00 O ATOM 7 HA SER B 295 -9.596 16.004 -3.311 1.00 0.00 H ATOM 8 HB2 SER B 295 -12.166 14.617 -2.442 1.00 0.00 H ATOM 9 HB3 SER B 295 -11.965 15.648 -3.879 1.00 0.00 H ATOM 10 HG SER B 295 -11.617 16.463 -1.142 1.00 0.00 H ATOM 11 HN3 SER B 295 -10.354 13.139 -3.259 1.00 0.00 H ATOM 12 HN2 SER B 295 -8.841 13.772 -3.704 1.00 0.00 H ATOM 13 HN1 SER B 295 -10.214 14.105 -4.649 1.00 0.00 H ATOM 14 N LEU B 296 -9.535 13.723 -1.011 1.00 0.00 N ATOM 15 CA LEU B 296 -9.073 13.394 0.336 1.00 0.00 C ATOM 16 C LEU B 296 -9.913 14.106 1.392 1.00 0.00 C ATOM 17 O LEU B 296 -10.953 14.690 1.085 1.00 0.00 O ATOM 18 CB LEU B 296 -7.595 13.762 0.506 1.00 0.00 C ATOM 19 CG LEU B 296 -6.618 12.973 -0.371 1.00 0.00 C ATOM 20 CD1 LEU B 296 -6.658 13.473 -1.807 1.00 0.00 C ATOM 21 CD2 LEU B 296 -5.206 13.068 0.187 1.00 0.00 C ATOM 22 HA LEU B 296 -9.186 12.319 0.473 1.00 0.00 H ATOM 23 HB2 LEU B 296 -7.482 14.820 0.269 1.00 0.00 H ATOM 24 HB3 LEU B 296 -7.324 13.594 1.548 1.00 0.00 H ATOM 25 HG LEU B 296 -6.923 11.927 -0.366 1.00 0.00 H ATOM 26 HD21 LEU B 296 -4.896 14.113 0.212 1.00 0.00 H ATOM 27 HD22 LEU B 296 -5.187 12.658 1.197 1.00 0.00 H ATOM 28 HD23 LEU B 296 -4.526 12.501 -0.449 1.00 0.00 H ATOM 29 HD11 LEU B 296 -7.666 13.352 -2.205 1.00 0.00 H ATOM 30 HD12 LEU B 296 -6.381 14.527 -1.831 1.00 0.00 H ATOM 31 HD13 LEU B 296 -5.956 12.898 -2.410 1.00 0.00 H ATOM 32 H LEU B 296 -9.795 12.951 -1.657 1.00 0.00 H ATOM 33 N GLN B 297 -9.459 14.048 2.640 1.00 0.00 N ATOM 34 CA GLN B 297 -10.167 14.688 3.743 1.00 0.00 C ATOM 35 C GLN B 297 -9.182 15.270 4.752 1.00 0.00 C ATOM 36 O GLN B 297 -9.512 16.194 5.495 1.00 0.00 O ATOM 37 CB GLN B 297 -11.093 13.683 4.433 1.00 0.00 C ATOM 38 CG GLN B 297 -11.950 14.294 5.530 1.00 0.00 C ATOM 39 CD GLN B 297 -12.862 15.392 5.017 1.00 0.00 C ATOM 40 OE1 GLN B 297 -12.487 16.564 4.990 1.00 0.00 O ATOM 41 NE2 GLN B 297 -14.069 15.016 4.607 1.00 0.00 N ATOM 42 HA GLN B 297 -10.767 15.502 3.337 1.00 0.00 H ATOM 43 HB2 GLN B 297 -11.753 13.250 3.681 1.00 0.00 H ATOM 44 HB3 GLN B 297 -10.480 12.896 4.873 1.00 0.00 H ATOM 45 HG2 GLN B 297 -12.563 13.509 5.972 1.00 0.00 H ATOM 46 HG3 GLN B 297 -11.294 14.713 6.293 1.00 0.00 H ATOM 47 HE22 GLN B 297 -14.343 14.014 4.648 1.00 0.00 H ATOM 48 HE21 GLN B 297 -14.739 15.724 4.245 1.00 0.00 H ATOM 49 H GLN B 297 -8.577 13.533 2.835 1.00 0.00 H ATOM 50 N ASN B 298 -7.970 14.724 4.768 1.00 0.00 N ATOM 51 CA ASN B 298 -6.933 15.186 5.685 1.00 0.00 C ATOM 52 C ASN B 298 -6.367 16.531 5.238 1.00 0.00 C ATOM 53 O ASN B 298 -6.631 16.989 4.126 1.00 0.00 O ATOM 54 CB ASN B 298 -5.808 14.153 5.775 1.00 0.00 C ATOM 55 CG ASN B 298 -6.301 12.797 6.240 1.00 0.00 C ATOM 56 OD1 ASN B 298 -6.316 12.505 7.437 1.00 0.00 O ATOM 57 ND2 ASN B 298 -6.709 11.958 5.294 1.00 0.00 N ATOM 58 HA ASN B 298 -7.384 15.312 6.669 1.00 0.00 H ATOM 59 HB2 ASN B 298 -5.356 14.042 4.790 1.00 0.00 H ATOM 60 HB3 ASN B 298 -5.058 14.513 6.479 1.00 0.00 H ATOM 61 HD22 ASN B 298 -6.679 12.246 4.295 1.00 0.00 H ATOM 62 HD21 ASN B 298 -7.058 11.013 5.552 1.00 0.00 H ATOM 63 H ASN B 298 -7.755 13.948 4.110 1.00 0.00 H ATOM 64 N ASN B 299 -5.585 17.157 6.113 1.00 0.00 N ATOM 65 CA ASN B 299 -4.978 18.448 5.810 1.00 0.00 C ATOM 66 C ASN B 299 -3.562 18.528 6.374 1.00 0.00 C ATOM 67 O ASN B 299 -2.961 19.601 6.417 1.00 0.00 O ATOM 68 CB ASN B 299 -5.831 19.585 6.377 1.00 0.00 C ATOM 69 CG ASN B 299 -7.216 19.632 5.762 1.00 0.00 C ATOM 70 OD1 ASN B 299 -8.156 19.022 6.273 1.00 0.00 O ATOM 71 ND2 ASN B 299 -7.349 20.357 4.658 1.00 0.00 N ATOM 72 HA ASN B 299 -4.926 18.551 4.726 1.00 0.00 H ATOM 73 HB2 ASN B 299 -5.930 19.445 7.453 1.00 0.00 H ATOM 74 HB3 ASN B 299 -5.328 20.532 6.180 1.00 0.00 H ATOM 75 HD22 ASN B 299 -6.527 20.856 4.261 1.00 0.00 H ATOM 76 HD21 ASN B 299 -8.275 20.426 4.190 1.00 0.00 H ATOM 77 H ASN B 299 -5.402 16.715 7.036 1.00 0.00 H ATOM 78 N GLN B 300 -3.034 17.384 6.804 1.00 0.00 N ATOM 79 CA GLN B 300 -1.692 17.322 7.362 1.00 0.00 C ATOM 80 C GLN B 300 -0.686 16.858 6.304 1.00 0.00 C ATOM 81 O GLN B 300 -0.747 15.716 5.848 1.00 0.00 O ATOM 82 CB GLN B 300 -1.672 16.375 8.565 1.00 0.00 C ATOM 83 CG GLN B 300 -0.276 15.990 9.010 1.00 0.00 C ATOM 84 CD GLN B 300 -0.263 15.266 10.342 1.00 0.00 C ATOM 85 OE1 GLN B 300 -0.179 15.890 11.400 1.00 0.00 O ATOM 86 NE2 GLN B 300 -0.341 13.941 10.296 1.00 0.00 N ATOM 87 HA GLN B 300 -1.405 18.321 7.690 1.00 0.00 H ATOM 88 HB2 GLN B 300 -2.177 16.865 9.398 1.00 0.00 H ATOM 89 HB3 GLN B 300 -2.212 15.466 8.298 1.00 0.00 H ATOM 90 HG2 GLN B 300 0.163 15.338 8.255 1.00 0.00 H ATOM 91 HG3 GLN B 300 0.324 16.896 9.100 1.00 0.00 H ATOM 92 HE22 GLN B 300 -0.411 13.456 9.379 1.00 0.00 H ATOM 93 HE21 GLN B 300 -0.332 13.389 11.177 1.00 0.00 H ATOM 94 H GLN B 300 -3.596 16.511 6.739 1.00 0.00 H ATOM 95 N PRO B 301 0.252 17.738 5.895 1.00 0.00 N ATOM 96 CA PRO B 301 1.263 17.405 4.886 1.00 0.00 C ATOM 97 C PRO B 301 2.327 16.445 5.412 1.00 0.00 C ATOM 98 O PRO B 301 3.258 16.084 4.692 1.00 0.00 O ATOM 99 CB PRO B 301 1.902 18.760 4.536 1.00 0.00 C ATOM 100 CG PRO B 301 1.050 19.796 5.196 1.00 0.00 C ATOM 101 CD PRO B 301 0.403 19.120 6.368 1.00 0.00 C ATOM 102 HA PRO B 301 0.814 16.897 4.032 1.00 0.00 H ATOM 103 HD3 PRO B 301 1.040 19.167 7.251 1.00 0.00 H ATOM 104 HD2 PRO B 301 -0.565 19.567 6.596 1.00 0.00 H ATOM 105 HG3 PRO B 301 0.291 20.160 4.503 1.00 0.00 H ATOM 106 HG2 PRO B 301 1.663 20.632 5.533 1.00 0.00 H ATOM 107 HB2 PRO B 301 2.922 18.808 4.917 1.00 0.00 H ATOM 108 HB3 PRO B 301 1.911 18.908 3.456 1.00 0.00 H ATOM 109 N VAL B 302 2.187 16.036 6.669 1.00 0.00 N ATOM 110 CA VAL B 302 3.143 15.119 7.282 1.00 0.00 C ATOM 111 C VAL B 302 2.940 13.693 6.776 1.00 0.00 C ATOM 112 O VAL B 302 3.907 12.981 6.504 1.00 0.00 O ATOM 113 CB VAL B 302 3.034 15.130 8.820 1.00 0.00 C ATOM 114 CG1 VAL B 302 4.078 14.214 9.441 1.00 0.00 C ATOM 115 CG2 VAL B 302 3.174 16.547 9.355 1.00 0.00 C ATOM 116 HA VAL B 302 4.137 15.465 6.997 1.00 0.00 H ATOM 117 HB VAL B 302 2.048 14.756 9.096 1.00 0.00 H ATOM 118 HG11 VAL B 302 3.924 13.196 9.084 1.00 0.00 H ATOM 119 HG12 VAL B 302 5.074 14.554 9.156 1.00 0.00 H ATOM 120 HG13 VAL B 302 3.981 14.238 10.526 1.00 0.00 H ATOM 121 HG21 VAL B 302 4.145 16.949 9.066 1.00 0.00 H ATOM 122 HG22 VAL B 302 2.383 17.171 8.939 1.00 0.00 H ATOM 123 HG23 VAL B 302 3.094 16.533 10.442 1.00 0.00 H ATOM 124 H VAL B 302 1.379 16.377 7.228 1.00 0.00 H ATOM 125 N GLU B 303 1.681 13.283 6.654 1.00 0.00 N ATOM 126 CA GLU B 303 1.358 11.941 6.182 1.00 0.00 C ATOM 127 C GLU B 303 1.896 11.716 4.773 1.00 0.00 C ATOM 128 O GLU B 303 2.421 10.647 4.463 1.00 0.00 O ATOM 129 CB GLU B 303 -0.155 11.713 6.205 1.00 0.00 C ATOM 130 CG GLU B 303 -0.763 11.795 7.596 1.00 0.00 C ATOM 131 CD GLU B 303 -2.247 11.484 7.603 1.00 0.00 C ATOM 132 OE1 GLU B 303 -3.052 12.423 7.425 1.00 0.00 O ATOM 133 OE2 GLU B 303 -2.605 10.301 7.787 1.00 0.00 O ATOM 134 HA GLU B 303 1.833 11.226 6.853 1.00 0.00 H ATOM 135 HB2 GLU B 303 -0.627 12.469 5.577 1.00 0.00 H ATOM 136 HB3 GLU B 303 -0.361 10.724 5.797 1.00 0.00 H ATOM 137 HG2 GLU B 303 -0.253 11.081 8.243 1.00 0.00 H ATOM 138 HG3 GLU B 303 -0.615 12.803 7.983 1.00 0.00 H ATOM 139 H GLU B 303 0.909 13.934 6.901 1.00 0.00 H ATOM 140 N PHE B 304 1.760 12.730 3.925 1.00 0.00 N ATOM 141 CA PHE B 304 2.238 12.650 2.549 1.00 0.00 C ATOM 142 C PHE B 304 3.744 12.408 2.518 1.00 0.00 C ATOM 143 O PHE B 304 4.234 11.555 1.775 1.00 0.00 O ATOM 144 CB PHE B 304 1.895 13.940 1.798 1.00 0.00 C ATOM 145 CG PHE B 304 2.266 13.913 0.343 1.00 0.00 C ATOM 146 CD1 PHE B 304 1.526 13.169 -0.561 1.00 0.00 C ATOM 147 CD2 PHE B 304 3.356 14.632 -0.120 1.00 0.00 C ATOM 148 CE1 PHE B 304 1.866 13.143 -1.901 1.00 0.00 C ATOM 149 CE2 PHE B 304 3.701 14.611 -1.457 1.00 0.00 C ATOM 150 CZ PHE B 304 2.955 13.865 -2.349 1.00 0.00 C ATOM 151 HA PHE B 304 1.744 11.812 2.058 1.00 0.00 H ATOM 152 HB2 PHE B 304 0.821 14.108 1.876 1.00 0.00 H ATOM 153 HB3 PHE B 304 2.426 14.765 2.273 1.00 0.00 H ATOM 154 HD2 PHE B 304 3.949 15.221 0.580 1.00 0.00 H ATOM 155 HE2 PHE B 304 4.561 15.182 -1.808 1.00 0.00 H ATOM 156 HZ PHE B 304 3.225 13.846 -3.405 1.00 0.00 H ATOM 157 HE1 PHE B 304 1.276 12.554 -2.603 1.00 0.00 H ATOM 158 HD1 PHE B 304 0.666 12.598 -0.212 1.00 0.00 H ATOM 159 H PHE B 304 1.300 13.604 4.251 1.00 0.00 H ATOM 160 N ASN B 305 4.472 13.165 3.335 1.00 0.00 N ATOM 161 CA ASN B 305 5.922 13.037 3.412 1.00 0.00 C ATOM 162 C ASN B 305 6.317 11.631 3.854 1.00 0.00 C ATOM 163 O ASN B 305 7.256 11.041 3.317 1.00 0.00 O ATOM 164 CB ASN B 305 6.494 14.074 4.381 1.00 0.00 C ATOM 165 CG ASN B 305 8.003 13.984 4.515 1.00 0.00 C ATOM 166 OD1 ASN B 305 8.563 14.299 5.565 1.00 0.00 O ATOM 167 ND2 ASN B 305 8.671 13.556 3.450 1.00 0.00 N ATOM 168 HA ASN B 305 6.335 13.215 2.419 1.00 0.00 H ATOM 169 HB2 ASN B 305 6.235 15.069 4.019 1.00 0.00 H ATOM 170 HB3 ASN B 305 6.047 13.918 5.363 1.00 0.00 H ATOM 171 HD22 ASN B 305 8.158 13.300 2.582 1.00 0.00 H ATOM 172 HD21 ASN B 305 9.707 13.477 3.484 1.00 0.00 H ATOM 173 H ASN B 305 3.994 13.867 3.935 1.00 0.00 H ATOM 174 N HIS B 306 5.593 11.099 4.835 1.00 0.00 N ATOM 175 CA HIS B 306 5.865 9.761 5.345 1.00 0.00 C ATOM 176 C HIS B 306 5.612 8.715 4.264 1.00 0.00 C ATOM 177 O HIS B 306 6.326 7.717 4.171 1.00 0.00 O ATOM 178 CB HIS B 306 4.995 9.468 6.569 1.00 0.00 C ATOM 179 CG HIS B 306 5.344 8.184 7.256 1.00 0.00 C ATOM 180 ND1 HIS B 306 4.763 6.975 6.932 1.00 0.00 N ATOM 181 CD2 HIS B 306 6.221 7.922 8.254 1.00 0.00 C ATOM 182 CE1 HIS B 306 5.268 6.026 7.701 1.00 0.00 C ATOM 183 NE2 HIS B 306 6.155 6.574 8.510 1.00 0.00 N ATOM 184 HA HIS B 306 6.913 9.715 5.639 1.00 0.00 H ATOM 185 HB2 HIS B 306 5.115 10.284 7.281 1.00 0.00 H ATOM 186 HB3 HIS B 306 3.954 9.417 6.249 1.00 0.00 H ATOM 187 HD2 HIS B 306 6.860 8.646 8.760 1.00 0.00 H ATOM 188 HE1 HIS B 306 4.998 4.970 7.672 1.00 0.00 H ATOM 189 H HIS B 306 4.814 11.651 5.248 1.00 0.00 H ATOM 190 N ALA B 307 4.588 8.955 3.449 1.00 0.00 N ATOM 191 CA ALA B 307 4.236 8.040 2.369 1.00 0.00 C ATOM 192 C ALA B 307 5.373 7.925 1.360 1.00 0.00 C ATOM 193 O ALA B 307 5.808 6.823 1.024 1.00 0.00 O ATOM 194 CB ALA B 307 2.963 8.506 1.679 1.00 0.00 C ATOM 195 HA ALA B 307 4.063 7.054 2.800 1.00 0.00 H ATOM 196 HB1 ALA B 307 2.148 8.534 2.403 1.00 0.00 H ATOM 197 HB2 ALA B 307 3.119 9.503 1.266 1.00 0.00 H ATOM 198 HB3 ALA B 307 2.713 7.814 0.875 1.00 0.00 H ATOM 199 H ALA B 307 4.024 9.818 3.586 1.00 0.00 H ATOM 200 N ILE B 308 5.851 9.070 0.883 1.00 0.00 N ATOM 201 CA ILE B 308 6.940 9.099 -0.088 1.00 0.00 C ATOM 202 C ILE B 308 8.214 8.483 0.487 1.00 0.00 C ATOM 203 O ILE B 308 8.952 7.798 -0.219 1.00 0.00 O ATOM 204 CB ILE B 308 7.233 10.541 -0.560 1.00 0.00 C ATOM 205 CG1 ILE B 308 6.086 11.050 -1.438 1.00 0.00 C ATOM 206 CG2 ILE B 308 8.558 10.606 -1.311 1.00 0.00 C ATOM 207 CD1 ILE B 308 6.284 12.463 -1.944 1.00 0.00 C ATOM 208 HA ILE B 308 6.618 8.506 -0.944 1.00 0.00 H ATOM 209 HB ILE B 308 7.313 11.184 0.316 1.00 0.00 H ATOM 210 HG12 ILE B 308 5.991 10.387 -2.298 1.00 0.00 H ATOM 211 HG13 ILE B 308 5.166 11.020 -0.854 1.00 0.00 H ATOM 212 HD11 ILE B 308 6.369 13.143 -1.096 1.00 0.00 H ATOM 213 HD12 ILE B 308 7.195 12.509 -2.541 1.00 0.00 H ATOM 214 HD13 ILE B 308 5.430 12.751 -2.558 1.00 0.00 H ATOM 215 HG21 ILE B 308 9.364 10.281 -0.653 1.00 0.00 H ATOM 216 HG22 ILE B 308 8.513 9.953 -2.182 1.00 0.00 H ATOM 217 HG23 ILE B 308 8.742 11.631 -1.633 1.00 0.00 H ATOM 218 H ILE B 308 5.439 9.967 1.210 1.00 0.00 H ATOM 219 N ASN B 309 8.464 8.728 1.770 1.00 0.00 N ATOM 220 CA ASN B 309 9.655 8.199 2.429 1.00 0.00 C ATOM 221 C ASN B 309 9.640 6.672 2.466 1.00 0.00 C ATOM 222 O ASN B 309 10.651 6.024 2.193 1.00 0.00 O ATOM 223 CB ASN B 309 9.761 8.752 3.851 1.00 0.00 C ATOM 224 CG ASN B 309 11.074 8.390 4.516 1.00 0.00 C ATOM 225 OD1 ASN B 309 11.197 7.337 5.143 1.00 0.00 O ATOM 226 ND2 ASN B 309 12.065 9.265 4.385 1.00 0.00 N ATOM 227 HA ASN B 309 10.523 8.516 1.852 1.00 0.00 H ATOM 228 HB2 ASN B 309 9.676 9.838 3.812 1.00 0.00 H ATOM 229 HB3 ASN B 309 8.943 8.346 4.446 1.00 0.00 H ATOM 230 HD22 ASN B 309 11.916 10.142 3.846 1.00 0.00 H ATOM 231 HD21 ASN B 309 12.989 9.073 4.821 1.00 0.00 H ATOM 232 H ASN B 309 7.797 9.309 2.316 1.00 0.00 H ATOM 233 N TYR B 310 8.486 6.103 2.804 1.00 0.00 N ATOM 234 CA TYR B 310 8.340 4.652 2.887 1.00 0.00 C ATOM 235 C TYR B 310 8.475 4.001 1.513 1.00 0.00 C ATOM 236 O TYR B 310 9.309 3.115 1.315 1.00 0.00 O ATOM 237 CB TYR B 310 6.985 4.298 3.504 1.00 0.00 C ATOM 238 CG TYR B 310 6.745 2.811 3.643 1.00 0.00 C ATOM 239 CD1 TYR B 310 7.546 2.030 4.468 1.00 0.00 C ATOM 240 CD2 TYR B 310 5.716 2.189 2.948 1.00 0.00 C ATOM 241 CE1 TYR B 310 7.327 0.671 4.596 1.00 0.00 C ATOM 242 CE2 TYR B 310 5.490 0.832 3.072 1.00 0.00 C ATOM 243 CZ TYR B 310 6.297 0.078 3.896 1.00 0.00 C ATOM 244 OH TYR B 310 6.075 -1.273 4.019 1.00 0.00 O ATOM 245 HA TYR B 310 9.139 4.268 3.521 1.00 0.00 H ATOM 246 HB3 TYR B 310 6.200 4.715 2.873 1.00 0.00 H ATOM 247 HB2 TYR B 310 6.930 4.749 4.495 1.00 0.00 H ATOM 248 HD2 TYR B 310 5.076 2.781 2.294 1.00 0.00 H ATOM 249 HE2 TYR B 310 4.677 0.360 2.521 1.00 0.00 H ATOM 250 HE1 TYR B 310 7.964 0.072 5.246 1.00 0.00 H ATOM 251 HD1 TYR B 310 8.360 2.497 5.023 1.00 0.00 H ATOM 252 HH TYR B 310 6.738 -1.660 4.644 1.00 0.00 H ATOM 253 H TYR B 310 7.666 6.707 3.015 1.00 0.00 H ATOM 254 N VAL B 311 7.650 4.443 0.568 1.00 0.00 N ATOM 255 CA VAL B 311 7.679 3.903 -0.787 1.00 0.00 C ATOM 256 C VAL B 311 9.076 4.016 -1.388 1.00 0.00 C ATOM 257 O VAL B 311 9.535 3.116 -2.093 1.00 0.00 O ATOM 258 CB VAL B 311 6.668 4.623 -1.701 1.00 0.00 C ATOM 259 CG1 VAL B 311 6.707 4.045 -3.109 1.00 0.00 C ATOM 260 CG2 VAL B 311 5.266 4.528 -1.119 1.00 0.00 C ATOM 261 HA VAL B 311 7.402 2.851 -0.720 1.00 0.00 H ATOM 262 HB VAL B 311 6.946 5.675 -1.760 1.00 0.00 H ATOM 263 HG11 VAL B 311 7.707 4.169 -3.524 1.00 0.00 H ATOM 264 HG12 VAL B 311 6.456 2.985 -3.072 1.00 0.00 H ATOM 265 HG13 VAL B 311 5.985 4.569 -3.736 1.00 0.00 H ATOM 266 HG21 VAL B 311 4.981 3.480 -1.030 1.00 0.00 H ATOM 267 HG22 VAL B 311 5.250 4.995 -0.134 1.00 0.00 H ATOM 268 HG23 VAL B 311 4.565 5.042 -1.777 1.00 0.00 H ATOM 269 H VAL B 311 6.967 5.192 0.801 1.00 0.00 H ATOM 270 N ASN B 312 9.748 5.127 -1.103 1.00 0.00 N ATOM 271 CA ASN B 312 11.099 5.353 -1.606 1.00 0.00 C ATOM 272 C ASN B 312 12.075 4.395 -0.934 1.00 0.00 C ATOM 273 O ASN B 312 13.027 3.923 -1.556 1.00 0.00 O ATOM 274 CB ASN B 312 11.527 6.801 -1.350 1.00 0.00 C ATOM 275 CG ASN B 312 12.799 7.176 -2.089 1.00 0.00 C ATOM 276 OD1 ASN B 312 13.661 6.334 -2.338 1.00 0.00 O ATOM 277 ND2 ASN B 312 12.922 8.450 -2.443 1.00 0.00 N ATOM 278 HA ASN B 312 11.106 5.170 -2.681 1.00 0.00 H ATOM 279 HB2 ASN B 312 10.726 7.464 -1.676 1.00 0.00 H ATOM 280 HB3 ASN B 312 11.693 6.932 -0.281 1.00 0.00 H ATOM 281 HD22 ASN B 312 12.169 9.129 -2.212 1.00 0.00 H ATOM 282 HD21 ASN B 312 13.772 8.769 -2.951 1.00 0.00 H ATOM 283 H ASN B 312 9.300 5.852 -0.507 1.00 0.00 H ATOM 284 N LYS B 313 11.827 4.112 0.341 1.00 0.00 N ATOM 285 CA LYS B 313 12.679 3.208 1.103 1.00 0.00 C ATOM 286 C LYS B 313 12.646 1.806 0.507 1.00 0.00 C ATOM 287 O LYS B 313 13.667 1.123 0.445 1.00 0.00 O ATOM 288 CB LYS B 313 12.237 3.163 2.567 1.00 0.00 C ATOM 289 CG LYS B 313 13.150 2.329 3.450 1.00 0.00 C ATOM 290 CD LYS B 313 12.703 2.362 4.901 1.00 0.00 C ATOM 291 CE LYS B 313 13.604 1.511 5.780 1.00 0.00 C ATOM 292 NZ LYS B 313 13.606 0.083 5.358 1.00 0.00 N ATOM 293 HA LYS B 313 13.701 3.584 1.054 1.00 0.00 H ATOM 294 HB2 LYS B 313 12.219 4.182 2.954 1.00 0.00 H ATOM 295 HB3 LYS B 313 11.233 2.741 2.612 1.00 0.00 H ATOM 296 HG2 LYS B 313 13.137 1.297 3.099 1.00 0.00 H ATOM 297 HG3 LYS B 313 14.164 2.722 3.383 1.00 0.00 H ATOM 298 HD2 LYS B 313 12.730 3.392 5.257 1.00 0.00 H ATOM 299 HD3 LYS B 313 11.683 1.983 4.967 1.00 0.00 H ATOM 300 HE2 LYS B 313 13.253 1.574 6.810 1.00 0.00 H ATOM 301 HE3 LYS B 313 14.621 1.897 5.720 1.00 0.00 H ATOM 302 HZ1 LYS B 313 12.640 -0.296 5.418 1.00 0.00 H ATOM 303 HZ2 LYS B 313 13.947 0.013 4.378 1.00 0.00 H ATOM 304 HZ3 LYS B 313 14.233 -0.461 5.984 1.00 0.00 H ATOM 305 H LYS B 313 11.005 4.547 0.806 1.00 0.00 H ATOM 306 N ILE B 314 11.463 1.382 0.073 1.00 0.00 N ATOM 307 CA ILE B 314 11.296 0.062 -0.525 1.00 0.00 C ATOM 308 C ILE B 314 11.947 0.003 -1.902 1.00 0.00 C ATOM 309 O ILE B 314 12.658 -0.948 -2.225 1.00 0.00 O ATOM 310 CB ILE B 314 9.807 -0.312 -0.666 1.00 0.00 C ATOM 311 CG1 ILE B 314 9.118 -0.289 0.701 1.00 0.00 C ATOM 312 CG2 ILE B 314 9.666 -1.681 -1.318 1.00 0.00 C ATOM 313 CD1 ILE B 314 7.630 -0.561 0.635 1.00 0.00 C ATOM 314 HA ILE B 314 11.780 -0.650 0.143 1.00 0.00 H ATOM 315 HB ILE B 314 9.321 0.425 -1.305 1.00 0.00 H ATOM 316 HG12 ILE B 314 9.580 -1.048 1.333 1.00 0.00 H ATOM 317 HG13 ILE B 314 9.269 0.694 1.147 1.00 0.00 H ATOM 318 HD11 ILE B 314 7.151 0.197 0.016 1.00 0.00 H ATOM 319 HD12 ILE B 314 7.461 -1.547 0.201 1.00 0.00 H ATOM 320 HD13 ILE B 314 7.211 -0.528 1.641 1.00 0.00 H ATOM 321 HG21 ILE B 314 10.124 -1.660 -2.307 1.00 0.00 H ATOM 322 HG22 ILE B 314 10.165 -2.429 -0.701 1.00 0.00 H ATOM 323 HG23 ILE B 314 8.609 -1.931 -1.411 1.00 0.00 H ATOM 324 H ILE B 314 10.636 2.007 0.162 1.00 0.00 H ATOM 325 N LYS B 315 11.691 1.026 -2.711 1.00 0.00 N ATOM 326 CA LYS B 315 12.242 1.096 -4.058 1.00 0.00 C ATOM 327 C LYS B 315 13.768 1.127 -4.026 1.00 0.00 C ATOM 328 O LYS B 315 14.426 0.619 -4.933 1.00 0.00 O ATOM 329 CB LYS B 315 11.706 2.332 -4.783 1.00 0.00 C ATOM 330 CG LYS B 315 12.087 2.392 -6.252 1.00 0.00 C ATOM 331 CD LYS B 315 11.568 3.661 -6.907 1.00 0.00 C ATOM 332 CE LYS B 315 11.874 3.686 -8.395 1.00 0.00 C ATOM 333 NZ LYS B 315 13.337 3.598 -8.662 1.00 0.00 N ATOM 334 HA LYS B 315 11.931 0.202 -4.598 1.00 0.00 H ATOM 335 HB2 LYS B 315 10.619 2.330 -4.709 1.00 0.00 H ATOM 336 HB3 LYS B 315 12.101 3.219 -4.288 1.00 0.00 H ATOM 337 HG2 LYS B 315 13.173 2.366 -6.338 1.00 0.00 H ATOM 338 HG3 LYS B 315 11.663 1.529 -6.764 1.00 0.00 H ATOM 339 HD2 LYS B 315 10.489 3.716 -6.766 1.00 0.00 H ATOM 340 HD3 LYS B 315 12.039 4.522 -6.434 1.00 0.00 H ATOM 341 HE2 LYS B 315 11.493 4.616 -8.818 1.00 0.00 H ATOM 342 HE3 LYS B 315 11.377 2.841 -8.872 1.00 0.00 H ATOM 343 HZ1 LYS B 315 13.819 4.405 -8.216 1.00 0.00 H ATOM 344 HZ2 LYS B 315 13.707 2.710 -8.267 1.00 0.00 H ATOM 345 HZ3 LYS B 315 13.503 3.618 -9.689 1.00 0.00 H ATOM 346 H LYS B 315 11.081 1.798 -2.373 1.00 0.00 H ATOM 347 N ASN B 316 14.325 1.728 -2.979 1.00 0.00 N ATOM 348 CA ASN B 316 15.774 1.823 -2.835 1.00 0.00 C ATOM 349 C ASN B 316 16.355 0.532 -2.266 1.00 0.00 C ATOM 350 O ASN B 316 17.407 0.066 -2.706 1.00 0.00 O ATOM 351 CB ASN B 316 16.142 3.004 -1.934 1.00 0.00 C ATOM 352 CG ASN B 316 17.642 3.205 -1.829 1.00 0.00 C ATOM 353 OD1 ASN B 316 18.298 2.627 -0.962 1.00 0.00 O ATOM 354 ND2 ASN B 316 18.191 4.030 -2.712 1.00 0.00 N ATOM 355 HA ASN B 316 16.201 1.983 -3.825 1.00 0.00 H ATOM 356 HB2 ASN B 316 15.695 3.910 -2.343 1.00 0.00 H ATOM 357 HB3 ASN B 316 15.742 2.822 -0.937 1.00 0.00 H ATOM 358 HD22 ASN B 316 17.597 4.496 -3.427 1.00 0.00 H ATOM 359 HD21 ASN B 316 19.215 4.210 -2.689 1.00 0.00 H ATOM 360 H ASN B 316 13.714 2.140 -2.245 1.00 0.00 H ATOM 361 N ARG B 317 15.664 -0.042 -1.285 1.00 0.00 N ATOM 362 CA ARG B 317 16.111 -1.279 -0.652 1.00 0.00 C ATOM 363 C ARG B 317 16.047 -2.447 -1.631 1.00 0.00 C ATOM 364 O ARG B 317 16.830 -3.393 -1.536 1.00 0.00 O ATOM 365 CB ARG B 317 15.254 -1.582 0.580 1.00 0.00 C ATOM 366 CG ARG B 317 15.654 -2.856 1.308 1.00 0.00 C ATOM 367 CD ARG B 317 17.050 -2.751 1.901 1.00 0.00 C ATOM 368 NE ARG B 317 17.414 -3.950 2.648 1.00 0.00 N ATOM 369 CZ ARG B 317 18.651 -4.220 3.053 1.00 0.00 C ATOM 370 NH1 ARG B 317 19.642 -3.384 2.775 1.00 0.00 N ATOM 371 NH2 ARG B 317 18.899 -5.332 3.732 1.00 0.00 N ATOM 372 HA ARG B 317 17.148 -1.146 -0.343 1.00 0.00 H ATOM 373 HB2 ARG B 317 15.343 -0.747 1.275 1.00 0.00 H ATOM 374 HB3 ARG B 317 14.216 -1.679 0.261 1.00 0.00 H ATOM 375 HG2 ARG B 317 14.942 -3.042 2.112 1.00 0.00 H ATOM 376 HG3 ARG B 317 15.631 -3.688 0.604 1.00 0.00 H ATOM 377 HD2 ARG B 317 17.085 -1.893 2.572 1.00 0.00 H ATOM 378 HD3 ARG B 317 17.767 -2.608 1.093 1.00 0.00 H ATOM 379 HE ARG B 317 16.663 -4.632 2.877 1.00 0.00 H ATOM 380 HH12 ARG B 317 20.608 -3.599 3.094 1.00 0.00 H ATOM 381 HH11 ARG B 317 19.453 -2.513 2.238 1.00 0.00 H ATOM 382 HH22 ARG B 317 19.867 -5.543 4.049 1.00 0.00 H ATOM 383 HH21 ARG B 317 18.126 -5.993 3.948 1.00 0.00 H ATOM 384 H ARG B 317 14.782 0.402 -0.960 1.00 0.00 H ATOM 385 N PHE B 318 15.110 -2.374 -2.571 1.00 0.00 N ATOM 386 CA PHE B 318 14.940 -3.426 -3.568 1.00 0.00 C ATOM 387 C PHE B 318 15.240 -2.909 -4.970 1.00 0.00 C ATOM 388 O PHE B 318 14.752 -3.456 -5.960 1.00 0.00 O ATOM 389 CB PHE B 318 13.517 -3.986 -3.513 1.00 0.00 C ATOM 390 CG PHE B 318 13.213 -4.730 -2.245 1.00 0.00 C ATOM 391 CD1 PHE B 318 13.585 -6.057 -2.100 1.00 0.00 C ATOM 392 CD2 PHE B 318 12.555 -4.103 -1.199 1.00 0.00 C ATOM 393 CE1 PHE B 318 13.308 -6.745 -0.934 1.00 0.00 C ATOM 394 CE2 PHE B 318 12.275 -4.787 -0.031 1.00 0.00 C ATOM 395 CZ PHE B 318 12.652 -6.109 0.102 1.00 0.00 C ATOM 396 HA PHE B 318 15.648 -4.223 -3.338 1.00 0.00 H ATOM 397 HB2 PHE B 318 12.816 -3.156 -3.603 1.00 0.00 H ATOM 398 HB3 PHE B 318 13.381 -4.667 -4.353 1.00 0.00 H ATOM 399 HD2 PHE B 318 12.255 -3.060 -1.298 1.00 0.00 H ATOM 400 HE2 PHE B 318 11.757 -4.283 0.785 1.00 0.00 H ATOM 401 HZ PHE B 318 12.432 -6.649 1.023 1.00 0.00 H ATOM 402 HE1 PHE B 318 13.607 -7.788 -0.832 1.00 0.00 H ATOM 403 HD1 PHE B 318 14.102 -6.564 -2.915 1.00 0.00 H ATOM 404 H PHE B 318 14.482 -1.546 -2.597 1.00 0.00 H ATOM 405 N GLN B 319 16.048 -1.856 -5.049 1.00 0.00 N ATOM 406 CA GLN B 319 16.416 -1.269 -6.334 1.00 0.00 C ATOM 407 C GLN B 319 17.044 -2.318 -7.248 1.00 0.00 C ATOM 408 O GLN B 319 16.930 -2.239 -8.471 1.00 0.00 O ATOM 409 CB GLN B 319 17.387 -0.105 -6.127 1.00 0.00 C ATOM 410 CG GLN B 319 17.761 0.614 -7.414 1.00 0.00 C ATOM 411 CD GLN B 319 18.689 1.792 -7.179 1.00 0.00 C ATOM 412 OE1 GLN B 319 18.647 2.783 -7.908 1.00 0.00 O ATOM 413 NE2 GLN B 319 19.537 1.688 -6.162 1.00 0.00 N ATOM 414 HA GLN B 319 15.510 -0.894 -6.810 1.00 0.00 H ATOM 415 HB2 GLN B 319 16.923 0.615 -5.452 1.00 0.00 H ATOM 416 HB3 GLN B 319 18.298 -0.493 -5.672 1.00 0.00 H ATOM 417 HG2 GLN B 319 18.257 -0.094 -8.078 1.00 0.00 H ATOM 418 HG3 GLN B 319 16.849 0.977 -7.888 1.00 0.00 H ATOM 419 HE22 GLN B 319 19.538 0.832 -5.571 1.00 0.00 H ATOM 420 HE21 GLN B 319 20.200 2.463 -5.956 1.00 0.00 H ATOM 421 H GLN B 319 16.427 -1.440 -4.174 1.00 0.00 H ATOM 422 N GLY B 320 17.705 -3.301 -6.643 1.00 0.00 N ATOM 423 CA GLY B 320 18.338 -4.356 -7.414 1.00 0.00 C ATOM 424 C GLY B 320 17.329 -5.247 -8.112 1.00 0.00 C ATOM 425 O GLY B 320 17.524 -5.632 -9.264 1.00 0.00 O ATOM 426 HA3 GLY B 320 18.940 -4.968 -6.742 1.00 0.00 H ATOM 427 HA2 GLY B 320 18.983 -3.902 -8.166 1.00 0.00 H ATOM 428 H GLY B 320 17.769 -3.314 -5.605 1.00 0.00 H ATOM 429 N GLN B 321 16.248 -5.574 -7.409 1.00 0.00 N ATOM 430 CA GLN B 321 15.199 -6.421 -7.966 1.00 0.00 C ATOM 431 C GLN B 321 13.903 -5.629 -8.144 1.00 0.00 C ATOM 432 O GLN B 321 13.111 -5.513 -7.209 1.00 0.00 O ATOM 433 CB GLN B 321 14.952 -7.627 -7.056 1.00 0.00 C ATOM 434 CG GLN B 321 14.008 -8.661 -7.652 1.00 0.00 C ATOM 435 CD GLN B 321 13.771 -9.839 -6.726 1.00 0.00 C ATOM 436 OE1 GLN B 321 14.632 -10.193 -5.920 1.00 0.00 O ATOM 437 NE2 GLN B 321 12.600 -10.456 -6.839 1.00 0.00 N ATOM 438 HA GLN B 321 15.528 -6.774 -8.943 1.00 0.00 H ATOM 439 HB2 GLN B 321 15.909 -8.109 -6.856 1.00 0.00 H ATOM 440 HB3 GLN B 321 14.524 -7.270 -6.119 1.00 0.00 H ATOM 441 HG2 GLN B 321 13.051 -8.182 -7.859 1.00 0.00 H ATOM 442 HG3 GLN B 321 14.437 -9.030 -8.583 1.00 0.00 H ATOM 443 HE22 GLN B 321 11.902 -10.123 -7.534 1.00 0.00 H ATOM 444 HE21 GLN B 321 12.382 -11.272 -6.233 1.00 0.00 H ATOM 445 H GLN B 321 16.148 -5.217 -6.437 1.00 0.00 H ATOM 446 N PRO B 322 13.673 -5.062 -9.345 1.00 0.00 N ATOM 447 CA PRO B 322 12.463 -4.279 -9.626 1.00 0.00 C ATOM 448 C PRO B 322 11.195 -5.123 -9.555 1.00 0.00 C ATOM 449 O PRO B 322 10.085 -4.591 -9.529 1.00 0.00 O ATOM 450 CB PRO B 322 12.683 -3.767 -11.054 1.00 0.00 C ATOM 451 CG PRO B 322 13.677 -4.703 -11.649 1.00 0.00 C ATOM 452 CD PRO B 322 14.565 -5.133 -10.517 1.00 0.00 C ATOM 453 HA PRO B 322 12.319 -3.484 -8.894 1.00 0.00 H ATOM 454 HD3 PRO B 322 14.930 -6.149 -10.670 1.00 0.00 H ATOM 455 HD2 PRO B 322 15.412 -4.456 -10.406 1.00 0.00 H ATOM 456 HG3 PRO B 322 14.261 -4.198 -12.419 1.00 0.00 H ATOM 457 HG2 PRO B 322 13.173 -5.566 -12.085 1.00 0.00 H ATOM 458 HB2 PRO B 322 11.750 -3.789 -11.617 1.00 0.00 H ATOM 459 HB3 PRO B 322 13.074 -2.750 -11.041 1.00 0.00 H ATOM 460 N ASP B 323 11.366 -6.441 -9.519 1.00 0.00 N ATOM 461 CA ASP B 323 10.234 -7.358 -9.452 1.00 0.00 C ATOM 462 C ASP B 323 9.486 -7.209 -8.131 1.00 0.00 C ATOM 463 O ASP B 323 8.255 -7.202 -8.100 1.00 0.00 O ATOM 464 CB ASP B 323 10.709 -8.802 -9.618 1.00 0.00 C ATOM 465 CG ASP B 323 9.557 -9.784 -9.709 1.00 0.00 C ATOM 466 OD1 ASP B 323 9.040 -10.194 -8.648 1.00 0.00 O ATOM 467 OD2 ASP B 323 9.171 -10.143 -10.841 1.00 0.00 O ATOM 468 HA ASP B 323 9.552 -7.109 -10.265 1.00 0.00 H ATOM 469 HB2 ASP B 323 11.302 -8.873 -10.530 1.00 0.00 H ATOM 470 HB3 ASP B 323 11.329 -9.067 -8.761 1.00 0.00 H ATOM 471 H ASP B 323 12.331 -6.828 -9.539 1.00 0.00 H ATOM 472 N ILE B 324 10.239 -7.091 -7.042 1.00 0.00 N ATOM 473 CA ILE B 324 9.651 -6.946 -5.715 1.00 0.00 C ATOM 474 C ILE B 324 8.845 -5.654 -5.606 1.00 0.00 C ATOM 475 O ILE B 324 7.730 -5.650 -5.082 1.00 0.00 O ATOM 476 CB ILE B 324 10.737 -6.962 -4.617 1.00 0.00 C ATOM 477 CG1 ILE B 324 11.533 -8.272 -4.669 1.00 0.00 C ATOM 478 CG2 ILE B 324 10.112 -6.766 -3.242 1.00 0.00 C ATOM 479 CD1 ILE B 324 10.701 -9.506 -4.388 1.00 0.00 C ATOM 480 HA ILE B 324 8.984 -7.795 -5.568 1.00 0.00 H ATOM 481 HB ILE B 324 11.424 -6.136 -4.800 1.00 0.00 H ATOM 482 HG12 ILE B 324 11.969 -8.370 -5.663 1.00 0.00 H ATOM 483 HG13 ILE B 324 12.331 -8.219 -3.928 1.00 0.00 H ATOM 484 HD11 ILE B 324 10.267 -9.431 -3.391 1.00 0.00 H ATOM 485 HD12 ILE B 324 9.904 -9.582 -5.128 1.00 0.00 H ATOM 486 HD13 ILE B 324 11.335 -10.391 -4.443 1.00 0.00 H ATOM 487 HG21 ILE B 324 9.594 -5.807 -3.213 1.00 0.00 H ATOM 488 HG22 ILE B 324 9.402 -7.570 -3.049 1.00 0.00 H ATOM 489 HG23 ILE B 324 10.894 -6.781 -2.483 1.00 0.00 H ATOM 490 H ILE B 324 11.274 -7.102 -7.139 1.00 0.00 H ATOM 491 N TYR B 325 9.415 -4.561 -6.104 1.00 0.00 N ATOM 492 CA TYR B 325 8.751 -3.262 -6.062 1.00 0.00 C ATOM 493 C TYR B 325 7.434 -3.298 -6.833 1.00 0.00 C ATOM 494 O TYR B 325 6.376 -2.963 -6.293 1.00 0.00 O ATOM 495 CB TYR B 325 9.672 -2.185 -6.642 1.00 0.00 C ATOM 496 CG TYR B 325 9.117 -0.781 -6.538 1.00 0.00 C ATOM 497 CD1 TYR B 325 8.810 -0.223 -5.303 1.00 0.00 C ATOM 498 CD2 TYR B 325 8.905 -0.013 -7.676 1.00 0.00 C ATOM 499 CE1 TYR B 325 8.306 1.060 -5.205 1.00 0.00 C ATOM 500 CE2 TYR B 325 8.402 1.272 -7.586 1.00 0.00 C ATOM 501 CZ TYR B 325 8.104 1.803 -6.349 1.00 0.00 C ATOM 502 OH TYR B 325 7.604 3.081 -6.255 1.00 0.00 O ATOM 503 HA TYR B 325 8.530 -3.022 -5.022 1.00 0.00 H ATOM 504 HB3 TYR B 325 9.842 -2.410 -7.695 1.00 0.00 H ATOM 505 HB2 TYR B 325 10.621 -2.220 -6.106 1.00 0.00 H ATOM 506 HD2 TYR B 325 9.139 -0.430 -8.656 1.00 0.00 H ATOM 507 HE2 TYR B 325 8.242 1.862 -8.488 1.00 0.00 H ATOM 508 HE1 TYR B 325 8.069 1.482 -4.228 1.00 0.00 H ATOM 509 HD1 TYR B 325 8.969 -0.807 -4.397 1.00 0.00 H ATOM 510 HH TYR B 325 7.447 3.303 -5.303 1.00 0.00 H ATOM 511 H TYR B 325 10.359 -4.634 -6.535 1.00 0.00 H ATOM 512 N LYS B 326 7.506 -3.708 -8.096 1.00 0.00 N ATOM 513 CA LYS B 326 6.322 -3.792 -8.942 1.00 0.00 C ATOM 514 C LYS B 326 5.270 -4.697 -8.310 1.00 0.00 C ATOM 515 O LYS B 326 4.071 -4.446 -8.428 1.00 0.00 O ATOM 516 CB LYS B 326 6.695 -4.314 -10.331 1.00 0.00 C ATOM 517 CG LYS B 326 7.675 -3.421 -11.075 1.00 0.00 C ATOM 518 CD LYS B 326 8.044 -4.009 -12.428 1.00 0.00 C ATOM 519 CE LYS B 326 9.123 -3.191 -13.118 1.00 0.00 C ATOM 520 NZ LYS B 326 9.495 -3.767 -14.439 1.00 0.00 N ATOM 521 HA LYS B 326 5.904 -2.790 -9.041 1.00 0.00 H ATOM 522 HB2 LYS B 326 7.144 -5.301 -10.219 1.00 0.00 H ATOM 523 HB3 LYS B 326 5.784 -4.396 -10.924 1.00 0.00 H ATOM 524 HG2 LYS B 326 7.220 -2.442 -11.226 1.00 0.00 H ATOM 525 HG3 LYS B 326 8.580 -3.311 -10.477 1.00 0.00 H ATOM 526 HD2 LYS B 326 8.408 -5.026 -12.284 1.00 0.00 H ATOM 527 HD3 LYS B 326 7.156 -4.028 -13.060 1.00 0.00 H ATOM 528 HE2 LYS B 326 10.008 -3.166 -12.482 1.00 0.00 H ATOM 529 HE3 LYS B 326 8.755 -2.176 -13.267 1.00 0.00 H ATOM 530 HZ1 LYS B 326 9.853 -4.734 -14.306 1.00 0.00 H ATOM 531 HZ2 LYS B 326 8.657 -3.788 -15.055 1.00 0.00 H ATOM 532 HZ3 LYS B 326 10.233 -3.180 -14.876 1.00 0.00 H ATOM 533 H LYS B 326 8.431 -3.975 -8.490 1.00 0.00 H ATOM 534 N ALA B 327 5.729 -5.748 -7.637 1.00 0.00 N ATOM 535 CA ALA B 327 4.829 -6.688 -6.982 1.00 0.00 C ATOM 536 C ALA B 327 3.993 -5.987 -5.917 1.00 0.00 C ATOM 537 O ALA B 327 2.763 -6.012 -5.965 1.00 0.00 O ATOM 538 CB ALA B 327 5.618 -7.835 -6.369 1.00 0.00 C ATOM 539 HA ALA B 327 4.151 -7.093 -7.734 1.00 0.00 H ATOM 540 HB1 ALA B 327 6.168 -8.356 -7.153 1.00 0.00 H ATOM 541 HB2 ALA B 327 6.318 -7.440 -5.633 1.00 0.00 H ATOM 542 HB3 ALA B 327 4.931 -8.528 -5.884 1.00 0.00 H ATOM 543 H ALA B 327 6.756 -5.903 -7.577 1.00 0.00 H ATOM 544 N PHE B 328 4.671 -5.358 -4.959 1.00 0.00 N ATOM 545 CA PHE B 328 3.998 -4.642 -3.879 1.00 0.00 C ATOM 546 C PHE B 328 2.970 -3.659 -4.436 1.00 0.00 C ATOM 547 O PHE B 328 1.830 -3.601 -3.964 1.00 0.00 O ATOM 548 CB PHE B 328 5.027 -3.902 -3.020 1.00 0.00 C ATOM 549 CG PHE B 328 4.431 -3.118 -1.884 1.00 0.00 C ATOM 550 CD1 PHE B 328 3.607 -3.731 -0.951 1.00 0.00 C ATOM 551 CD2 PHE B 328 4.704 -1.766 -1.744 1.00 0.00 C ATOM 552 CE1 PHE B 328 3.068 -3.010 0.097 1.00 0.00 C ATOM 553 CE2 PHE B 328 4.166 -1.041 -0.699 1.00 0.00 C ATOM 554 CZ PHE B 328 3.348 -1.663 0.223 1.00 0.00 C ATOM 555 HA PHE B 328 3.473 -5.369 -3.259 1.00 0.00 H ATOM 556 HB2 PHE B 328 5.717 -4.636 -2.604 1.00 0.00 H ATOM 557 HB3 PHE B 328 5.575 -3.212 -3.661 1.00 0.00 H ATOM 558 HD2 PHE B 328 5.351 -1.269 -2.467 1.00 0.00 H ATOM 559 HE2 PHE B 328 4.387 0.022 -0.602 1.00 0.00 H ATOM 560 HZ PHE B 328 2.924 -1.092 1.049 1.00 0.00 H ATOM 561 HE1 PHE B 328 2.423 -3.503 0.824 1.00 0.00 H ATOM 562 HD1 PHE B 328 3.382 -4.793 -1.046 1.00 0.00 H ATOM 563 H PHE B 328 5.711 -5.377 -4.981 1.00 0.00 H ATOM 564 N LEU B 329 3.378 -2.891 -5.443 1.00 0.00 N ATOM 565 CA LEU B 329 2.490 -1.915 -6.065 1.00 0.00 C ATOM 566 C LEU B 329 1.217 -2.586 -6.568 1.00 0.00 C ATOM 567 O LEU B 329 0.111 -2.138 -6.270 1.00 0.00 O ATOM 568 CB LEU B 329 3.196 -1.205 -7.222 1.00 0.00 C ATOM 569 CG LEU B 329 4.367 -0.306 -6.817 1.00 0.00 C ATOM 570 CD1 LEU B 329 5.058 0.253 -8.049 1.00 0.00 C ATOM 571 CD2 LEU B 329 3.889 0.825 -5.918 1.00 0.00 C ATOM 572 HA LEU B 329 2.221 -1.176 -5.310 1.00 0.00 H ATOM 573 HB2 LEU B 329 3.575 -1.966 -7.904 1.00 0.00 H ATOM 574 HB3 LEU B 329 2.460 -0.589 -7.739 1.00 0.00 H ATOM 575 HG LEU B 329 5.085 -0.908 -6.260 1.00 0.00 H ATOM 576 HD21 LEU B 329 3.151 1.424 -6.451 1.00 0.00 H ATOM 577 HD22 LEU B 329 3.437 0.406 -5.019 1.00 0.00 H ATOM 578 HD23 LEU B 329 4.737 1.451 -5.642 1.00 0.00 H ATOM 579 HD11 LEU B 329 5.435 -0.569 -8.657 1.00 0.00 H ATOM 580 HD12 LEU B 329 4.345 0.838 -8.630 1.00 0.00 H ATOM 581 HD13 LEU B 329 5.888 0.890 -7.741 1.00 0.00 H ATOM 582 H LEU B 329 4.352 -2.989 -5.795 1.00 0.00 H ATOM 583 N GLU B 330 1.382 -3.665 -7.328 1.00 0.00 N ATOM 584 CA GLU B 330 0.245 -4.401 -7.871 1.00 0.00 C ATOM 585 C GLU B 330 -0.692 -4.852 -6.756 1.00 0.00 C ATOM 586 O GLU B 330 -1.911 -4.860 -6.926 1.00 0.00 O ATOM 587 CB GLU B 330 0.725 -5.610 -8.676 1.00 0.00 C ATOM 588 CG GLU B 330 1.445 -5.238 -9.963 1.00 0.00 C ATOM 589 CD GLU B 330 0.564 -4.457 -10.918 1.00 0.00 C ATOM 590 OE1 GLU B 330 -0.174 -5.093 -11.699 1.00 0.00 O ATOM 591 OE2 GLU B 330 0.611 -3.209 -10.885 1.00 0.00 O ATOM 592 HA GLU B 330 -0.305 -3.733 -8.534 1.00 0.00 H ATOM 593 HB2 GLU B 330 1.407 -6.189 -8.054 1.00 0.00 H ATOM 594 HB3 GLU B 330 -0.141 -6.221 -8.930 1.00 0.00 H ATOM 595 HG2 GLU B 330 2.315 -4.630 -9.714 1.00 0.00 H ATOM 596 HG3 GLU B 330 1.772 -6.153 -10.458 1.00 0.00 H ATOM 597 H GLU B 330 2.346 -3.992 -7.541 1.00 0.00 H ATOM 598 N ILE B 331 -0.118 -5.232 -5.617 1.00 0.00 N ATOM 599 CA ILE B 331 -0.912 -5.672 -4.477 1.00 0.00 C ATOM 600 C ILE B 331 -1.841 -4.558 -4.012 1.00 0.00 C ATOM 601 O ILE B 331 -3.045 -4.764 -3.849 1.00 0.00 O ATOM 602 CB ILE B 331 -0.021 -6.107 -3.294 1.00 0.00 C ATOM 603 CG1 ILE B 331 0.898 -7.257 -3.709 1.00 0.00 C ATOM 604 CG2 ILE B 331 -0.881 -6.514 -2.103 1.00 0.00 C ATOM 605 CD1 ILE B 331 1.920 -7.629 -2.654 1.00 0.00 C ATOM 606 HA ILE B 331 -1.497 -6.530 -4.808 1.00 0.00 H ATOM 607 HB ILE B 331 0.600 -5.261 -3.000 1.00 0.00 H ATOM 608 HG12 ILE B 331 0.283 -8.132 -3.917 1.00 0.00 H ATOM 609 HG13 ILE B 331 1.429 -6.964 -4.615 1.00 0.00 H ATOM 610 HD11 ILE B 331 2.552 -6.767 -2.443 1.00 0.00 H ATOM 611 HD12 ILE B 331 1.405 -7.936 -1.743 1.00 0.00 H ATOM 612 HD13 ILE B 331 2.535 -8.451 -3.020 1.00 0.00 H ATOM 613 HG21 ILE B 331 -1.495 -5.668 -1.794 1.00 0.00 H ATOM 614 HG22 ILE B 331 -1.524 -7.346 -2.389 1.00 0.00 H ATOM 615 HG23 ILE B 331 -0.237 -6.818 -1.278 1.00 0.00 H ATOM 616 H ILE B 331 0.919 -5.215 -5.539 1.00 0.00 H ATOM 617 N LEU B 332 -1.273 -3.374 -3.805 1.00 0.00 N ATOM 618 CA LEU B 332 -2.051 -2.226 -3.355 1.00 0.00 C ATOM 619 C LEU B 332 -3.110 -1.842 -4.386 1.00 0.00 C ATOM 620 O LEU B 332 -4.249 -1.537 -4.031 1.00 0.00 O ATOM 621 CB LEU B 332 -1.134 -1.033 -3.076 1.00 0.00 C ATOM 622 CG LEU B 332 0.101 -1.337 -2.221 1.00 0.00 C ATOM 623 CD1 LEU B 332 0.787 -0.045 -1.812 1.00 0.00 C ATOM 624 CD2 LEU B 332 -0.273 -2.153 -0.990 1.00 0.00 C ATOM 625 HA LEU B 332 -2.557 -2.507 -2.431 1.00 0.00 H ATOM 626 HB2 LEU B 332 -0.792 -0.641 -4.034 1.00 0.00 H ATOM 627 HB3 LEU B 332 -1.720 -0.271 -2.561 1.00 0.00 H ATOM 628 HG LEU B 332 0.793 -1.929 -2.820 1.00 0.00 H ATOM 629 HD21 LEU B 332 -0.987 -1.592 -0.387 1.00 0.00 H ATOM 630 HD22 LEU B 332 -0.722 -3.095 -1.303 1.00 0.00 H ATOM 631 HD23 LEU B 332 0.623 -2.354 -0.403 1.00 0.00 H ATOM 632 HD11 LEU B 332 1.095 0.499 -2.705 1.00 0.00 H ATOM 633 HD12 LEU B 332 0.094 0.566 -1.234 1.00 0.00 H ATOM 634 HD13 LEU B 332 1.662 -0.276 -1.205 1.00 0.00 H ATOM 635 H LEU B 332 -0.252 -3.264 -3.968 1.00 0.00 H ATOM 636 N HIS B 333 -2.728 -1.857 -5.662 1.00 0.00 N ATOM 637 CA HIS B 333 -3.654 -1.515 -6.738 1.00 0.00 C ATOM 638 C HIS B 333 -4.870 -2.435 -6.719 1.00 0.00 C ATOM 639 O HIS B 333 -6.008 -1.976 -6.821 1.00 0.00 O ATOM 640 CB HIS B 333 -2.957 -1.600 -8.098 1.00 0.00 C ATOM 641 CG HIS B 333 -2.091 -0.418 -8.409 1.00 0.00 C ATOM 642 ND1 HIS B 333 -2.600 0.830 -8.701 1.00 0.00 N ATOM 643 CD2 HIS B 333 -0.744 -0.298 -8.479 1.00 0.00 C ATOM 644 CE1 HIS B 333 -1.605 1.666 -8.937 1.00 0.00 C ATOM 645 NE2 HIS B 333 -0.468 1.006 -8.808 1.00 0.00 N ATOM 646 HA HIS B 333 -3.989 -0.490 -6.578 1.00 0.00 H ATOM 647 HB2 HIS B 333 -2.335 -2.495 -8.110 1.00 0.00 H ATOM 648 HB3 HIS B 333 -3.721 -1.680 -8.871 1.00 0.00 H ATOM 649 HD2 HIS B 333 -0.015 -1.089 -8.306 1.00 0.00 H ATOM 650 HE1 HIS B 333 -1.705 2.720 -9.194 1.00 0.00 H ATOM 651 H HIS B 333 -1.749 -2.118 -5.897 1.00 0.00 H ATOM 652 N THR B 334 -4.622 -3.735 -6.589 1.00 0.00 N ATOM 653 CA THR B 334 -5.699 -4.716 -6.552 1.00 0.00 C ATOM 654 C THR B 334 -6.630 -4.444 -5.377 1.00 0.00 C ATOM 655 O THR B 334 -7.852 -4.470 -5.522 1.00 0.00 O ATOM 656 CB THR B 334 -5.154 -6.153 -6.446 1.00 0.00 C ATOM 657 OG1 THR B 334 -4.231 -6.405 -7.512 1.00 0.00 O ATOM 658 CG2 THR B 334 -6.286 -7.169 -6.500 1.00 0.00 C ATOM 659 HA THR B 334 -6.252 -4.623 -7.487 1.00 0.00 H ATOM 660 HB THR B 334 -4.643 -6.254 -5.489 1.00 0.00 H ATOM 661 HG1 THR B 334 -3.478 -5.765 -7.453 1.00 0.00 H ATOM 662 HG23 THR B 334 -6.986 -6.974 -5.688 1.00 0.00 H ATOM 663 HG21 THR B 334 -6.803 -7.084 -7.456 1.00 0.00 H ATOM 664 HG22 THR B 334 -5.876 -8.174 -6.395 1.00 0.00 H ATOM 665 H THR B 334 -3.637 -4.059 -6.512 1.00 0.00 H ATOM 666 N TYR B 335 -6.042 -4.180 -4.214 1.00 0.00 N ATOM 667 CA TYR B 335 -6.819 -3.893 -3.014 1.00 0.00 C ATOM 668 C TYR B 335 -7.720 -2.682 -3.238 1.00 0.00 C ATOM 669 O TYR B 335 -8.845 -2.632 -2.742 1.00 0.00 O ATOM 670 CB TYR B 335 -5.889 -3.642 -1.824 1.00 0.00 C ATOM 671 CG TYR B 335 -6.616 -3.228 -0.563 1.00 0.00 C ATOM 672 CD1 TYR B 335 -7.097 -4.177 0.330 1.00 0.00 C ATOM 673 CD2 TYR B 335 -6.824 -1.886 -0.270 1.00 0.00 C ATOM 674 CE1 TYR B 335 -7.766 -3.800 1.479 1.00 0.00 C ATOM 675 CE2 TYR B 335 -7.492 -1.502 0.878 1.00 0.00 C ATOM 676 CZ TYR B 335 -7.960 -2.462 1.748 1.00 0.00 C ATOM 677 OH TYR B 335 -8.625 -2.083 2.892 1.00 0.00 O ATOM 678 HA TYR B 335 -7.445 -4.758 -2.795 1.00 0.00 H ATOM 679 HB3 TYR B 335 -5.189 -2.851 -2.094 1.00 0.00 H ATOM 680 HB2 TYR B 335 -5.337 -4.559 -1.618 1.00 0.00 H ATOM 681 HD2 TYR B 335 -6.455 -1.124 -0.956 1.00 0.00 H ATOM 682 HE2 TYR B 335 -7.648 -0.445 1.094 1.00 0.00 H ATOM 683 HE1 TYR B 335 -8.138 -4.557 2.169 1.00 0.00 H ATOM 684 HD1 TYR B 335 -6.944 -5.236 0.121 1.00 0.00 H ATOM 685 HH TYR B 335 -8.891 -2.890 3.400 1.00 0.00 H ATOM 686 H TYR B 335 -5.003 -4.178 -4.159 1.00 0.00 H ATOM 687 N GLN B 336 -7.213 -1.708 -3.988 1.00 0.00 N ATOM 688 CA GLN B 336 -7.965 -0.493 -4.283 1.00 0.00 C ATOM 689 C GLN B 336 -9.193 -0.811 -5.131 1.00 0.00 C ATOM 690 O GLN B 336 -10.305 -0.394 -4.809 1.00 0.00 O ATOM 691 CB GLN B 336 -7.068 0.512 -5.014 1.00 0.00 C ATOM 692 CG GLN B 336 -7.497 1.964 -4.853 1.00 0.00 C ATOM 693 CD GLN B 336 -8.855 2.253 -5.462 1.00 0.00 C ATOM 694 OE1 GLN B 336 -8.964 2.555 -6.650 1.00 0.00 O ATOM 695 NE2 GLN B 336 -9.899 2.176 -4.645 1.00 0.00 N ATOM 696 HA GLN B 336 -8.300 -0.056 -3.342 1.00 0.00 H ATOM 697 HB2 GLN B 336 -6.054 0.410 -4.627 1.00 0.00 H ATOM 698 HB3 GLN B 336 -7.077 0.269 -6.076 1.00 0.00 H ATOM 699 HG2 GLN B 336 -7.536 2.199 -3.789 1.00 0.00 H ATOM 700 HG3 GLN B 336 -6.757 2.601 -5.337 1.00 0.00 H ATOM 701 HE22 GLN B 336 -9.761 1.917 -3.647 1.00 0.00 H ATOM 702 HE21 GLN B 336 -10.855 2.375 -5.003 1.00 0.00 H ATOM 703 H GLN B 336 -6.254 -1.815 -4.375 1.00 0.00 H ATOM 704 N LYS B 337 -8.985 -1.556 -6.212 1.00 0.00 N ATOM 705 CA LYS B 337 -10.076 -1.926 -7.108 1.00 0.00 C ATOM 706 C LYS B 337 -11.147 -2.730 -6.374 1.00 0.00 C ATOM 707 O LYS B 337 -12.338 -2.595 -6.655 1.00 0.00 O ATOM 708 CB LYS B 337 -9.540 -2.728 -8.296 1.00 0.00 C ATOM 709 CG LYS B 337 -10.617 -3.145 -9.286 1.00 0.00 C ATOM 710 CD LYS B 337 -10.034 -3.936 -10.447 1.00 0.00 C ATOM 711 CE LYS B 337 -9.623 -5.337 -10.022 1.00 0.00 C ATOM 712 NZ LYS B 337 -10.780 -6.125 -9.513 1.00 0.00 N ATOM 713 HA LYS B 337 -10.533 -1.007 -7.475 1.00 0.00 H ATOM 714 HB2 LYS B 337 -8.806 -2.117 -8.822 1.00 0.00 H ATOM 715 HB3 LYS B 337 -9.056 -3.627 -7.915 1.00 0.00 H ATOM 716 HG2 LYS B 337 -11.352 -3.763 -8.770 1.00 0.00 H ATOM 717 HG3 LYS B 337 -11.105 -2.252 -9.676 1.00 0.00 H ATOM 718 HD2 LYS B 337 -10.783 -4.011 -11.235 1.00 0.00 H ATOM 719 HD3 LYS B 337 -9.158 -3.411 -10.828 1.00 0.00 H ATOM 720 HE2 LYS B 337 -8.874 -5.261 -9.234 1.00 0.00 H ATOM 721 HE3 LYS B 337 -9.194 -5.854 -10.880 1.00 0.00 H ATOM 722 HZ1 LYS B 337 -11.191 -5.642 -8.689 1.00 0.00 H ATOM 723 HZ2 LYS B 337 -11.497 -6.208 -10.261 1.00 0.00 H ATOM 724 HZ3 LYS B 337 -10.456 -7.073 -9.234 1.00 0.00 H ATOM 725 H LYS B 337 -8.021 -1.883 -6.425 1.00 0.00 H ATOM 726 N GLU B 338 -10.717 -3.565 -5.433 1.00 0.00 N ATOM 727 CA GLU B 338 -11.641 -4.392 -4.662 1.00 0.00 C ATOM 728 C GLU B 338 -12.464 -3.545 -3.695 1.00 0.00 C ATOM 729 O GLU B 338 -13.685 -3.683 -3.619 1.00 0.00 O ATOM 730 CB GLU B 338 -10.873 -5.465 -3.889 1.00 0.00 C ATOM 731 CG GLU B 338 -10.185 -6.485 -4.783 1.00 0.00 C ATOM 732 CD GLU B 338 -11.157 -7.228 -5.678 1.00 0.00 C ATOM 733 OE1 GLU B 338 -11.676 -8.280 -5.249 1.00 0.00 O ATOM 734 OE2 GLU B 338 -11.399 -6.758 -6.811 1.00 0.00 O ATOM 735 HA GLU B 338 -12.324 -4.873 -5.362 1.00 0.00 H ATOM 736 HB2 GLU B 338 -10.115 -4.974 -3.279 1.00 0.00 H ATOM 737 HB3 GLU B 338 -11.574 -5.991 -3.241 1.00 0.00 H ATOM 738 HG2 GLU B 338 -9.460 -5.967 -5.410 1.00 0.00 H ATOM 739 HG3 GLU B 338 -9.668 -7.209 -4.153 1.00 0.00 H ATOM 740 H GLU B 338 -9.697 -3.631 -5.241 1.00 0.00 H ATOM 741 N GLN B 339 -11.784 -2.672 -2.960 1.00 0.00 N ATOM 742 CA GLN B 339 -12.445 -1.803 -1.992 1.00 0.00 C ATOM 743 C GLN B 339 -13.459 -0.897 -2.682 1.00 0.00 C ATOM 744 O GLN B 339 -14.576 -0.715 -2.198 1.00 0.00 O ATOM 745 CB GLN B 339 -11.407 -0.957 -1.250 1.00 0.00 C ATOM 746 CG GLN B 339 -11.982 -0.168 -0.085 1.00 0.00 C ATOM 747 CD GLN B 339 -10.940 0.689 0.609 1.00 0.00 C ATOM 748 OE1 GLN B 339 -9.984 1.150 -0.014 1.00 0.00 O ATOM 749 NE2 GLN B 339 -11.123 0.907 1.907 1.00 0.00 N ATOM 750 HA GLN B 339 -12.975 -2.430 -1.274 1.00 0.00 H ATOM 751 HB2 GLN B 339 -10.632 -1.621 -0.867 1.00 0.00 H ATOM 752 HB3 GLN B 339 -10.966 -0.255 -1.957 1.00 0.00 H ATOM 753 HG2 GLN B 339 -12.775 0.480 -0.459 1.00 0.00 H ATOM 754 HG3 GLN B 339 -12.398 -0.868 0.640 1.00 0.00 H ATOM 755 HE22 GLN B 339 -11.946 0.497 2.392 1.00 0.00 H ATOM 756 HE21 GLN B 339 -10.443 1.488 2.438 1.00 0.00 H ATOM 757 H GLN B 339 -10.753 -2.606 -3.078 1.00 0.00 H ATOM 758 N ARG B 340 -13.059 -0.333 -3.817 1.00 0.00 N ATOM 759 CA ARG B 340 -13.927 0.554 -4.581 1.00 0.00 C ATOM 760 C ARG B 340 -15.133 -0.203 -5.125 1.00 0.00 C ATOM 761 O ARG B 340 -16.256 0.300 -5.100 1.00 0.00 O ATOM 762 CB ARG B 340 -13.147 1.194 -5.730 1.00 0.00 C ATOM 763 CG ARG B 340 -13.982 2.127 -6.590 1.00 0.00 C ATOM 764 CD ARG B 340 -13.176 2.674 -7.756 1.00 0.00 C ATOM 765 NE ARG B 340 -13.971 3.556 -8.608 1.00 0.00 N ATOM 766 CZ ARG B 340 -13.658 3.840 -9.868 1.00 0.00 C ATOM 767 NH1 ARG B 340 -12.570 3.317 -10.419 1.00 0.00 N ATOM 768 NH2 ARG B 340 -14.431 4.649 -10.578 1.00 0.00 N ATOM 769 HA ARG B 340 -14.286 1.338 -3.914 1.00 0.00 H ATOM 770 HB2 ARG B 340 -12.318 1.763 -5.309 1.00 0.00 H ATOM 771 HB3 ARG B 340 -12.755 0.399 -6.365 1.00 0.00 H ATOM 772 HG2 ARG B 340 -14.841 1.579 -6.978 1.00 0.00 H ATOM 773 HG3 ARG B 340 -14.330 2.959 -5.977 1.00 0.00 H ATOM 774 HD2 ARG B 340 -12.813 1.839 -8.355 1.00 0.00 H ATOM 775 HD3 ARG B 340 -12.327 3.234 -7.365 1.00 0.00 H ATOM 776 HE ARG B 340 -14.829 3.985 -8.206 1.00 0.00 H ATOM 777 HH12 ARG B 340 -12.328 3.541 -11.405 1.00 0.00 H ATOM 778 HH11 ARG B 340 -11.960 2.683 -9.865 1.00 0.00 H ATOM 779 HH22 ARG B 340 -14.185 4.871 -11.564 1.00 0.00 H ATOM 780 HH21 ARG B 340 -15.284 5.062 -10.149 1.00 0.00 H ATOM 781 H ARG B 340 -12.101 -0.530 -4.170 1.00 0.00 H ATOM 782 N ASN B 341 -14.891 -1.415 -5.619 1.00 0.00 N ATOM 783 CA ASN B 341 -15.958 -2.244 -6.166 1.00 0.00 C ATOM 784 C ASN B 341 -17.038 -2.482 -5.118 1.00 0.00 C ATOM 785 O ASN B 341 -18.230 -2.376 -5.403 1.00 0.00 O ATOM 786 CB ASN B 341 -15.398 -3.584 -6.645 1.00 0.00 C ATOM 787 CG ASN B 341 -16.345 -4.308 -7.582 1.00 0.00 C ATOM 788 OD1 ASN B 341 -17.565 -4.177 -7.474 1.00 0.00 O ATOM 789 ND2 ASN B 341 -15.787 -5.076 -8.510 1.00 0.00 N ATOM 790 HA ASN B 341 -16.398 -1.720 -7.014 1.00 0.00 H ATOM 791 HB2 ASN B 341 -14.459 -3.404 -7.168 1.00 0.00 H ATOM 792 HB3 ASN B 341 -15.214 -4.217 -5.777 1.00 0.00 H ATOM 793 HD22 ASN B 341 -14.752 -5.157 -8.564 1.00 0.00 H ATOM 794 HD21 ASN B 341 -16.385 -5.597 -9.183 1.00 0.00 H ATOM 795 H ASN B 341 -13.917 -1.779 -5.615 1.00 0.00 H ATOM 796 N ALA B 342 -16.606 -2.806 -3.905 1.00 0.00 N ATOM 797 CA ALA B 342 -17.529 -3.058 -2.804 1.00 0.00 C ATOM 798 C ALA B 342 -18.320 -1.802 -2.450 1.00 0.00 C ATOM 799 O ALA B 342 -19.537 -1.855 -2.268 1.00 0.00 O ATOM 800 CB ALA B 342 -16.773 -3.569 -1.587 1.00 0.00 C ATOM 801 HA ALA B 342 -18.237 -3.822 -3.125 1.00 0.00 H ATOM 802 HB1 ALA B 342 -16.261 -4.497 -1.842 1.00 0.00 H ATOM 803 HB2 ALA B 342 -16.042 -2.823 -1.275 1.00 0.00 H ATOM 804 HB3 ALA B 342 -17.476 -3.752 -0.775 1.00 0.00 H ATOM 805 H ALA B 342 -15.583 -2.882 -3.735 1.00 0.00 H ATOM 806 N LYS B 343 -17.621 -0.675 -2.352 1.00 0.00 N ATOM 807 CA LYS B 343 -18.258 0.594 -2.019 1.00 0.00 C ATOM 808 C LYS B 343 -19.159 1.068 -3.155 1.00 0.00 C ATOM 809 O LYS B 343 -20.058 1.884 -2.948 1.00 0.00 O ATOM 810 CB LYS B 343 -17.199 1.658 -1.714 1.00 0.00 C ATOM 811 CG LYS B 343 -16.337 1.334 -0.503 1.00 0.00 C ATOM 812 CD LYS B 343 -17.143 1.364 0.786 1.00 0.00 C ATOM 813 CE LYS B 343 -16.284 1.010 1.990 1.00 0.00 C ATOM 814 NZ LYS B 343 -15.160 1.969 2.174 1.00 0.00 N ATOM 815 HA LYS B 343 -18.873 0.439 -1.133 1.00 0.00 H ATOM 816 HB2 LYS B 343 -16.549 1.756 -2.583 1.00 0.00 H ATOM 817 HB3 LYS B 343 -17.706 2.606 -1.532 1.00 0.00 H ATOM 818 HG2 LYS B 343 -15.909 0.339 -0.629 1.00 0.00 H ATOM 819 HG3 LYS B 343 -15.534 2.067 -0.435 1.00 0.00 H ATOM 820 HD2 LYS B 343 -17.552 2.365 0.925 1.00 0.00 H ATOM 821 HD3 LYS B 343 -17.960 0.646 0.710 1.00 0.00 H ATOM 822 HE2 LYS B 343 -15.874 0.010 1.849 1.00 0.00 H ATOM 823 HE3 LYS B 343 -16.908 1.023 2.884 1.00 0.00 H ATOM 824 HZ1 LYS B 343 -14.555 1.959 1.328 1.00 0.00 H ATOM 825 HZ2 LYS B 343 -15.542 2.926 2.317 1.00 0.00 H ATOM 826 HZ3 LYS B 343 -14.601 1.690 3.005 1.00 0.00 H ATOM 827 H LYS B 343 -16.594 -0.699 -2.517 1.00 0.00 H ATOM 828 N GLU B 344 -18.915 0.549 -4.355 1.00 0.00 N ATOM 829 CA GLU B 344 -19.706 0.920 -5.524 1.00 0.00 C ATOM 830 C GLU B 344 -20.831 -0.083 -5.757 1.00 0.00 C ATOM 831 O GLU B 344 -21.798 0.205 -6.463 1.00 0.00 O ATOM 832 CB GLU B 344 -18.815 1.002 -6.766 1.00 0.00 C ATOM 833 CG GLU B 344 -19.512 1.595 -7.980 1.00 0.00 C ATOM 834 CD GLU B 344 -19.974 3.020 -7.749 1.00 0.00 C ATOM 835 OE1 GLU B 344 -19.123 3.934 -7.791 1.00 0.00 O ATOM 836 OE2 GLU B 344 -21.186 3.223 -7.524 1.00 0.00 O ATOM 837 HA GLU B 344 -20.147 1.899 -5.338 1.00 0.00 H ATOM 838 HB2 GLU B 344 -17.950 1.621 -6.529 1.00 0.00 H ATOM 839 HB3 GLU B 344 -18.482 -0.005 -7.018 1.00 0.00 H ATOM 840 HG2 GLU B 344 -18.818 1.585 -8.821 1.00 0.00 H ATOM 841 HG3 GLU B 344 -20.380 0.981 -8.219 1.00 0.00 H ATOM 842 H GLU B 344 -18.142 -0.138 -4.463 1.00 0.00 H ATOM 843 N ALA B 345 -20.697 -1.261 -5.157 1.00 0.00 N ATOM 844 CA ALA B 345 -21.700 -2.310 -5.295 1.00 0.00 C ATOM 845 C ALA B 345 -22.911 -2.026 -4.414 1.00 0.00 C ATOM 846 O ALA B 345 -23.897 -2.763 -4.440 1.00 0.00 O ATOM 847 CB ALA B 345 -21.097 -3.664 -4.946 1.00 0.00 C ATOM 848 HA ALA B 345 -22.033 -2.329 -6.333 1.00 0.00 H ATOM 849 HB1 ALA B 345 -20.265 -3.874 -5.619 1.00 0.00 H ATOM 850 HB2 ALA B 345 -20.738 -3.646 -3.917 1.00 0.00 H ATOM 851 HB3 ALA B 345 -21.857 -4.438 -5.054 1.00 0.00 H ATOM 852 H ALA B 345 -19.855 -1.439 -4.574 1.00 0.00 H ATOM 853 N GLY B 346 -22.829 -0.952 -3.635 1.00 0.00 N ATOM 854 CA GLY B 346 -23.923 -0.586 -2.756 1.00 0.00 C ATOM 855 C GLY B 346 -23.786 -1.194 -1.374 1.00 0.00 C ATOM 856 O GLY B 346 -23.639 -0.477 -0.385 1.00 0.00 O ATOM 857 HA3 GLY B 346 -24.858 -0.930 -3.199 1.00 0.00 H ATOM 858 HA2 GLY B 346 -23.946 0.500 -2.660 1.00 0.00 H ATOM 859 H GLY B 346 -21.970 -0.367 -3.656 1.00 0.00 H ATOM 860 N GLY B 347 -23.832 -2.521 -1.309 1.00 0.00 N ATOM 861 CA GLY B 347 -23.711 -3.207 -0.036 1.00 0.00 C ATOM 862 C GLY B 347 -23.543 -4.704 -0.199 1.00 0.00 C ATOM 863 O GLY B 347 -22.639 -5.300 0.387 1.00 0.00 O ATOM 864 HA3 GLY B 347 -24.610 -3.017 0.551 1.00 0.00 H ATOM 865 HA2 GLY B 347 -22.843 -2.813 0.493 1.00 0.00 H ATOM 866 H GLY B 347 -23.956 -3.074 -2.181 1.00 0.00 H ATOM 867 N ASN B 348 -24.415 -5.313 -0.997 1.00 0.00 N ATOM 868 CA ASN B 348 -24.357 -6.750 -1.236 1.00 0.00 C ATOM 869 C ASN B 348 -23.173 -7.102 -2.129 1.00 0.00 C ATOM 870 O ASN B 348 -23.266 -7.029 -3.354 1.00 0.00 O ATOM 871 CB ASN B 348 -25.655 -7.239 -1.881 1.00 0.00 C ATOM 872 CG ASN B 348 -26.866 -7.019 -0.996 1.00 0.00 C ATOM 873 OD1 ASN B 348 -26.919 -6.065 -0.219 1.00 0.00 O ATOM 874 ND2 ASN B 348 -27.848 -7.905 -1.109 1.00 0.00 N ATOM 875 HA ASN B 348 -24.230 -7.246 -0.274 1.00 0.00 H ATOM 876 HB2 ASN B 348 -25.804 -6.701 -2.817 1.00 0.00 H ATOM 877 HB3 ASN B 348 -25.562 -8.305 -2.087 1.00 0.00 H ATOM 878 HD22 ASN B 348 -27.760 -8.696 -1.779 1.00 0.00 H ATOM 879 HD21 ASN B 348 -28.705 -7.808 -0.528 1.00 0.00 H ATOM 880 H ASN B 348 -25.156 -4.751 -1.462 1.00 0.00 H ATOM 881 N TYR B 349 -22.061 -7.480 -1.506 1.00 0.00 N ATOM 882 CA TYR B 349 -20.855 -7.842 -2.244 1.00 0.00 C ATOM 883 C TYR B 349 -19.784 -8.380 -1.301 1.00 0.00 C ATOM 884 O TYR B 349 -19.642 -7.907 -0.174 1.00 0.00 O ATOM 885 CB TYR B 349 -20.317 -6.630 -3.008 1.00 0.00 C ATOM 886 CG TYR B 349 -19.134 -6.945 -3.896 1.00 0.00 C ATOM 887 CD1 TYR B 349 -19.315 -7.532 -5.143 1.00 0.00 C ATOM 888 CD2 TYR B 349 -17.839 -6.655 -3.489 1.00 0.00 C ATOM 889 CE1 TYR B 349 -18.238 -7.820 -5.959 1.00 0.00 C ATOM 890 CE2 TYR B 349 -16.755 -6.939 -4.300 1.00 0.00 C ATOM 891 CZ TYR B 349 -16.960 -7.521 -5.534 1.00 0.00 C ATOM 892 OH TYR B 349 -15.885 -7.806 -6.344 1.00 0.00 O ATOM 893 HA TYR B 349 -21.114 -8.625 -2.956 1.00 0.00 H ATOM 894 HB3 TYR B 349 -20.012 -5.874 -2.284 1.00 0.00 H ATOM 895 HB2 TYR B 349 -21.118 -6.232 -3.631 1.00 0.00 H ATOM 896 HD2 TYR B 349 -17.674 -6.196 -2.514 1.00 0.00 H ATOM 897 HE2 TYR B 349 -15.744 -6.704 -3.966 1.00 0.00 H ATOM 898 HE1 TYR B 349 -18.397 -8.281 -6.934 1.00 0.00 H ATOM 899 HD1 TYR B 349 -20.323 -7.769 -5.483 1.00 0.00 H ATOM 900 HH TYR B 349 -16.207 -8.217 -7.185 1.00 0.00 H ATOM 901 H TYR B 349 -22.050 -7.519 -0.467 1.00 0.00 H ATOM 902 N THR B 350 -19.031 -9.370 -1.771 1.00 0.00 N ATOM 903 CA THR B 350 -17.971 -9.969 -0.970 1.00 0.00 C ATOM 904 C THR B 350 -16.615 -9.848 -1.670 1.00 0.00 C ATOM 905 O THR B 350 -16.339 -10.568 -2.630 1.00 0.00 O ATOM 906 CB THR B 350 -18.260 -11.453 -0.671 1.00 0.00 C ATOM 907 OG1 THR B 350 -17.096 -12.079 -0.119 1.00 0.00 O ATOM 908 CG2 THR B 350 -18.692 -12.190 -1.930 1.00 0.00 C ATOM 909 HA THR B 350 -17.937 -9.421 -0.028 1.00 0.00 H ATOM 910 HB THR B 350 -19.074 -11.500 0.052 1.00 0.00 H ATOM 911 HG1 THR B 350 -16.350 -12.017 -0.767 1.00 0.00 H ATOM 912 HG23 THR B 350 -19.578 -11.709 -2.345 1.00 0.00 H ATOM 913 HG21 THR B 350 -17.885 -12.161 -2.662 1.00 0.00 H ATOM 914 HG22 THR B 350 -18.922 -13.226 -1.682 1.00 0.00 H ATOM 915 H THR B 350 -19.203 -9.725 -2.733 1.00 0.00 H ATOM 916 N PRO B 351 -15.748 -8.928 -1.203 1.00 0.00 N ATOM 917 CA PRO B 351 -14.423 -8.723 -1.798 1.00 0.00 C ATOM 918 C PRO B 351 -13.523 -9.943 -1.641 1.00 0.00 C ATOM 919 O PRO B 351 -13.656 -10.707 -0.685 1.00 0.00 O ATOM 920 CB PRO B 351 -13.854 -7.533 -1.018 1.00 0.00 C ATOM 921 CG PRO B 351 -14.610 -7.519 0.265 1.00 0.00 C ATOM 922 CD PRO B 351 -15.986 -8.022 -0.065 1.00 0.00 C ATOM 923 HA PRO B 351 -14.485 -8.550 -2.872 1.00 0.00 H ATOM 924 HD3 PRO B 351 -16.419 -8.559 0.779 1.00 0.00 H ATOM 925 HD2 PRO B 351 -16.645 -7.202 -0.349 1.00 0.00 H ATOM 926 HG3 PRO B 351 -14.662 -6.506 0.664 1.00 0.00 H ATOM 927 HG2 PRO B 351 -14.132 -8.172 0.995 1.00 0.00 H ATOM 928 HB2 PRO B 351 -12.788 -7.669 -0.834 1.00 0.00 H ATOM 929 HB3 PRO B 351 -14.011 -6.604 -1.566 1.00 0.00 H ATOM 930 N ALA B 352 -12.606 -10.119 -2.587 1.00 0.00 N ATOM 931 CA ALA B 352 -11.682 -11.246 -2.558 1.00 0.00 C ATOM 932 C ALA B 352 -10.335 -10.842 -1.966 1.00 0.00 C ATOM 933 O ALA B 352 -9.476 -11.690 -1.721 1.00 0.00 O ATOM 934 CB ALA B 352 -11.497 -11.811 -3.959 1.00 0.00 C ATOM 935 HA ALA B 352 -12.111 -12.018 -1.919 1.00 0.00 H ATOM 936 HB1 ALA B 352 -12.460 -12.148 -4.343 1.00 0.00 H ATOM 937 HB2 ALA B 352 -11.095 -11.036 -4.612 1.00 0.00 H ATOM 938 HB3 ALA B 352 -10.804 -12.652 -3.922 1.00 0.00 H ATOM 939 H ALA B 352 -12.546 -9.435 -3.368 1.00 0.00 H ATOM 940 N LEU B 353 -10.156 -9.544 -1.737 1.00 0.00 N ATOM 941 CA LEU B 353 -8.912 -9.031 -1.174 1.00 0.00 C ATOM 942 C LEU B 353 -9.191 -7.970 -0.114 1.00 0.00 C ATOM 943 O LEU B 353 -9.639 -6.868 -0.428 1.00 0.00 O ATOM 944 CB LEU B 353 -8.031 -8.446 -2.282 1.00 0.00 C ATOM 945 CG LEU B 353 -6.640 -7.984 -1.836 1.00 0.00 C ATOM 946 CD1 LEU B 353 -5.825 -9.158 -1.315 1.00 0.00 C ATOM 947 CD2 LEU B 353 -5.914 -7.302 -2.985 1.00 0.00 C ATOM 948 HA LEU B 353 -8.386 -9.860 -0.701 1.00 0.00 H ATOM 949 HB2 LEU B 353 -7.903 -9.209 -3.049 1.00 0.00 H ATOM 950 HB3 LEU B 353 -8.551 -7.588 -2.708 1.00 0.00 H ATOM 951 HG LEU B 353 -6.761 -7.265 -1.026 1.00 0.00 H ATOM 952 HD21 LEU B 353 -5.807 -8.003 -3.813 1.00 0.00 H ATOM 953 HD22 LEU B 353 -6.488 -6.435 -3.313 1.00 0.00 H ATOM 954 HD23 LEU B 353 -4.928 -6.980 -2.650 1.00 0.00 H ATOM 955 HD11 LEU B 353 -6.338 -9.606 -0.464 1.00 0.00 H ATOM 956 HD12 LEU B 353 -5.714 -9.901 -2.105 1.00 0.00 H ATOM 957 HD13 LEU B 353 -4.841 -8.806 -1.004 1.00 0.00 H ATOM 958 H LEU B 353 -10.922 -8.878 -1.965 1.00 0.00 H ATOM 959 N THR B 354 -8.921 -8.312 1.144 1.00 0.00 N ATOM 960 CA THR B 354 -9.144 -7.392 2.255 1.00 0.00 C ATOM 961 C THR B 354 -7.833 -7.024 2.939 1.00 0.00 C ATOM 962 O THR B 354 -6.755 -7.397 2.478 1.00 0.00 O ATOM 963 CB THR B 354 -10.099 -7.996 3.301 1.00 0.00 C ATOM 964 OG1 THR B 354 -9.584 -9.247 3.773 1.00 0.00 O ATOM 965 CG2 THR B 354 -11.487 -8.201 2.712 1.00 0.00 C ATOM 966 HA THR B 354 -9.596 -6.494 1.833 1.00 0.00 H ATOM 967 HB THR B 354 -10.175 -7.299 4.136 1.00 0.00 H ATOM 968 HG1 THR B 354 -10.205 -9.626 4.444 1.00 0.00 H ATOM 969 HG23 THR B 354 -11.873 -7.246 2.355 1.00 0.00 H ATOM 970 HG21 THR B 354 -11.428 -8.904 1.881 1.00 0.00 H ATOM 971 HG22 THR B 354 -12.151 -8.599 3.480 1.00 0.00 H ATOM 972 H THR B 354 -8.541 -9.260 1.340 1.00 0.00 H ATOM 973 N GLU B 355 -7.934 -6.289 4.044 1.00 0.00 N ATOM 974 CA GLU B 355 -6.757 -5.867 4.794 1.00 0.00 C ATOM 975 C GLU B 355 -5.965 -7.070 5.296 1.00 0.00 C ATOM 976 O GLU B 355 -4.748 -7.138 5.124 1.00 0.00 O ATOM 977 CB GLU B 355 -7.167 -4.983 5.973 1.00 0.00 C ATOM 978 CG GLU B 355 -7.917 -3.727 5.559 1.00 0.00 C ATOM 979 CD GLU B 355 -8.265 -2.837 6.737 1.00 0.00 C ATOM 980 OE1 GLU B 355 -9.325 -3.061 7.357 1.00 0.00 O ATOM 981 OE2 GLU B 355 -7.477 -1.916 7.037 1.00 0.00 O ATOM 982 HA GLU B 355 -6.119 -5.293 4.122 1.00 0.00 H ATOM 983 HB2 GLU B 355 -7.808 -5.566 6.634 1.00 0.00 H ATOM 984 HB3 GLU B 355 -6.267 -4.686 6.511 1.00 0.00 H ATOM 985 HG2 GLU B 355 -7.294 -3.161 4.866 1.00 0.00 H ATOM 986 HG3 GLU B 355 -8.840 -4.021 5.059 1.00 0.00 H ATOM 987 H GLU B 355 -8.877 -6.008 4.381 1.00 0.00 H ATOM 988 N GLN B 356 -6.661 -8.015 5.922 1.00 0.00 N ATOM 989 CA GLN B 356 -6.021 -9.217 6.446 1.00 0.00 C ATOM 990 C GLN B 356 -5.361 -10.008 5.321 1.00 0.00 C ATOM 991 O GLN B 356 -4.232 -10.482 5.458 1.00 0.00 O ATOM 992 CB GLN B 356 -7.047 -10.094 7.167 1.00 0.00 C ATOM 993 CG GLN B 356 -6.446 -11.328 7.822 1.00 0.00 C ATOM 994 CD GLN B 356 -5.450 -10.987 8.914 1.00 0.00 C ATOM 995 OE1 GLN B 356 -4.497 -11.729 9.153 1.00 0.00 O ATOM 996 NE2 GLN B 356 -5.669 -9.863 9.588 1.00 0.00 N ATOM 997 HA GLN B 356 -5.253 -8.913 7.157 1.00 0.00 H ATOM 998 HB2 GLN B 356 -7.530 -9.495 7.939 1.00 0.00 H ATOM 999 HB3 GLN B 356 -7.793 -10.418 6.441 1.00 0.00 H ATOM 1000 HG2 GLN B 356 -7.252 -11.919 8.257 1.00 0.00 H ATOM 1001 HG3 GLN B 356 -5.938 -11.916 7.058 1.00 0.00 H ATOM 1002 HE22 GLN B 356 -6.487 -9.266 9.352 1.00 0.00 H ATOM 1003 HE21 GLN B 356 -5.022 -9.580 10.352 1.00 0.00 H ATOM 1004 H GLN B 356 -7.687 -7.894 6.041 1.00 0.00 H ATOM 1005 N GLU B 357 -6.077 -10.145 4.209 1.00 0.00 N ATOM 1006 CA GLU B 357 -5.569 -10.874 3.055 1.00 0.00 C ATOM 1007 C GLU B 357 -4.287 -10.235 2.529 1.00 0.00 C ATOM 1008 O GLU B 357 -3.344 -10.933 2.154 1.00 0.00 O ATOM 1009 CB GLU B 357 -6.627 -10.917 1.952 1.00 0.00 C ATOM 1010 CG GLU B 357 -6.282 -11.863 0.814 1.00 0.00 C ATOM 1011 CD GLU B 357 -6.106 -13.295 1.278 1.00 0.00 C ATOM 1012 OE1 GLU B 357 -7.125 -14.008 1.406 1.00 0.00 O ATOM 1013 OE2 GLU B 357 -4.950 -13.705 1.514 1.00 0.00 O ATOM 1014 HA GLU B 357 -5.340 -11.893 3.368 1.00 0.00 H ATOM 1015 HB2 GLU B 357 -7.571 -11.237 2.392 1.00 0.00 H ATOM 1016 HB3 GLU B 357 -6.740 -9.913 1.543 1.00 0.00 H ATOM 1017 HG2 GLU B 357 -7.085 -11.831 0.078 1.00 0.00 H ATOM 1018 HG3 GLU B 357 -5.353 -11.529 0.352 1.00 0.00 H ATOM 1019 H GLU B 357 -7.025 -9.720 4.162 1.00 0.00 H ATOM 1020 N VAL B 358 -4.257 -8.905 2.504 1.00 0.00 N ATOM 1021 CA VAL B 358 -3.083 -8.181 2.032 1.00 0.00 C ATOM 1022 C VAL B 358 -1.900 -8.415 2.964 1.00 0.00 C ATOM 1023 O VAL B 358 -0.786 -8.662 2.513 1.00 0.00 O ATOM 1024 CB VAL B 358 -3.357 -6.664 1.913 1.00 0.00 C ATOM 1025 CG1 VAL B 358 -2.062 -5.883 1.726 1.00 0.00 C ATOM 1026 CG2 VAL B 358 -4.309 -6.390 0.761 1.00 0.00 C ATOM 1027 HA VAL B 358 -2.844 -8.564 1.040 1.00 0.00 H ATOM 1028 HB VAL B 358 -3.820 -6.331 2.842 1.00 0.00 H ATOM 1029 HG11 VAL B 358 -1.410 -6.053 2.583 1.00 0.00 H ATOM 1030 HG12 VAL B 358 -1.564 -6.219 0.816 1.00 0.00 H ATOM 1031 HG13 VAL B 358 -2.289 -4.820 1.646 1.00 0.00 H ATOM 1032 HG21 VAL B 358 -3.865 -6.746 -0.168 1.00 0.00 H ATOM 1033 HG22 VAL B 358 -5.251 -6.910 0.938 1.00 0.00 H ATOM 1034 HG23 VAL B 358 -4.492 -5.318 0.690 1.00 0.00 H ATOM 1035 H VAL B 358 -5.088 -8.371 2.828 1.00 0.00 H ATOM 1036 N TYR B 359 -2.153 -8.345 4.266 1.00 0.00 N ATOM 1037 CA TYR B 359 -1.105 -8.556 5.258 1.00 0.00 C ATOM 1038 C TYR B 359 -0.459 -9.926 5.074 1.00 0.00 C ATOM 1039 O TYR B 359 0.761 -10.064 5.159 1.00 0.00 O ATOM 1040 CB TYR B 359 -1.679 -8.431 6.672 1.00 0.00 C ATOM 1041 CG TYR B 359 -0.652 -8.605 7.769 1.00 0.00 C ATOM 1042 CD1 TYR B 359 0.158 -7.547 8.161 1.00 0.00 C ATOM 1043 CD2 TYR B 359 -0.496 -9.826 8.416 1.00 0.00 C ATOM 1044 CE1 TYR B 359 1.095 -7.699 9.166 1.00 0.00 C ATOM 1045 CE2 TYR B 359 0.438 -9.985 9.423 1.00 0.00 C ATOM 1046 CZ TYR B 359 1.231 -8.919 9.793 1.00 0.00 C ATOM 1047 OH TYR B 359 2.161 -9.073 10.794 1.00 0.00 O ATOM 1048 HA TYR B 359 -0.341 -7.791 5.118 1.00 0.00 H ATOM 1049 HB3 TYR B 359 -2.449 -9.192 6.799 1.00 0.00 H ATOM 1050 HB2 TYR B 359 -2.127 -7.443 6.775 1.00 0.00 H ATOM 1051 HD2 TYR B 359 -1.120 -10.671 8.125 1.00 0.00 H ATOM 1052 HE2 TYR B 359 0.547 -10.948 9.922 1.00 0.00 H ATOM 1053 HE1 TYR B 359 1.723 -6.858 9.461 1.00 0.00 H ATOM 1054 HD1 TYR B 359 0.053 -6.581 7.668 1.00 0.00 H ATOM 1055 HH TYR B 359 2.640 -8.218 10.932 1.00 0.00 H ATOM 1056 H TYR B 359 -3.120 -8.135 4.585 1.00 0.00 H ATOM 1057 N ALA B 360 -1.287 -10.932 4.813 1.00 0.00 N ATOM 1058 CA ALA B 360 -0.802 -12.294 4.618 1.00 0.00 C ATOM 1059 C ALA B 360 0.066 -12.405 3.366 1.00 0.00 C ATOM 1060 O ALA B 360 1.172 -12.943 3.414 1.00 0.00 O ATOM 1061 CB ALA B 360 -1.974 -13.261 4.539 1.00 0.00 C ATOM 1062 HA ALA B 360 -0.181 -12.556 5.475 1.00 0.00 H ATOM 1063 HB1 ALA B 360 -2.546 -13.214 5.466 1.00 0.00 H ATOM 1064 HB2 ALA B 360 -2.615 -12.986 3.701 1.00 0.00 H ATOM 1065 HB3 ALA B 360 -1.599 -14.274 4.393 1.00 0.00 H ATOM 1066 H ALA B 360 -2.308 -10.743 4.746 1.00 0.00 H ATOM 1067 N GLN B 361 -0.442 -11.894 2.248 1.00 0.00 N ATOM 1068 CA GLN B 361 0.287 -11.942 0.983 1.00 0.00 C ATOM 1069 C GLN B 361 1.611 -11.186 1.075 1.00 0.00 C ATOM 1070 O GLN B 361 2.667 -11.725 0.739 1.00 0.00 O ATOM 1071 CB GLN B 361 -0.570 -11.360 -0.145 1.00 0.00 C ATOM 1072 CG GLN B 361 -1.831 -12.162 -0.426 1.00 0.00 C ATOM 1073 CD GLN B 361 -2.679 -11.553 -1.528 1.00 0.00 C ATOM 1074 OE1 GLN B 361 -3.360 -12.264 -2.267 1.00 0.00 O ATOM 1075 NE2 GLN B 361 -2.646 -10.230 -1.641 1.00 0.00 N ATOM 1076 HA GLN B 361 0.508 -12.987 0.765 1.00 0.00 H ATOM 1077 HB2 GLN B 361 -0.860 -10.346 0.130 1.00 0.00 H ATOM 1078 HB3 GLN B 361 0.030 -11.331 -1.054 1.00 0.00 H ATOM 1079 HG2 GLN B 361 -1.544 -13.171 -0.723 1.00 0.00 H ATOM 1080 HG3 GLN B 361 -2.425 -12.209 0.486 1.00 0.00 H ATOM 1081 HE22 GLN B 361 -2.056 -9.667 -0.995 1.00 0.00 H ATOM 1082 HE21 GLN B 361 -3.210 -9.757 -2.376 1.00 0.00 H ATOM 1083 H GLN B 361 -1.382 -11.449 2.275 1.00 0.00 H ATOM 1084 N VAL B 362 1.550 -9.939 1.532 1.00 0.00 N ATOM 1085 CA VAL B 362 2.747 -9.115 1.667 1.00 0.00 C ATOM 1086 C VAL B 362 3.745 -9.758 2.626 1.00 0.00 C ATOM 1087 O VAL B 362 4.955 -9.624 2.456 1.00 0.00 O ATOM 1088 CB VAL B 362 2.409 -7.694 2.168 1.00 0.00 C ATOM 1089 CG1 VAL B 362 3.664 -6.837 2.240 1.00 0.00 C ATOM 1090 CG2 VAL B 362 1.369 -7.040 1.272 1.00 0.00 C ATOM 1091 HA VAL B 362 3.191 -9.039 0.675 1.00 0.00 H ATOM 1092 HB VAL B 362 1.992 -7.779 3.172 1.00 0.00 H ATOM 1093 HG11 VAL B 362 4.375 -7.294 2.928 1.00 0.00 H ATOM 1094 HG12 VAL B 362 4.111 -6.765 1.248 1.00 0.00 H ATOM 1095 HG13 VAL B 362 3.402 -5.840 2.595 1.00 0.00 H ATOM 1096 HG21 VAL B 362 1.758 -6.972 0.256 1.00 0.00 H ATOM 1097 HG22 VAL B 362 0.459 -7.640 1.275 1.00 0.00 H ATOM 1098 HG23 VAL B 362 1.147 -6.040 1.645 1.00 0.00 H ATOM 1099 H VAL B 362 0.627 -9.541 1.800 1.00 0.00 H ATOM 1100 N ALA B 363 3.227 -10.456 3.632 1.00 0.00 N ATOM 1101 CA ALA B 363 4.074 -11.122 4.615 1.00 0.00 C ATOM 1102 C ALA B 363 4.873 -12.253 3.978 1.00 0.00 C ATOM 1103 O ALA B 363 6.073 -12.389 4.215 1.00 0.00 O ATOM 1104 CB ALA B 363 3.230 -11.659 5.762 1.00 0.00 C ATOM 1105 HA ALA B 363 4.778 -10.387 5.005 1.00 0.00 H ATOM 1106 HB1 ALA B 363 2.706 -10.833 6.244 1.00 0.00 H ATOM 1107 HB2 ALA B 363 2.504 -12.374 5.374 1.00 0.00 H ATOM 1108 HB3 ALA B 363 3.877 -12.153 6.487 1.00 0.00 H ATOM 1109 H ALA B 363 2.193 -10.529 3.720 1.00 0.00 H ATOM 1110 N ARG B 364 4.198 -13.063 3.169 1.00 0.00 N ATOM 1111 CA ARG B 364 4.842 -14.188 2.500 1.00 0.00 C ATOM 1112 C ARG B 364 5.894 -13.712 1.502 1.00 0.00 C ATOM 1113 O ARG B 364 6.964 -14.310 1.385 1.00 0.00 O ATOM 1114 CB ARG B 364 3.797 -15.049 1.787 1.00 0.00 C ATOM 1115 CG ARG B 364 4.392 -16.208 1.003 1.00 0.00 C ATOM 1116 CD ARG B 364 3.313 -17.019 0.302 1.00 0.00 C ATOM 1117 NE ARG B 364 2.403 -17.657 1.250 1.00 0.00 N ATOM 1118 CZ ARG B 364 1.258 -18.236 0.899 1.00 0.00 C ATOM 1119 NH1 ARG B 364 0.882 -18.251 -0.373 1.00 0.00 N ATOM 1120 NH2 ARG B 364 0.490 -18.802 1.819 1.00 0.00 N ATOM 1121 HA ARG B 364 5.343 -14.787 3.261 1.00 0.00 H ATOM 1122 HB2 ARG B 364 3.115 -15.453 2.535 1.00 0.00 H ATOM 1123 HB3 ARG B 364 3.242 -14.415 1.096 1.00 0.00 H ATOM 1124 HG2 ARG B 364 5.081 -15.814 0.256 1.00 0.00 H ATOM 1125 HG3 ARG B 364 4.935 -16.858 1.689 1.00 0.00 H ATOM 1126 HD2 ARG B 364 3.790 -17.791 -0.302 1.00 0.00 H ATOM 1127 HD3 ARG B 364 2.739 -16.356 -0.345 1.00 0.00 H ATOM 1128 HE ARG B 364 2.665 -17.659 2.256 1.00 0.00 H ATOM 1129 HH12 ARG B 364 -0.014 -18.704 -0.645 1.00 0.00 H ATOM 1130 HH11 ARG B 364 1.483 -17.810 -1.098 1.00 0.00 H ATOM 1131 HH22 ARG B 364 -0.405 -19.254 1.543 1.00 0.00 H ATOM 1132 HH21 ARG B 364 0.782 -18.794 2.817 1.00 0.00 H ATOM 1133 H ARG B 364 3.185 -12.890 3.009 1.00 0.00 H ATOM 1134 N LEU B 365 5.587 -12.634 0.785 1.00 0.00 N ATOM 1135 CA LEU B 365 6.510 -12.091 -0.202 1.00 0.00 C ATOM 1136 C LEU B 365 7.659 -11.352 0.489 1.00 0.00 C ATOM 1137 O LEU B 365 8.782 -11.327 -0.015 1.00 0.00 O ATOM 1138 CB LEU B 365 5.749 -11.185 -1.186 1.00 0.00 C ATOM 1139 CG LEU B 365 6.236 -9.744 -1.301 1.00 0.00 C ATOM 1140 CD1 LEU B 365 7.455 -9.660 -2.208 1.00 0.00 C ATOM 1141 CD2 LEU B 365 5.124 -8.846 -1.819 1.00 0.00 C ATOM 1142 HA LEU B 365 6.951 -12.907 -0.774 1.00 0.00 H ATOM 1143 HB2 LEU B 365 5.818 -11.638 -2.175 1.00 0.00 H ATOM 1144 HB3 LEU B 365 4.705 -11.158 -0.872 1.00 0.00 H ATOM 1145 HG LEU B 365 6.524 -9.399 -0.308 1.00 0.00 H ATOM 1146 HD21 LEU B 365 4.807 -9.193 -2.803 1.00 0.00 H ATOM 1147 HD22 LEU B 365 4.280 -8.881 -1.130 1.00 0.00 H ATOM 1148 HD23 LEU B 365 5.491 -7.822 -1.894 1.00 0.00 H ATOM 1149 HD11 LEU B 365 8.257 -10.272 -1.795 1.00 0.00 H ATOM 1150 HD12 LEU B 365 7.193 -10.025 -3.201 1.00 0.00 H ATOM 1151 HD13 LEU B 365 7.785 -8.623 -2.276 1.00 0.00 H ATOM 1152 H LEU B 365 4.668 -12.169 0.933 1.00 0.00 H ATOM 1153 N PHE B 366 7.375 -10.765 1.651 1.00 0.00 N ATOM 1154 CA PHE B 366 8.396 -10.049 2.417 1.00 0.00 C ATOM 1155 C PHE B 366 8.900 -10.914 3.565 1.00 0.00 C ATOM 1156 O PHE B 366 8.314 -10.929 4.648 1.00 0.00 O ATOM 1157 CB PHE B 366 7.848 -8.725 2.968 1.00 0.00 C ATOM 1158 CG PHE B 366 7.700 -7.625 1.945 1.00 0.00 C ATOM 1159 CD1 PHE B 366 8.043 -7.827 0.616 1.00 0.00 C ATOM 1160 CD2 PHE B 366 7.206 -6.386 2.319 1.00 0.00 C ATOM 1161 CE1 PHE B 366 7.897 -6.821 -0.315 1.00 0.00 C ATOM 1162 CE2 PHE B 366 7.059 -5.372 1.391 1.00 0.00 C ATOM 1163 CZ PHE B 366 7.405 -5.590 0.071 1.00 0.00 C ATOM 1164 HA PHE B 366 9.223 -9.826 1.743 1.00 0.00 H ATOM 1165 HB2 PHE B 366 6.867 -8.918 3.402 1.00 0.00 H ATOM 1166 HB3 PHE B 366 8.526 -8.375 3.746 1.00 0.00 H ATOM 1167 HD2 PHE B 366 6.930 -6.208 3.358 1.00 0.00 H ATOM 1168 HE2 PHE B 366 6.671 -4.402 1.700 1.00 0.00 H ATOM 1169 HZ PHE B 366 7.290 -4.793 -0.663 1.00 0.00 H ATOM 1170 HE1 PHE B 366 8.170 -6.997 -1.355 1.00 0.00 H ATOM 1171 HD1 PHE B 366 8.434 -8.795 0.303 1.00 0.00 H ATOM 1172 H PHE B 366 6.405 -10.817 2.022 1.00 0.00 H ATOM 1173 N LYS B 367 9.985 -11.639 3.320 1.00 0.00 N ATOM 1174 CA LYS B 367 10.564 -12.512 4.333 1.00 0.00 C ATOM 1175 C LYS B 367 11.754 -11.842 5.014 1.00 0.00 C ATOM 1176 O LYS B 367 12.524 -11.125 4.374 1.00 0.00 O ATOM 1177 CB LYS B 367 10.995 -13.839 3.705 1.00 0.00 C ATOM 1178 CG LYS B 367 11.499 -14.857 4.715 1.00 0.00 C ATOM 1179 CD LYS B 367 11.803 -16.196 4.057 1.00 0.00 C ATOM 1180 CE LYS B 367 10.536 -16.877 3.561 1.00 0.00 C ATOM 1181 NZ LYS B 367 10.828 -18.167 2.878 1.00 0.00 N ATOM 1182 HA LYS B 367 9.803 -12.708 5.088 1.00 0.00 H ATOM 1183 HB2 LYS B 367 10.140 -14.267 3.182 1.00 0.00 H ATOM 1184 HB3 LYS B 367 11.793 -13.639 2.990 1.00 0.00 H ATOM 1185 HG2 LYS B 367 12.409 -14.475 5.178 1.00 0.00 H ATOM 1186 HG3 LYS B 367 10.737 -15.004 5.480 1.00 0.00 H ATOM 1187 HD2 LYS B 367 12.471 -16.031 3.211 1.00 0.00 H ATOM 1188 HD3 LYS B 367 12.292 -16.845 4.784 1.00 0.00 H ATOM 1189 HE2 LYS B 367 10.031 -16.213 2.859 1.00 0.00 H ATOM 1190 HE3 LYS B 367 9.883 -17.069 4.412 1.00 0.00 H ATOM 1191 HZ1 LYS B 367 11.446 -17.993 2.060 1.00 0.00 H ATOM 1192 HZ2 LYS B 367 11.304 -18.810 3.543 1.00 0.00 H ATOM 1193 HZ3 LYS B 367 9.937 -18.597 2.556 1.00 0.00 H ATOM 1194 H LYS B 367 10.432 -11.582 2.383 1.00 0.00 H ATOM 1195 N ASN B 368 11.891 -12.081 6.316 1.00 0.00 N ATOM 1196 CA ASN B 368 12.982 -11.507 7.099 1.00 0.00 C ATOM 1197 C ASN B 368 12.922 -9.980 7.092 1.00 0.00 C ATOM 1198 O ASN B 368 13.854 -9.311 7.537 1.00 0.00 O ATOM 1199 CB ASN B 368 14.333 -11.985 6.557 1.00 0.00 C ATOM 1200 CG ASN B 368 15.486 -11.624 7.472 1.00 0.00 C ATOM 1201 OD1 ASN B 368 15.327 -11.546 8.690 1.00 0.00 O ATOM 1202 ND2 ASN B 368 16.658 -11.400 6.888 1.00 0.00 N ATOM 1203 HA ASN B 368 12.872 -11.846 8.129 1.00 0.00 H ATOM 1204 HB2 ASN B 368 14.301 -13.069 6.445 1.00 0.00 H ATOM 1205 HB3 ASN B 368 14.502 -11.525 5.583 1.00 0.00 H ATOM 1206 HD22 ASN B 368 16.747 -11.477 5.855 1.00 0.00 H ATOM 1207 HD21 ASN B 368 17.486 -11.148 7.464 1.00 0.00 H ATOM 1208 H ASN B 368 11.199 -12.696 6.791 1.00 0.00 H ATOM 1209 N GLN B 369 11.816 -9.436 6.593 1.00 0.00 N ATOM 1210 CA GLN B 369 11.634 -7.989 6.531 1.00 0.00 C ATOM 1211 C GLN B 369 10.332 -7.575 7.211 1.00 0.00 C ATOM 1212 O GLN B 369 9.446 -6.995 6.583 1.00 0.00 O ATOM 1213 CB GLN B 369 11.642 -7.514 5.076 1.00 0.00 C ATOM 1214 CG GLN B 369 12.969 -7.741 4.370 1.00 0.00 C ATOM 1215 CD GLN B 369 14.101 -6.944 4.987 1.00 0.00 C ATOM 1216 OE1 GLN B 369 14.785 -7.415 5.895 1.00 0.00 O ATOM 1217 NE2 GLN B 369 14.303 -5.727 4.496 1.00 0.00 N ATOM 1218 HA GLN B 369 12.463 -7.520 7.061 1.00 0.00 H ATOM 1219 HB2 GLN B 369 10.866 -8.053 4.533 1.00 0.00 H ATOM 1220 HB3 GLN B 369 11.421 -6.447 5.060 1.00 0.00 H ATOM 1221 HG2 GLN B 369 13.217 -8.801 4.425 1.00 0.00 H ATOM 1222 HG3 GLN B 369 12.864 -7.448 3.326 1.00 0.00 H ATOM 1223 HE22 GLN B 369 13.700 -5.370 3.728 1.00 0.00 H ATOM 1224 HE21 GLN B 369 15.064 -5.131 4.880 1.00 0.00 H ATOM 1225 H GLN B 369 11.061 -10.057 6.238 1.00 0.00 H ATOM 1226 N GLU B 370 10.227 -7.878 8.501 1.00 0.00 N ATOM 1227 CA GLU B 370 9.038 -7.542 9.275 1.00 0.00 C ATOM 1228 C GLU B 370 8.955 -6.038 9.518 1.00 0.00 C ATOM 1229 O GLU B 370 7.876 -5.501 9.767 1.00 0.00 O ATOM 1230 CB GLU B 370 9.051 -8.292 10.610 1.00 0.00 C ATOM 1231 CG GLU B 370 7.862 -7.977 11.502 1.00 0.00 C ATOM 1232 CD GLU B 370 7.895 -8.743 12.810 1.00 0.00 C ATOM 1233 OE1 GLU B 370 8.709 -8.384 13.687 1.00 0.00 O ATOM 1234 OE2 GLU B 370 7.110 -9.703 12.957 1.00 0.00 O ATOM 1235 HA GLU B 370 8.160 -7.845 8.704 1.00 0.00 H ATOM 1236 HB2 GLU B 370 9.052 -9.362 10.403 1.00 0.00 H ATOM 1237 HB3 GLU B 370 9.963 -8.026 11.145 1.00 0.00 H ATOM 1238 HG2 GLU B 370 7.864 -6.909 11.722 1.00 0.00 H ATOM 1239 HG3 GLU B 370 6.947 -8.235 10.969 1.00 0.00 H ATOM 1240 H GLU B 370 11.015 -8.368 8.971 1.00 0.00 H ATOM 1241 N ASP B 371 10.098 -5.363 9.441 1.00 0.00 N ATOM 1242 CA ASP B 371 10.149 -3.921 9.651 1.00 0.00 C ATOM 1243 C ASP B 371 9.236 -3.199 8.666 1.00 0.00 C ATOM 1244 O ASP B 371 8.407 -2.379 9.059 1.00 0.00 O ATOM 1245 CB ASP B 371 11.583 -3.411 9.505 1.00 0.00 C ATOM 1246 CG ASP B 371 12.525 -4.043 10.510 1.00 0.00 C ATOM 1247 OD1 ASP B 371 12.625 -3.521 11.640 1.00 0.00 O ATOM 1248 OD2 ASP B 371 13.162 -5.062 10.168 1.00 0.00 O ATOM 1249 HA ASP B 371 9.801 -3.713 10.663 1.00 0.00 H ATOM 1250 HB2 ASP B 371 11.936 -3.642 8.500 1.00 0.00 H ATOM 1251 HB3 ASP B 371 11.588 -2.331 9.651 1.00 0.00 H ATOM 1252 H ASP B 371 10.977 -5.876 9.226 1.00 0.00 H ATOM 1253 N LEU B 372 9.395 -3.510 7.383 1.00 0.00 N ATOM 1254 CA LEU B 372 8.580 -2.896 6.342 1.00 0.00 C ATOM 1255 C LEU B 372 7.116 -3.287 6.502 1.00 0.00 C ATOM 1256 O LEU B 372 6.224 -2.443 6.410 1.00 0.00 O ATOM 1257 CB LEU B 372 9.083 -3.311 4.956 1.00 0.00 C ATOM 1258 CG LEU B 372 10.220 -2.457 4.385 1.00 0.00 C ATOM 1259 CD1 LEU B 372 11.419 -2.450 5.322 1.00 0.00 C ATOM 1260 CD2 LEU B 372 10.622 -2.964 3.008 1.00 0.00 C ATOM 1261 HA LEU B 372 8.664 -1.814 6.440 1.00 0.00 H ATOM 1262 HB2 LEU B 372 9.435 -4.340 5.020 1.00 0.00 H ATOM 1263 HB3 LEU B 372 8.243 -3.259 4.264 1.00 0.00 H ATOM 1264 HG LEU B 372 9.861 -1.432 4.289 1.00 0.00 H ATOM 1265 HD21 LEU B 372 10.958 -3.998 3.087 1.00 0.00 H ATOM 1266 HD22 LEU B 372 9.764 -2.910 2.338 1.00 0.00 H ATOM 1267 HD23 LEU B 372 11.431 -2.347 2.617 1.00 0.00 H ATOM 1268 HD11 LEU B 372 11.122 -2.039 6.287 1.00 0.00 H ATOM 1269 HD12 LEU B 372 11.780 -3.470 5.456 1.00 0.00 H ATOM 1270 HD13 LEU B 372 12.211 -1.837 4.892 1.00 0.00 H ATOM 1271 H LEU B 372 10.118 -4.208 7.116 1.00 0.00 H ATOM 1272 N LEU B 373 6.875 -4.573 6.745 1.00 0.00 N ATOM 1273 CA LEU B 373 5.518 -5.075 6.920 1.00 0.00 C ATOM 1274 C LEU B 373 4.831 -4.370 8.086 1.00 0.00 C ATOM 1275 O LEU B 373 3.617 -4.167 8.075 1.00 0.00 O ATOM 1276 CB LEU B 373 5.534 -6.589 7.155 1.00 0.00 C ATOM 1277 CG LEU B 373 4.170 -7.280 7.061 1.00 0.00 C ATOM 1278 CD1 LEU B 373 3.493 -6.961 5.737 1.00 0.00 C ATOM 1279 CD2 LEU B 373 4.325 -8.784 7.227 1.00 0.00 C ATOM 1280 HA LEU B 373 4.957 -4.867 6.009 1.00 0.00 H ATOM 1281 HB2 LEU B 373 6.192 -7.039 6.411 1.00 0.00 H ATOM 1282 HB3 LEU B 373 5.936 -6.771 8.152 1.00 0.00 H ATOM 1283 HG LEU B 373 3.540 -6.903 7.867 1.00 0.00 H ATOM 1284 HD21 LEU B 373 4.974 -9.170 6.441 1.00 0.00 H ATOM 1285 HD22 LEU B 373 4.765 -8.997 8.201 1.00 0.00 H ATOM 1286 HD23 LEU B 373 3.346 -9.259 7.157 1.00 0.00 H ATOM 1287 HD11 LEU B 373 3.348 -5.884 5.655 1.00 0.00 H ATOM 1288 HD12 LEU B 373 4.121 -7.308 4.916 1.00 0.00 H ATOM 1289 HD13 LEU B 373 2.526 -7.463 5.694 1.00 0.00 H ATOM 1290 H LEU B 373 7.674 -5.235 6.812 1.00 0.00 H ATOM 1291 N SER B 374 5.620 -3.999 9.090 1.00 0.00 N ATOM 1292 CA SER B 374 5.094 -3.310 10.262 1.00 0.00 C ATOM 1293 C SER B 374 4.679 -1.889 9.899 1.00 0.00 C ATOM 1294 O SER B 374 3.555 -1.468 10.181 1.00 0.00 O ATOM 1295 CB SER B 374 6.139 -3.285 11.378 1.00 0.00 C ATOM 1296 OG SER B 374 6.472 -4.598 11.794 1.00 0.00 O ATOM 1297 HA SER B 374 4.217 -3.851 10.617 1.00 0.00 H ATOM 1298 HB2 SER B 374 5.739 -2.732 12.228 1.00 0.00 H ATOM 1299 HB3 SER B 374 7.038 -2.788 11.013 1.00 0.00 H ATOM 1300 HG SER B 374 6.840 -5.103 11.026 1.00 0.00 H ATOM 1301 H SER B 374 6.638 -4.206 9.038 1.00 0.00 H ATOM 1302 N GLU B 375 5.594 -1.155 9.271 1.00 0.00 N ATOM 1303 CA GLU B 375 5.322 0.217 8.858 1.00 0.00 C ATOM 1304 C GLU B 375 4.094 0.265 7.956 1.00 0.00 C ATOM 1305 O GLU B 375 3.348 1.244 7.957 1.00 0.00 O ATOM 1306 CB GLU B 375 6.532 0.803 8.124 1.00 0.00 C ATOM 1307 CG GLU B 375 7.796 0.851 8.967 1.00 0.00 C ATOM 1308 CD GLU B 375 7.639 1.704 10.211 1.00 0.00 C ATOM 1309 OE1 GLU B 375 7.799 2.939 10.109 1.00 0.00 O ATOM 1310 OE2 GLU B 375 7.359 1.137 11.287 1.00 0.00 O ATOM 1311 HA GLU B 375 5.129 0.813 9.750 1.00 0.00 H ATOM 1312 HB2 GLU B 375 6.729 0.192 7.243 1.00 0.00 H ATOM 1313 HB3 GLU B 375 6.287 1.819 7.813 1.00 0.00 H ATOM 1314 HG2 GLU B 375 8.052 -0.164 9.270 1.00 0.00 H ATOM 1315 HG3 GLU B 375 8.604 1.262 8.362 1.00 0.00 H ATOM 1316 H GLU B 375 6.526 -1.570 9.070 1.00 0.00 H ATOM 1317 N PHE B 376 3.889 -0.805 7.193 1.00 0.00 N ATOM 1318 CA PHE B 376 2.749 -0.898 6.287 1.00 0.00 C ATOM 1319 C PHE B 376 1.465 -1.162 7.065 1.00 0.00 C ATOM 1320 O PHE B 376 0.412 -0.604 6.754 1.00 0.00 O ATOM 1321 CB PHE B 376 2.981 -2.008 5.259 1.00 0.00 C ATOM 1322 CG PHE B 376 1.821 -2.226 4.327 1.00 0.00 C ATOM 1323 CD1 PHE B 376 1.571 -1.341 3.290 1.00 0.00 C ATOM 1324 CD2 PHE B 376 0.984 -3.319 4.487 1.00 0.00 C ATOM 1325 CE1 PHE B 376 0.507 -1.543 2.431 1.00 0.00 C ATOM 1326 CE2 PHE B 376 -0.081 -3.526 3.631 1.00 0.00 C ATOM 1327 CZ PHE B 376 -0.320 -2.636 2.602 1.00 0.00 C ATOM 1328 HA PHE B 376 2.646 0.053 5.764 1.00 0.00 H ATOM 1329 HB2 PHE B 376 3.856 -1.748 4.664 1.00 0.00 H ATOM 1330 HB3 PHE B 376 3.171 -2.938 5.795 1.00 0.00 H ATOM 1331 HD2 PHE B 376 1.168 -4.024 5.298 1.00 0.00 H ATOM 1332 HE2 PHE B 376 -0.731 -4.390 3.768 1.00 0.00 H ATOM 1333 HZ PHE B 376 -1.160 -2.796 1.926 1.00 0.00 H ATOM 1334 HE1 PHE B 376 0.321 -0.840 1.619 1.00 0.00 H ATOM 1335 HD1 PHE B 376 2.220 -0.477 3.150 1.00 0.00 H ATOM 1336 H PHE B 376 4.560 -1.598 7.244 1.00 0.00 H ATOM 1337 N GLY B 377 1.560 -2.018 8.079 1.00 0.00 N ATOM 1338 CA GLY B 377 0.401 -2.340 8.891 1.00 0.00 C ATOM 1339 C GLY B 377 -0.090 -1.151 9.693 1.00 0.00 C ATOM 1340 O GLY B 377 -1.281 -1.043 9.985 1.00 0.00 O ATOM 1341 HA3 GLY B 377 0.667 -3.142 9.580 1.00 0.00 H ATOM 1342 HA2 GLY B 377 -0.403 -2.677 8.237 1.00 0.00 H ATOM 1343 H GLY B 377 2.476 -2.462 8.292 1.00 0.00 H ATOM 1344 N GLN B 378 0.829 -0.259 10.052 1.00 0.00 N ATOM 1345 CA GLN B 378 0.480 0.929 10.824 1.00 0.00 C ATOM 1346 C GLN B 378 -0.556 1.772 10.088 1.00 0.00 C ATOM 1347 O GLN B 378 -1.424 2.385 10.710 1.00 0.00 O ATOM 1348 CB GLN B 378 1.727 1.768 11.107 1.00 0.00 C ATOM 1349 CG GLN B 378 2.721 1.086 12.033 1.00 0.00 C ATOM 1350 CD GLN B 378 3.905 1.970 12.378 1.00 0.00 C ATOM 1351 OE1 GLN B 378 5.012 1.482 12.607 1.00 0.00 O ATOM 1352 NE2 GLN B 378 3.677 3.279 12.421 1.00 0.00 N ATOM 1353 HA GLN B 378 0.050 0.600 11.770 1.00 0.00 H ATOM 1354 HB2 GLN B 378 2.225 1.977 10.160 1.00 0.00 H ATOM 1355 HB3 GLN B 378 1.415 2.706 11.566 1.00 0.00 H ATOM 1356 HG2 GLN B 378 2.208 0.814 12.956 1.00 0.00 H ATOM 1357 HG3 GLN B 378 3.090 0.184 11.545 1.00 0.00 H ATOM 1358 HE22 GLN B 378 2.726 3.648 12.220 1.00 0.00 H ATOM 1359 HE21 GLN B 378 4.450 3.934 12.655 1.00 0.00 H ATOM 1360 H GLN B 378 1.820 -0.412 9.776 1.00 0.00 H ATOM 1361 N PHE B 379 -0.460 1.797 8.762 1.00 0.00 N ATOM 1362 CA PHE B 379 -1.393 2.563 7.942 1.00 0.00 C ATOM 1363 C PHE B 379 -2.811 2.024 8.090 1.00 0.00 C ATOM 1364 O PHE B 379 -3.782 2.778 8.031 1.00 0.00 O ATOM 1365 CB PHE B 379 -0.970 2.520 6.472 1.00 0.00 C ATOM 1366 CG PHE B 379 0.363 3.163 6.208 1.00 0.00 C ATOM 1367 CD1 PHE B 379 0.535 4.528 6.380 1.00 0.00 C ATOM 1368 CD2 PHE B 379 1.442 2.404 5.786 1.00 0.00 C ATOM 1369 CE1 PHE B 379 1.758 5.122 6.138 1.00 0.00 C ATOM 1370 CE2 PHE B 379 2.668 2.993 5.541 1.00 0.00 C ATOM 1371 CZ PHE B 379 2.826 4.353 5.718 1.00 0.00 C ATOM 1372 HA PHE B 379 -1.376 3.597 8.286 1.00 0.00 H ATOM 1373 HB2 PHE B 379 -0.917 1.477 6.159 1.00 0.00 H ATOM 1374 HB3 PHE B 379 -1.725 3.038 5.881 1.00 0.00 H ATOM 1375 HD2 PHE B 379 1.323 1.330 5.645 1.00 0.00 H ATOM 1376 HE2 PHE B 379 3.509 2.385 5.208 1.00 0.00 H ATOM 1377 HZ PHE B 379 3.792 4.819 5.527 1.00 0.00 H ATOM 1378 HE1 PHE B 379 1.880 6.196 6.278 1.00 0.00 H ATOM 1379 HD1 PHE B 379 -0.305 5.139 6.710 1.00 0.00 H ATOM 1380 H PHE B 379 0.298 1.258 8.298 1.00 0.00 H ATOM 1381 N LEU B 380 -2.922 0.714 8.284 1.00 0.00 N ATOM 1382 CA LEU B 380 -4.220 0.071 8.441 1.00 0.00 C ATOM 1383 C LEU B 380 -4.875 0.483 9.761 1.00 0.00 C ATOM 1384 O LEU B 380 -4.236 0.435 10.813 1.00 0.00 O ATOM 1385 CB LEU B 380 -4.062 -1.451 8.392 1.00 0.00 C ATOM 1386 CG LEU B 380 -3.409 -1.999 7.122 1.00 0.00 C ATOM 1387 CD1 LEU B 380 -3.100 -3.480 7.280 1.00 0.00 C ATOM 1388 CD2 LEU B 380 -4.308 -1.768 5.916 1.00 0.00 C ATOM 1389 HA LEU B 380 -4.862 0.393 7.621 1.00 0.00 H ATOM 1390 HB2 LEU B 380 -3.452 -1.754 9.243 1.00 0.00 H ATOM 1391 HB3 LEU B 380 -5.053 -1.896 8.480 1.00 0.00 H ATOM 1392 HG LEU B 380 -2.472 -1.466 6.959 1.00 0.00 H ATOM 1393 HD21 LEU B 380 -5.260 -2.275 6.072 1.00 0.00 H ATOM 1394 HD22 LEU B 380 -4.480 -0.699 5.792 1.00 0.00 H ATOM 1395 HD23 LEU B 380 -3.825 -2.165 5.023 1.00 0.00 H ATOM 1396 HD11 LEU B 380 -2.418 -3.620 8.119 1.00 0.00 H ATOM 1397 HD12 LEU B 380 -4.025 -4.025 7.467 1.00 0.00 H ATOM 1398 HD13 LEU B 380 -2.636 -3.852 6.367 1.00 0.00 H ATOM 1399 H LEU B 380 -2.060 0.133 8.325 1.00 0.00 H ATOM 1400 N PRO B 381 -6.160 0.894 9.729 1.00 0.00 N ATOM 1401 CA PRO B 381 -6.884 1.309 10.937 1.00 0.00 C ATOM 1402 C PRO B 381 -7.178 0.136 11.866 1.00 0.00 C ATOM 1403 O PRO B 381 -6.724 -0.984 11.629 1.00 0.00 O ATOM 1404 CB PRO B 381 -8.187 1.897 10.388 1.00 0.00 C ATOM 1405 CG PRO B 381 -8.382 1.223 9.075 1.00 0.00 C ATOM 1406 CD PRO B 381 -7.004 0.990 8.521 1.00 0.00 C ATOM 1407 HA PRO B 381 -6.306 2.011 11.538 1.00 0.00 H ATOM 1408 HD3 PRO B 381 -6.966 0.066 7.944 1.00 0.00 H ATOM 1409 HD2 PRO B 381 -6.691 1.823 7.891 1.00 0.00 H ATOM 1410 HG3 PRO B 381 -8.958 1.860 8.404 1.00 0.00 H ATOM 1411 HG2 PRO B 381 -8.902 0.275 9.209 1.00 0.00 H ATOM 1412 HB2 PRO B 381 -9.019 1.681 11.058 1.00 0.00 H ATOM 1413 HB3 PRO B 381 -8.097 2.975 10.257 1.00 0.00 H ATOM 1414 N ASP B 382 -7.943 0.398 12.922 1.00 0.00 N ATOM 1415 CA ASP B 382 -8.295 -0.637 13.887 1.00 0.00 C ATOM 1416 C ASP B 382 -9.361 -1.570 13.321 1.00 0.00 C ATOM 1417 O ASP B 382 -10.558 -1.328 13.474 1.00 0.00 O ATOM 1418 CB ASP B 382 -8.790 -0.007 15.190 1.00 0.00 C ATOM 1419 CG ASP B 382 -9.172 -1.047 16.225 1.00 0.00 C ATOM 1420 OD1 ASP B 382 -8.283 -1.481 16.987 1.00 0.00 O ATOM 1421 OD2 ASP B 382 -10.361 -1.427 16.273 1.00 0.00 O ATOM 1422 HA ASP B 382 -7.399 -1.222 14.095 1.00 0.00 H ATOM 1423 HB2 ASP B 382 -7.998 0.620 15.599 1.00 0.00 H ATOM 1424 HB3 ASP B 382 -9.663 0.608 14.972 1.00 0.00 H ATOM 1425 H ASP B 382 -8.299 1.365 13.063 1.00 0.00 H ATOM 1426 N ALA B 383 -8.915 -2.633 12.661 1.00 0.00 N ATOM 1427 CA ALA B 383 -9.825 -3.607 12.072 1.00 0.00 C ATOM 1428 C ALA B 383 -9.943 -4.848 12.950 1.00 0.00 C ATOM 1429 O ALA B 383 -10.855 -4.883 13.804 1.00 0.00 O ATOM 1430 CB ALA B 383 -9.358 -3.987 10.675 1.00 0.00 C ATOM 1431 HA ALA B 383 -10.812 -3.150 12.001 1.00 0.00 H ATOM 1432 OXT ALA B 383 -9.124 -5.775 12.778 1.00 0.00 O ATOM 1433 HB1 ALA B 383 -9.333 -3.097 10.047 1.00 0.00 H ATOM 1434 HB2 ALA B 383 -8.360 -4.421 10.732 1.00 0.00 H ATOM 1435 HB3 ALA B 383 -10.048 -4.715 10.248 1.00 0.00 H ATOM 1436 H ALA B 383 -7.889 -2.774 12.562 1.00 0.00 H TER 1437 ALA B 383 HETATM 1438 N ARG A 1 -9.595 8.976 3.687 1.00 0.24 N HETATM 1439 CA ARG A 1 -9.025 7.608 3.566 1.00 0.07 C HETATM 1440 C ARG A 1 -7.500 7.653 3.539 1.00 0.23 C HETATM 1441 O ARG A 1 -6.901 8.190 2.607 1.00 -0.39 O HETATM 1442 N ARG A 1 -6.880 7.082 4.567 1.00 -0.26 N HETATM 1443 CA ARG A 1 -5.424 7.053 4.667 1.00 0.13 C HETATM 1444 C ARG A 1 -4.935 5.679 5.118 1.00 0.20 C HETATM 1445 O ARG A 1 -4.948 5.364 6.307 1.00 -0.39 O HETATM 1446 N ARG A 1 -4.504 4.862 4.159 1.00 -0.26 N HETATM 1447 CA ARG A 1 -4.018 3.520 4.463 1.00 0.15 C HETATM 1448 C ARG A 1 -3.357 2.879 3.244 1.00 0.21 C HETATM 1449 O ARG A 1 -2.253 2.342 3.337 1.00 -0.39 O HETATM 1450 N ARG A 1 -4.040 2.939 2.105 1.00 -0.26 N HETATM 1451 CA ARG A 1 -3.520 2.361 0.870 1.00 0.13 C HETATM 1452 C ARG A 1 -3.516 3.387 -0.260 1.00 0.20 C HETATM 1453 O ARG A 1 -2.534 3.513 -0.991 1.00 -0.39 O HETATM 1454 N ARG A 1 -4.620 4.118 -0.396 1.00 -0.26 N HETATM 1455 CA ARG A 1 -4.741 5.133 -1.438 1.00 0.13 C HETATM 1456 C ARG A 1 -3.606 6.149 -1.342 1.00 0.20 C HETATM 1457 O ARG A 1 -3.132 6.667 -2.356 1.00 -0.39 O HETATM 1458 N ARG A 1 -3.172 6.425 -0.116 1.00 -0.26 N HETATM 1459 CA ARG A 1 -2.093 7.376 0.119 1.00 0.13 C HETATM 1460 C ARG A 1 -0.797 6.896 -0.527 1.00 0.20 C HETATM 1461 O ARG A 1 -0.182 7.612 -1.320 1.00 -0.39 O HETATM 1462 N ARG A 1 -0.389 5.677 -0.185 1.00 -0.26 N HETATM 1463 CA ARG A 1 0.834 5.102 -0.729 1.00 0.13 C HETATM 1464 C ARG A 1 0.736 4.956 -2.244 1.00 0.20 C HETATM 1465 O ARG A 1 1.745 5.007 -2.948 1.00 -0.39 O HETATM 1466 N ARG A 1 -0.484 4.774 -2.741 1.00 -0.26 N HETATM 1467 CA ARG A 1 -0.711 4.625 -4.174 1.00 0.13 C HETATM 1468 C ARG A 1 -0.338 5.903 -4.919 1.00 0.20 C HETATM 1469 O ARG A 1 0.438 5.870 -5.875 1.00 -0.39 O HETATM 1470 N ARG A 1 -0.895 7.026 -4.476 1.00 -0.26 N HETATM 1471 CA ARG A 1 -0.615 8.315 -5.101 1.00 0.13 C HETATM 1472 C ARG A 1 0.862 8.671 -4.973 1.00 0.20 C HETATM 1473 O ARG A 1 1.457 9.234 -5.893 1.00 -0.39 O HETATM 1474 N ARG A 1 1.448 8.340 -3.826 1.00 -0.26 N HETATM 1475 CA ARG A 1 2.857 8.622 -3.576 1.00 0.13 C HETATM 1476 C ARG A 1 3.745 7.937 -4.610 1.00 0.20 C HETATM 1477 O ARG A 1 4.617 8.567 -5.211 1.00 -0.39 O HETATM 1478 N ARG A 1 3.516 6.642 -4.812 1.00 -0.26 N HETATM 1479 CA ARG A 1 4.294 5.867 -5.772 1.00 0.13 C HETATM 1480 C ARG A 1 4.077 6.373 -7.194 1.00 0.20 C HETATM 1481 O ARG A 1 5.021 6.472 -7.977 1.00 -0.39 O HETATM 1482 N ARG A 1 2.828 6.692 -7.522 1.00 -0.26 N HETATM 1483 CA ARG A 1 2.490 7.187 -8.852 1.00 0.14 C HETATM 1484 C ARG A 1 3.115 8.556 -9.091 1.00 0.21 C HETATM 1485 O ARG A 1 3.360 8.950 -10.231 1.00 -0.39 O HETATM 1486 N ARG A 1 3.369 9.275 -8.003 1.00 -0.26 N HETATM 1487 CA ARG A 1 3.970 10.601 -8.080 1.00 0.14 C HETATM 1488 C ARG A 1 5.456 10.504 -8.417 1.00 0.21 C HETATM 1489 O ARG A 1 5.911 11.049 -9.423 1.00 -0.39 O HETATM 1490 N ARG A 1 6.205 9.809 -7.566 1.00 -0.26 N HETATM 1491 CA ARG A 1 7.641 9.640 -7.767 1.00 0.13 C HETATM 1492 C ARG A 1 7.928 8.967 -9.104 1.00 0.20 C HETATM 1493 O ARG A 1 8.876 9.328 -9.803 1.00 -0.39 O HETATM 1494 N ARG A 1 7.103 7.986 -9.450 1.00 -0.26 N HETATM 1495 CA ARG A 1 7.263 7.255 -10.703 1.00 0.13 C HETATM 1496 C ARG A 1 7.086 8.181 -11.904 1.00 0.20 C HETATM 1497 O ARG A 1 7.993 8.330 -12.723 1.00 -0.39 O HETATM 1498 N ARG A 1 5.913 8.799 -12.002 1.00 -0.27 N HETATM 1499 CA ARG A 1 5.617 9.711 -13.102 1.00 0.09 C HETATM 1500 C ARG A 1 4.546 10.719 -12.696 1.00 0.06 C HETATM 1501 O ARG A 1 3.348 10.407 -12.859 1.00 -0.57 O HETATM 1502 OXT ARG A 1 4.916 11.813 -12.220 1.00 -0.57 O HETATM 1503 CB ARG A 1 5.159 8.926 -14.334 1.00 -0.01 C HETATM 1504 CG ARG A 1 4.934 9.793 -15.563 1.00 -0.02 C HETATM 1505 CD ARG A 1 4.477 8.963 -16.752 1.00 0.06 C HETATM 1506 NE ARG A 1 5.450 7.932 -17.105 1.00 -0.27 N HETATM 1507 CZ ARG A 1 5.274 7.055 -18.089 1.00 0.29 C HETATM 1508 NH1 ARG A 1 4.164 7.080 -18.818 1.00 -0.28 N HETATM 1509 H136 ARG A 1 4.032 6.399 -19.579 1.00 0.26 H HETATM 1510 H137 ARG A 1 3.435 7.781 -18.622 1.00 0.26 H HETATM 1511 NH2 ARG A 1 6.207 6.147 -18.343 1.00 -0.28 N HETATM 1512 H138 ARG A 1 7.069 6.124 -17.780 1.00 0.26 H HETATM 1513 H139 ARG A 1 6.069 5.465 -19.103 1.00 0.26 H HETATM 1514 H135 ARG A 1 6.323 7.881 -16.560 1.00 0.26 H HETATM 1515 H133 ARG A 1 4.335 9.628 -17.616 1.00 0.07 H HETATM 1516 H134 ARG A 1 3.522 8.479 -16.501 1.00 0.07 H HETATM 1517 H131 ARG A 1 5.876 10.299 -15.821 1.00 0.03 H HETATM 1518 H132 ARG A 1 4.164 10.545 -15.335 1.00 0.03 H HETATM 1519 H129 ARG A 1 4.215 8.417 -14.090 1.00 0.03 H HETATM 1520 H130 ARG A 1 5.928 8.177 -14.574 1.00 0.03 H HETATM 1521 H128 ARG A 1 6.535 10.260 -13.357 1.00 0.07 H HETATM 1522 H127 ARG A 1 5.216 8.635 -11.304 1.00 0.19 H HETATM 1523 CB ARG A 1 6.259 6.102 -10.776 1.00 -0.00 C HETATM 1524 CG ARG A 1 6.397 5.251 -12.028 1.00 0.00 C HETATM 1525 CD ARG A 1 5.457 4.061 -12.031 1.00 0.04 C HETATM 1526 OE1 ARG A 1 4.280 4.236 -12.410 1.00 -0.57 O HETATM 1527 OE2 ARG A 1 5.898 2.956 -11.652 1.00 -0.57 O HETATM 1528 H125 ARG A 1 7.432 4.883 -12.091 1.00 0.04 H HETATM 1529 H126 ARG A 1 6.176 5.877 -12.905 1.00 0.04 H HETATM 1530 H123 ARG A 1 5.243 6.524 -10.753 1.00 0.03 H HETATM 1531 H124 ARG A 1 6.408 5.456 -9.899 1.00 0.03 H HETATM 1532 H122 ARG A 1 8.280 6.837 -10.733 1.00 0.08 H HETATM 1533 H121 ARG A 1 6.352 7.742 -8.836 1.00 0.19 H HETATM 1534 CB ARG A 1 8.236 8.806 -6.631 1.00 -0.01 C HETATM 1535 CG ARG A 1 7.867 9.274 -5.225 1.00 -0.04 C HETATM 1536 CD1 ARG A 1 8.301 8.249 -4.189 1.00 -0.06 C HETATM 1537 H115 ARG A 1 8.027 8.604 -3.185 1.00 0.02 H HETATM 1538 H116 ARG A 1 9.391 8.111 -4.244 1.00 0.02 H HETATM 1539 H117 ARG A 1 7.799 7.291 -4.389 1.00 0.02 H HETATM 1540 CD2 ARG A 1 8.495 10.629 -4.930 1.00 -0.06 C HETATM 1541 H118 ARG A 1 8.170 11.357 -5.688 1.00 0.02 H HETATM 1542 H119 ARG A 1 9.591 10.538 -4.955 1.00 0.02 H HETATM 1543 H120 ARG A 1 8.178 10.971 -3.934 1.00 0.02 H HETATM 1544 H114 ARG A 1 6.773 9.380 -5.171 1.00 0.03 H HETATM 1545 H112 ARG A 1 9.332 8.835 -6.724 1.00 0.03 H HETATM 1546 H113 ARG A 1 7.886 7.770 -6.749 1.00 0.03 H HETATM 1547 H111 ARG A 1 8.115 10.633 -7.764 1.00 0.08 H HETATM 1548 H110 ARG A 1 5.773 9.391 -6.767 1.00 0.19 H HETATM 1549 CB ARG A 1 3.775 11.341 -6.753 1.00 0.02 C HETATM 1550 CG ARG A 1 4.510 12.661 -6.670 1.00 -0.05 C HETATM 1551 CD1 ARG A 1 3.925 13.837 -7.124 1.00 -0.07 C HETATM 1552 CE1 ARG A 1 4.596 15.043 -7.046 1.00 -0.04 C HETATM 1553 CZ ARG A 1 5.865 15.085 -6.510 1.00 0.08 C HETATM 1554 CE2 ARG A 1 6.466 13.932 -6.053 1.00 -0.04 C HETATM 1555 CD2 ARG A 1 5.790 12.730 -6.134 1.00 -0.07 C HETATM 1556 H106 ARG A 1 6.266 11.825 -5.773 1.00 0.05 H HETATM 1557 H108 ARG A 1 7.464 13.968 -5.632 1.00 0.05 H HETATM 1558 OH ARG A 1 6.536 16.283 -6.430 1.00 -0.34 O HETATM 1559 H109 ARG A 1 5.990 16.975 -6.784 1.00 0.25 H HETATM 1560 H107 ARG A 1 4.126 15.952 -7.405 1.00 0.05 H HETATM 1561 H105 ARG A 1 2.927 13.808 -7.546 1.00 0.05 H HETATM 1562 H103 ARG A 1 4.135 10.693 -5.940 1.00 0.05 H HETATM 1563 H104 ARG A 1 2.700 11.535 -6.620 1.00 0.05 H HETATM 1564 H102 ARG A 1 3.467 11.168 -8.877 1.00 0.08 H HETATM 1565 H101 ARG A 1 3.142 8.896 -7.106 1.00 0.19 H HETATM 1566 CB ARG A 1 0.972 7.270 -9.022 1.00 0.04 C HETATM 1567 CG ARG A 1 0.571 7.711 -10.416 1.00 0.04 C HETATM 1568 OD1 ARG A 1 0.445 8.934 -10.639 1.00 -0.57 O HETATM 1569 OD2 ARG A 1 0.380 6.834 -11.284 1.00 -0.57 O HETATM 1570 H99 ARG A 1 0.574 7.993 -8.294 1.00 0.05 H HETATM 1571 H100 ARG A 1 0.540 6.277 -8.827 1.00 0.05 H HETATM 1572 H98 ARG A 1 2.889 6.484 -9.598 1.00 0.08 H HETATM 1573 H97 ARG A 1 2.103 6.590 -6.840 1.00 0.19 H HETATM 1574 CB ARG A 1 3.936 4.392 -5.675 1.00 -0.02 C HETATM 1575 H94 ARG A 1 4.530 3.822 -6.404 1.00 0.03 H HETATM 1576 H95 ARG A 1 2.865 4.260 -5.891 1.00 0.03 H HETATM 1577 H96 ARG A 1 4.153 4.028 -4.660 1.00 0.03 H HETATM 1578 H93 ARG A 1 5.359 5.982 -5.524 1.00 0.08 H HETATM 1579 H92 ARG A 1 2.792 6.188 -4.292 1.00 0.19 H HETATM 1580 CB ARG A 1 3.242 8.181 -2.172 1.00 -0.02 C HETATM 1581 H89 ARG A 1 4.306 8.400 -1.998 1.00 0.03 H HETATM 1582 H90 ARG A 1 3.068 7.100 -2.067 1.00 0.03 H HETATM 1583 H91 ARG A 1 2.631 8.725 -1.436 1.00 0.03 H HETATM 1584 H88 ARG A 1 3.011 9.708 -3.654 1.00 0.08 H HETATM 1585 H87 ARG A 1 0.909 7.886 -3.117 1.00 0.19 H HETATM 1586 CB ARG A 1 -1.471 9.413 -4.468 1.00 -0.00 C HETATM 1587 CG ARG A 1 -2.965 9.192 -4.633 1.00 0.00 C HETATM 1588 CD ARG A 1 -3.380 9.083 -6.087 1.00 0.04 C HETATM 1589 OE1 ARG A 1 -3.595 10.136 -6.724 1.00 -0.57 O HETATM 1590 OE2 ARG A 1 -3.489 7.945 -6.590 1.00 -0.57 O HETATM 1591 H85 ARG A 1 -3.499 10.038 -4.176 1.00 0.04 H HETATM 1592 H86 ARG A 1 -3.243 8.261 -4.116 1.00 0.04 H HETATM 1593 H83 ARG A 1 -1.208 10.373 -4.937 1.00 0.03 H HETATM 1594 H84 ARG A 1 -1.243 9.455 -3.393 1.00 0.03 H HETATM 1595 H82 ARG A 1 -0.867 8.245 -6.170 1.00 0.08 H HETATM 1596 H81 ARG A 1 -1.520 6.987 -3.697 1.00 0.19 H HETATM 1597 CB ARG A 1 -2.172 4.266 -4.454 1.00 -0.01 C HETATM 1598 CG ARG A 1 -2.572 2.832 -4.097 1.00 -0.04 C HETATM 1599 CD1 ARG A 1 -4.069 2.637 -4.276 1.00 -0.06 C HETATM 1600 H75 ARG A 1 -4.338 1.603 -4.015 1.00 0.02 H HETATM 1601 H76 ARG A 1 -4.342 2.834 -5.323 1.00 0.02 H HETATM 1602 H77 ARG A 1 -4.611 3.333 -3.619 1.00 0.02 H HETATM 1603 CD2 ARG A 1 -1.801 1.831 -4.948 1.00 -0.06 C HETATM 1604 H78 ARG A 1 -0.721 1.985 -4.807 1.00 0.02 H HETATM 1605 H79 ARG A 1 -2.057 1.977 -6.008 1.00 0.02 H HETATM 1606 H80 ARG A 1 -2.068 0.808 -4.643 1.00 0.02 H HETATM 1607 H74 ARG A 1 -2.322 2.655 -3.041 1.00 0.03 H HETATM 1608 H72 ARG A 1 -2.359 4.414 -5.528 1.00 0.03 H HETATM 1609 H73 ARG A 1 -2.808 4.951 -3.874 1.00 0.03 H HETATM 1610 H71 ARG A 1 -0.073 3.808 -4.542 1.00 0.08 H HETATM 1611 H70 ARG A 1 -1.265 4.738 -2.117 1.00 0.19 H HETATM 1612 CB ARG A 1 1.115 3.740 -0.088 1.00 -0.01 C HETATM 1613 CG ARG A 1 1.106 3.723 1.443 1.00 -0.04 C HETATM 1614 CD1 ARG A 1 1.268 2.303 1.962 1.00 -0.06 C HETATM 1615 H64 ARG A 1 1.259 2.311 3.062 1.00 0.02 H HETATM 1616 H65 ARG A 1 2.223 1.889 1.606 1.00 0.02 H HETATM 1617 H66 ARG A 1 0.439 1.681 1.593 1.00 0.02 H HETATM 1618 CD2 ARG A 1 2.204 4.621 1.994 1.00 -0.06 C HETATM 1619 H67 ARG A 1 2.070 5.642 1.608 1.00 0.02 H HETATM 1620 H68 ARG A 1 3.185 4.236 1.679 1.00 0.02 H HETATM 1621 H69 ARG A 1 2.150 4.634 3.093 1.00 0.02 H HETATM 1622 H63 ARG A 1 0.136 4.110 1.788 1.00 0.03 H HETATM 1623 H61 ARG A 1 2.106 3.404 -0.426 1.00 0.03 H HETATM 1624 H62 ARG A 1 0.348 3.034 -0.440 1.00 0.03 H HETATM 1625 H60 ARG A 1 1.670 5.778 -0.496 1.00 0.08 H HETATM 1626 H59 ARG A 1 -0.935 5.143 0.461 1.00 0.19 H HETATM 1627 CB ARG A 1 -1.888 7.580 1.622 1.00 -0.00 C HETATM 1628 CG ARG A 1 -0.738 8.518 1.958 1.00 -0.00 C HETATM 1629 SD ARG A 1 -0.535 8.760 3.733 1.00 -0.16 S HETATM 1630 CE ARG A 1 -2.090 9.544 4.145 1.00 -0.02 C HETATM 1631 H56 ARG A 1 -2.118 9.760 5.223 1.00 0.03 H HETATM 1632 H57 ARG A 1 -2.920 8.871 3.884 1.00 0.03 H HETATM 1633 H58 ARG A 1 -2.188 10.483 3.581 1.00 0.03 H HETATM 1634 H54 ARG A 1 -0.931 9.494 1.489 1.00 0.04 H HETATM 1635 H55 ARG A 1 0.192 8.094 1.552 1.00 0.04 H HETATM 1636 H52 ARG A 1 -1.684 6.601 2.081 1.00 0.03 H HETATM 1637 H53 ARG A 1 -2.813 7.998 2.046 1.00 0.03 H HETATM 1638 H51 ARG A 1 -2.372 8.340 -0.332 1.00 0.08 H HETATM 1639 H50 ARG A 1 -3.597 5.968 0.665 1.00 0.19 H HETATM 1640 CB ARG A 1 -6.092 5.845 -1.332 1.00 0.00 C HETATM 1641 CG ARG A 1 -6.339 6.855 -2.442 1.00 0.04 C HETATM 1642 CD ARG A 1 -7.706 7.505 -2.349 1.00 0.17 C HETATM 1643 OE1 ARG A 1 -8.259 7.662 -1.261 1.00 -0.40 O HETATM 1644 NE2 ARG A 1 -8.258 7.887 -3.495 1.00 -0.30 N HETATM 1645 H48 ARG A 1 -9.159 8.322 -3.496 1.00 0.18 H HETATM 1646 H49 ARG A 1 -7.773 7.740 -4.357 1.00 0.18 H HETATM 1647 H46 ARG A 1 -6.260 6.340 -3.411 1.00 0.05 H HETATM 1648 H47 ARG A 1 -5.571 7.640 -2.380 1.00 0.05 H HETATM 1649 H44 ARG A 1 -6.132 6.372 -0.367 1.00 0.03 H HETATM 1650 H45 ARG A 1 -6.888 5.087 -1.369 1.00 0.03 H HETATM 1651 H43 ARG A 1 -4.682 4.635 -2.417 1.00 0.08 H HETATM 1652 H42 ARG A 1 -5.385 3.968 0.231 1.00 0.19 H HETATM 1653 CB ARG A 1 -4.345 1.130 0.436 1.00 -0.00 C HETATM 1654 CG1 ARG A 1 -4.331 0.058 1.532 1.00 -0.05 C HETATM 1655 CD1 ARG A 1 -2.949 -0.473 1.854 1.00 -0.06 C HETATM 1656 H39 ARG A 1 -3.024 -1.234 2.645 1.00 0.02 H HETATM 1657 H40 ARG A 1 -2.310 0.353 2.199 1.00 0.02 H HETATM 1658 H41 ARG A 1 -2.510 -0.924 0.952 1.00 0.02 H HETATM 1659 H34 ARG A 1 -4.957 -0.784 1.201 1.00 0.03 H HETATM 1660 H35 ARG A 1 -4.757 0.494 2.448 1.00 0.03 H HETATM 1661 CG2 ARG A 1 -3.814 0.564 -0.874 1.00 -0.06 C HETATM 1662 H36 ARG A 1 -3.832 1.347 -1.646 1.00 0.02 H HETATM 1663 H37 ARG A 1 -4.445 -0.279 -1.192 1.00 0.02 H HETATM 1664 H38 ARG A 1 -2.781 0.215 -0.731 1.00 0.02 H HETATM 1665 H33 ARG A 1 -5.386 1.449 0.278 1.00 0.03 H HETATM 1666 H32 ARG A 1 -2.484 2.039 1.053 1.00 0.08 H HETATM 1667 H31 ARG A 1 -4.932 3.391 2.094 1.00 0.19 H HETATM 1668 CB ARG A 1 -5.173 2.647 4.953 1.00 0.08 C HETATM 1669 CG ARG A 1 -6.313 2.591 3.956 1.00 0.18 C HETATM 1670 OD1 ARG A 1 -6.476 1.607 3.234 1.00 -0.40 O HETATM 1671 ND2 ARG A 1 -7.099 3.659 3.898 1.00 -0.30 N HETATM 1672 H29 ARG A 1 -7.868 3.680 3.259 1.00 0.18 H HETATM 1673 H30 ARG A 1 -6.922 4.443 4.493 1.00 0.18 H HETATM 1674 H27 ARG A 1 -5.551 3.059 5.900 1.00 0.06 H HETATM 1675 H28 ARG A 1 -4.799 1.626 5.121 1.00 0.06 H HETATM 1676 H26 ARG A 1 -3.269 3.595 5.265 1.00 0.08 H HETATM 1677 H25 ARG A 1 -4.514 5.175 3.209 1.00 0.19 H HETATM 1678 CB ARG A 1 -4.934 8.134 5.636 1.00 -0.00 C HETATM 1679 CG ARG A 1 -5.997 8.617 6.613 1.00 -0.00 C HETATM 1680 SD ARG A 1 -6.489 7.348 7.797 1.00 -0.16 S HETATM 1681 CE ARG A 1 -4.991 7.185 8.767 1.00 -0.02 C HETATM 1682 H22 ARG A 1 -5.142 6.427 9.550 1.00 0.03 H HETATM 1683 H23 ARG A 1 -4.750 8.151 9.234 1.00 0.03 H HETATM 1684 H24 ARG A 1 -4.162 6.877 8.113 1.00 0.03 H HETATM 1685 H20 ARG A 1 -6.884 8.927 6.042 1.00 0.04 H HETATM 1686 H21 ARG A 1 -5.598 9.479 7.168 1.00 0.04 H HETATM 1687 H18 ARG A 1 -4.588 8.996 5.047 1.00 0.03 H HETATM 1688 H19 ARG A 1 -4.093 7.724 6.215 1.00 0.03 H HETATM 1689 H17 ARG A 1 -5.004 7.261 3.672 1.00 0.08 H HETATM 1690 H16 ARG A 1 -7.426 6.661 5.291 1.00 0.19 H HETATM 1691 CB ARG A 1 -9.547 6.929 2.297 1.00 0.01 C HETATM 1692 CG ARG A 1 -9.029 5.514 2.107 1.00 -0.01 C HETATM 1693 CD ARG A 1 -9.641 4.858 0.882 1.00 0.06 C HETATM 1694 NE ARG A 1 -11.091 4.731 1.000 1.00 -0.27 N HETATM 1695 CZ ARG A 1 -11.858 4.150 0.082 1.00 0.29 C HETATM 1696 NH1 ARG A 1 -11.316 3.640 -1.015 1.00 -0.28 N HETATM 1697 H12 ARG A 1 -11.913 3.191 -1.724 1.00 0.26 H HETATM 1698 H13 ARG A 1 -10.297 3.693 -1.159 1.00 0.26 H HETATM 1699 NH2 ARG A 1 -13.170 4.078 0.263 1.00 -0.28 N HETATM 1700 H14 ARG A 1 -13.595 4.473 1.114 1.00 0.26 H HETATM 1701 H15 ARG A 1 -13.764 3.627 -0.448 1.00 0.26 H HETATM 1702 H11 ARG A 1 -11.545 5.113 1.842 1.00 0.26 H HETATM 1703 H9 ARG A 1 -9.205 3.856 0.760 1.00 0.07 H HETATM 1704 H10 ARG A 1 -9.408 5.469 -0.003 1.00 0.07 H HETATM 1705 H7 ARG A 1 -9.283 4.918 2.996 1.00 0.03 H HETATM 1706 H8 ARG A 1 -7.936 5.546 1.987 1.00 0.03 H HETATM 1707 H5 ARG A 1 -9.240 7.531 1.429 1.00 0.03 H HETATM 1708 H6 ARG A 1 -10.645 6.893 2.348 1.00 0.03 H HETATM 1709 H4 ARG A 1 -9.343 7.019 4.439 1.00 0.11 H HETATM 1710 H1 ARG A 1 -10.601 8.921 3.703 1.00 0.20 H HETATM 1711 H2 ARG A 1 -9.302 9.533 2.900 1.00 0.20 H HETATM 1712 H3 ARG A 1 -9.269 9.402 4.540 1.00 0.20 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1438 1439 1710 1711 1712 CONECT 1439 1438 1440 1691 1709 CONECT 1440 1439 1441 1442 CONECT 1441 1440 CONECT 1442 1440 1443 1690 CONECT 1443 1442 1444 1678 1689 CONECT 1444 1443 1445 1446 CONECT 1445 1444 CONECT 1446 1444 1447 1677 CONECT 1447 1446 1448 1668 1676 CONECT 1448 1447 1449 1450 CONECT 1449 1448 CONECT 1450 1448 1451 1667 CONECT 1451 1450 1452 1653 1666 CONECT 1452 1451 1453 1454 CONECT 1453 1452 CONECT 1454 1452 1455 1652 CONECT 1455 1454 1456 1640 1651 CONECT 1456 1455 1457 1458 CONECT 1457 1456 CONECT 1458 1456 1459 1639 CONECT 1459 1458 1460 1627 1638 CONECT 1460 1459 1461 1462 CONECT 1461 1460 CONECT 1462 1460 1463 1626 CONECT 1463 1462 1464 1612 1625 CONECT 1464 1463 1465 1466 CONECT 1465 1464 CONECT 1466 1464 1467 1611 CONECT 1467 1466 1468 1597 1610 CONECT 1468 1467 1469 1470 CONECT 1469 1468 CONECT 1470 1468 1471 1596 CONECT 1471 1470 1472 1586 1595 CONECT 1472 1471 1473 1474 CONECT 1473 1472 CONECT 1474 1472 1475 1585 CONECT 1475 1474 1476 1580 1584 CONECT 1476 1475 1477 1478 CONECT 1477 1476 CONECT 1478 1476 1479 1579 CONECT 1479 1478 1480 1574 1578 CONECT 1480 1479 1481 1482 CONECT 1481 1480 CONECT 1482 1480 1483 1573 CONECT 1483 1482 1484 1566 1572 CONECT 1484 1483 1485 1486 CONECT 1485 1484 CONECT 1486 1484 1487 1565 CONECT 1487 1486 1488 1549 1564 CONECT 1488 1487 1489 1490 CONECT 1489 1488 CONECT 1490 1488 1491 1548 CONECT 1491 1490 1492 1534 1547 CONECT 1492 1491 1493 1494 CONECT 1493 1492 CONECT 1494 1492 1495 1533 CONECT 1495 1494 1496 1523 1532 CONECT 1496 1495 1497 1498 CONECT 1497 1496 CONECT 1498 1496 1499 1522 CONECT 1499 1498 1500 1503 1521 CONECT 1500 1499 1501 1502 CONECT 1501 1500 CONECT 1502 1500 CONECT 1503 1499 1504 1519 1520 CONECT 1504 1503 1505 1517 1518 CONECT 1505 1504 1506 1515 1516 CONECT 1506 1505 1507 1514 CONECT 1507 1506 1508 1511 CONECT 1508 1507 1509 1510 CONECT 1509 1508 CONECT 1510 1508 CONECT 1511 1507 1512 1513 CONECT 1512 1511 CONECT 1513 1511 CONECT 1514 1506 CONECT 1515 1505 CONECT 1516 1505 CONECT 1517 1504 CONECT 1518 1504 CONECT 1519 1503 CONECT 1520 1503 CONECT 1521 1499 CONECT 1522 1498 CONECT 1523 1495 1524 1530 1531 CONECT 1524 1523 1525 1528 1529 CONECT 1525 1524 1526 1527 CONECT 1526 1525 CONECT 1527 1525 CONECT 1528 1524 CONECT 1529 1524 CONECT 1530 1523 CONECT 1531 1523 CONECT 1532 1495 CONECT 1533 1494 CONECT 1534 1491 1535 1545 1546 CONECT 1535 1534 1536 1540 1544 CONECT 1536 1535 1537 1538 1539 CONECT 1537 1536 CONECT 1538 1536 CONECT 1539 1536 CONECT 1540 1535 1541 1542 1543 CONECT 1541 1540 CONECT 1542 1540 CONECT 1543 1540 CONECT 1544 1535 CONECT 1545 1534 CONECT 1546 1534 CONECT 1547 1491 CONECT 1548 1490 CONECT 1549 1487 1550 1562 1563 CONECT 1550 1549 1551 1555 CONECT 1551 1550 1552 1561 CONECT 1552 1551 1553 1560 CONECT 1553 1552 1554 1558 CONECT 1554 1553 1555 1557 CONECT 1555 1550 1554 1556 CONECT 1556 1555 CONECT 1557 1554 CONECT 1558 1553 1559 CONECT 1559 1558 CONECT 1560 1552 CONECT 1561 1551 CONECT 1562 1549 CONECT 1563 1549 CONECT 1564 1487 CONECT 1565 1486 CONECT 1566 1483 1567 1570 1571 CONECT 1567 1566 1568 1569 CONECT 1568 1567 CONECT 1569 1567 CONECT 1570 1566 CONECT 1571 1566 CONECT 1572 1483 CONECT 1573 1482 CONECT 1574 1479 1575 1576 1577 CONECT 1575 1574 CONECT 1576 1574 CONECT 1577 1574 CONECT 1578 1479 CONECT 1579 1478 CONECT 1580 1475 1581 1582 1583 CONECT 1581 1580 CONECT 1582 1580 CONECT 1583 1580 CONECT 1584 1475 CONECT 1585 1474 CONECT 1586 1471 1587 1593 1594 CONECT 1587 1586 1588 1591 1592 CONECT 1588 1587 1589 1590 CONECT 1589 1588 CONECT 1590 1588 CONECT 1591 1587 CONECT 1592 1587 CONECT 1593 1586 CONECT 1594 1586 CONECT 1595 1471 CONECT 1596 1470 CONECT 1597 1467 1598 1608 1609 CONECT 1598 1597 1599 1603 1607 CONECT 1599 1598 1600 1601 1602 CONECT 1600 1599 CONECT 1601 1599 CONECT 1602 1599 CONECT 1603 1598 1604 1605 1606 CONECT 1604 1603 CONECT 1605 1603 CONECT 1606 1603 CONECT 1607 1598 CONECT 1608 1597 CONECT 1609 1597 CONECT 1610 1467 CONECT 1611 1466 CONECT 1612 1463 1613 1623 1624 CONECT 1613 1612 1614 1618 1622 CONECT 1614 1613 1615 1616 1617 CONECT 1615 1614 CONECT 1616 1614 CONECT 1617 1614 CONECT 1618 1613 1619 1620 1621 CONECT 1619 1618 CONECT 1620 1618 CONECT 1621 1618 CONECT 1622 1613 CONECT 1623 1612 CONECT 1624 1612 CONECT 1625 1463 CONECT 1626 1462 CONECT 1627 1459 1628 1636 1637 CONECT 1628 1627 1629 1634 1635 CONECT 1629 1628 1630 CONECT 1630 1629 1631 1632 1633 CONECT 1631 1630 CONECT 1632 1630 CONECT 1633 1630 CONECT 1634 1628 CONECT 1635 1628 CONECT 1636 1627 CONECT 1637 1627 CONECT 1638 1459 CONECT 1639 1458 CONECT 1640 1455 1641 1649 1650 CONECT 1641 1640 1642 1647 1648 CONECT 1642 1641 1643 1644 CONECT 1643 1642 CONECT 1644 1642 1645 1646 CONECT 1645 1644 CONECT 1646 1644 CONECT 1647 1641 CONECT 1648 1641 CONECT 1649 1640 CONECT 1650 1640 CONECT 1651 1455 CONECT 1652 1454 CONECT 1653 1451 1654 1661 1665 CONECT 1654 1653 1655 1659 1660 CONECT 1655 1654 1656 1657 1658 CONECT 1656 1655 CONECT 1657 1655 CONECT 1658 1655 CONECT 1659 1654 CONECT 1660 1654 CONECT 1661 1653 1662 1663 1664 CONECT 1662 1661 CONECT 1663 1661 CONECT 1664 1661 CONECT 1665 1653 CONECT 1666 1451 CONECT 1667 1450 CONECT 1668 1447 1669 1674 1675 CONECT 1669 1668 1670 1671 CONECT 1670 1669 CONECT 1671 1669 1672 1673 CONECT 1672 1671 CONECT 1673 1671 CONECT 1674 1668 CONECT 1675 1668 CONECT 1676 1447 CONECT 1677 1446 CONECT 1678 1443 1679 1687 1688 CONECT 1679 1678 1680 1685 1686 CONECT 1680 1679 1681 CONECT 1681 1680 1682 1683 1684 CONECT 1682 1681 CONECT 1683 1681 CONECT 1684 1681 CONECT 1685 1679 CONECT 1686 1679 CONECT 1687 1678 CONECT 1688 1678 CONECT 1689 1443 CONECT 1690 1442 CONECT 1691 1439 1692 1707 1708 CONECT 1692 1691 1693 1705 1706 CONECT 1693 1692 1694 1703 1704 CONECT 1694 1693 1695 1702 CONECT 1695 1694 1696 1699 CONECT 1696 1695 1697 1698 CONECT 1697 1696 CONECT 1698 1696 CONECT 1699 1695 1700 1701 CONECT 1700 1699 CONECT 1701 1699 CONECT 1702 1694 CONECT 1703 1693 CONECT 1704 1693 CONECT 1705 1692 CONECT 1706 1692 CONECT 1707 1691 CONECT 1708 1691 CONECT 1709 1439 CONECT 1710 1438 CONECT 1711 1438 CONECT 1712 1438 MASTER 0 0 0 0 0 0 0 0 1711 1 279 7 END
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Protein Sequence Similarity
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PDBbind
16aa, >1G1E_1|Chain... at 100%
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PDBbind
16-mer
2mg5
RCSB PDB
PDBbind
16-mer
2mpm
RCSB PDB
PDBbind
16-mer
2mps
RCSB PDB
PDBbind
16-mer
2n1g
RCSB PDB
PDBbind
16-mer
3eht
RCSB PDB
PDBbind
16-mer
3g5v
RCSB PDB
PDBbind
16-mer
3g5y
RCSB PDB
PDBbind
16-mer
3g7l
RCSB PDB
PDBbind
16-mer
3k48
RCSB PDB
PDBbind
16-mer
3nfl
RCSB PDB
PDBbind
16-mer
3oe0
RCSB PDB
PDBbind
16-mer
3tdu
RCSB PDB
PDBbind
16-mer
3twr
RCSB PDB
PDBbind
16-mer
3tws
RCSB PDB
PDBbind
16-mer
3twu
RCSB PDB
PDBbind
16-mer
3twv
RCSB PDB
PDBbind
16-mer
3tww
RCSB PDB
PDBbind
16-mer
3twx
RCSB PDB
PDBbind
16-mer
3v3b
RCSB PDB
PDBbind
16-mer
3zqi
RCSB PDB
PDBbind
16-mer
4a2a
RCSB PDB
PDBbind
16-mer
4a7j
RCSB PDB
PDBbind
16-mer
4edu
RCSB PDB
PDBbind
16-mer
4hs6
RCSB PDB
PDBbind
16-mer
4hs8
RCSB PDB
PDBbind
16-mer
4is6
RCSB PDB
PDBbind
16-mer
4j8r
RCSB PDB
PDBbind
16-mer
4l3o
RCSB PDB
PDBbind
16-mer
4nuf
RCSB PDB
PDBbind
16-mer
4odk
RCSB PDB
PDBbind
16-mer
4odl
RCSB PDB
PDBbind
16-mer
4odm
RCSB PDB
PDBbind
16-mer
4odp
RCSB PDB
PDBbind
16-mer
4odq
RCSB PDB
PDBbind
16-mer
4pz5
RCSB PDB
PDBbind
16-mer
4qq4
RCSB PDB
PDBbind
16-mer
4tzm
RCSB PDB
PDBbind
16-mer
4tzn
RCSB PDB
PDBbind
16-mer
4u2w
RCSB PDB
PDBbind
16-mer
4ud7
RCSB PDB
PDBbind
16-mer
4ue1
RCSB PDB
PDBbind
16-mer
4wci
RCSB PDB
PDBbind
16-mer
4wy7
RCSB PDB
PDBbind
16-mer
4yhp
RCSB PDB
PDBbind
16-mer
4zdu
RCSB PDB
PDBbind
16-mer
5eta
RCSB PDB
PDBbind
16-mer
5hhx
RCSB PDB
PDBbind
16-mer
5iay
RCSB PDB
PDBbind
16-mer
5icx
RCSB PDB
PDBbind
16-mer
5iy4
RCSB PDB
PDBbind
16-mer
5klr
RCSB PDB
PDBbind
16-mer
5klt
RCSB PDB
PDBbind
16-mer
5lvf
RCSB PDB
PDBbind
16-mer
5ly3
RCSB PDB
PDBbind
16-mer
5m9d
RCSB PDB
PDBbind
16-mer
5myk
RCSB PDB
PDBbind
16-mer
5myx
RCSB PDB
PDBbind
16-mer
5nin
RCSB PDB
PDBbind
16-mer
5njx
RCSB PDB
PDBbind
16-mer
5o4y
RCSB PDB
PDBbind
16-mer
5u2j
RCSB PDB
PDBbind
16-mer
5v1y
RCSB PDB
PDBbind
16-mer
5v6y
RCSB PDB
PDBbind
16-mer
5wa4
RCSB PDB
PDBbind
16-mer
5wbl
RCSB PDB
PDBbind
16-mer
5wqd
RCSB PDB
PDBbind
16-mer
5y7w
RCSB PDB
PDBbind
16-mer
6bhi
RCSB PDB
PDBbind
16-mer
6g84
RCSB PDB
PDBbind
16-mer
6g85
RCSB PDB
PDBbind
16-mer
6g86
RCSB PDB
PDBbind
16-mer
6h0b
RCSB PDB
PDBbind
16-mer
6qsz
RCSB PDB
PDBbind
16-mer
6pi7
RCSB PDB
PDBbind
16-mer
6me1
RCSB PDB
PDBbind
16-mer
6d08
RCSB PDB
PDBbind
16-mer
6d07
RCSB PDB
PDBbind
16-mer
5zml
RCSB PDB
PDBbind
16-mer
5w4e
RCSB PDB
PDBbind
16-mer
6tyz
RCSB PDB
PDBbind
16-mer
Entry Information
PDB ID
1s5q
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
mammalian mSin3A (mSin3A) PAH2 domain
Ligand Name
16-mer
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=5.2uM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
(2004) Nat.Struct.Mol.Biol. Vol. 11: pp. 738-746
Ligand Properties
Formula
C
8
4
H
1
4
3
N
2
4
O
2
6
S
2
Molecular Weight
1969.310
Exact Mass
1968.000
No. of atoms
279
No. of bonds
279
Polar Surface Area
902.37
LOGP Value
3.45 (
Computed with XLOGP3
)
-0.69 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 19
No. of Hydrogen Bond Acceptors: 26
No. of Rotatable Bonds: 80
No. of Nitrogen and Oxygen Atoms: 50
No. of Rings: 1
Canonical SMILES
CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC(=O)O)CC(C)C)Cc1ccc(cc1)O)CC(=O)O)C)C)CCC(=O)O)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCSC)CC(=O)N)CCC(=O)N
InChI String
InChI=1S/C84H140N24O26S2/c1-13-43(8)66(108-80(131)59(38-62(87)111)107-73(124)52(28-32-135-11)96-69(120)48(85)16-14-30-92-83(88)89)81(132)100-49(22-25-61(86)110)71(122)99-53(29-33-136-12)74(125)103-57(36-42(6)7)77(128)104-55(34-40(2)3)75(126)97-50(23-26-63(112)113)70(121)95-44(9)67(118)94-45(10)68(119)102-60(39-65(116)117)79(130)106-58(37-46-18-20-47(109)21-19-46)78(129)105-56(35-41(4)5)76(127)98-51(24-27-64(114)115)72(123)101-54(82(133)134)17-15-31-93-84(90)91/h18-21,40-45,48-60,66,109H,13-17,22-39,85H2,1-12H3,(H2,86,110)(H2,87,111)(H,94,118)(H,95,121)(H,96,120)(H,97,126)(H,98,127)(H,99,122)(H,100,132)(H,101,123)(H,102,119)(H,103,125)(H,104,128)(H,105,129)(H,106,130)(H,107,124)(H,108,131)(H,112,113)(H,114,115)(H,116,117)(H,133,134)(H4,88,89,92)(H4,90,91,93)/p+3/t43-,44-,45-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/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):
Q05195
Q60520
Entrez Gene ID
NCBI Entrez Gene ID:
4084
20466
ASD
Information of known allosteric effects of PDB entries
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