Browse entries in the PDBbind-CN Database
HEADER 1W70_COMPLEX COMPND 1W70_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 1 ACE SEQRES 1 B 60 LEU ILE LYS HIS MET ARG ALA GLU ALA LEU PHE ASP PHE SEQRES 2 B 60 THR GLY ASN SER LYS LEU GLU LEU ASN PHE LYS ALA GLY SEQRES 3 B 60 ASP VAL ILE PHE LEU LEU SER ARG ILE ASN LYS ASP TRP SEQRES 4 B 60 LEU GLU GLY THR VAL ARG GLY ALA THR GLY ILE PHE PRO SEQRES 5 B 60 LEU SER PHE VAL LYS ILE LEU LYS SEQRES 1 D 11 LYS PRO GLN PRO ALA VAL PRO PRO ARG PRO SER HET ACE A 359 2 HET NON A 73 7 HETATM 1 C ACE A 359 3.708 21.766 31.843 1.00 29.56 C HETATM 2 O ACE A 359 3.329 22.143 32.957 1.00 30.80 O TER 3 ACE A 359 ATOM 4 N LEU B 169 10.147 37.726 0.058 1.00 18.80 N ATOM 5 CA LEU B 169 11.198 36.763 0.471 1.00 16.63 C ATOM 6 C LEU B 169 12.219 37.379 1.410 1.00 16.30 C ATOM 7 O LEU B 169 12.970 38.296 1.054 1.00 17.13 O ATOM 8 CB LEU B 169 11.912 36.180 -0.753 1.00 16.97 C ATOM 9 CG LEU B 169 13.002 35.150 -0.430 1.00 17.99 C ATOM 10 CD1 LEU B 169 12.402 33.905 0.218 1.00 19.06 C ATOM 11 CD2 LEU B 169 13.723 34.774 -1.716 1.00 19.51 C ATOM 12 HA LEU B 169 10.689 35.966 1.013 1.00 0.00 H ATOM 13 HB2 LEU B 169 12.402 37.011 -1.260 1.00 0.00 H ATOM 14 HB3 LEU B 169 11.156 35.666 -1.346 1.00 0.00 H ATOM 15 HG LEU B 169 13.707 35.588 0.277 1.00 0.00 H ATOM 16 HD21 LEU B 169 13.009 34.347 -2.420 1.00 0.00 H ATOM 17 HD22 LEU B 169 14.175 35.665 -2.151 1.00 0.00 H ATOM 18 HD23 LEU B 169 14.500 34.042 -1.495 1.00 0.00 H ATOM 19 HD11 LEU B 169 11.899 34.185 1.144 1.00 0.00 H ATOM 20 HD12 LEU B 169 11.683 33.452 -0.465 1.00 0.00 H ATOM 21 HD13 LEU B 169 13.197 33.192 0.436 1.00 0.00 H ATOM 22 HN3 LEU B 169 10.580 38.514 -0.423 1.00 0.00 H ATOM 23 HN2 LEU B 169 9.651 38.061 0.884 1.00 0.00 H ATOM 24 HN1 LEU B 169 9.490 37.262 -0.570 1.00 0.00 H ATOM 25 N ILE B 170 12.222 36.852 2.628 1.00 14.99 N ATOM 26 CA ILE B 170 13.131 37.268 3.685 1.00 14.86 C ATOM 27 C ILE B 170 14.506 36.611 3.460 1.00 13.87 C ATOM 28 O ILE B 170 14.583 35.456 3.046 1.00 15.02 O ATOM 29 CB ILE B 170 12.601 36.783 5.050 1.00 16.37 C ATOM 30 CG1 ILE B 170 11.174 37.267 5.262 1.00 19.07 C ATOM 31 CG2 ILE B 170 13.512 37.281 6.157 1.00 19.51 C ATOM 32 CD1 ILE B 170 10.501 36.604 6.455 1.00 17.25 C ATOM 33 HA ILE B 170 13.211 38.355 3.672 1.00 0.00 H ATOM 34 HB ILE B 170 12.594 35.693 5.068 1.00 0.00 H ATOM 35 HG12 ILE B 170 10.599 37.016 4.371 1.00 0.00 H ATOM 36 HG13 ILE B 170 11.209 38.340 5.451 1.00 0.00 H ATOM 37 HD11 ILE B 170 10.469 35.526 6.300 1.00 0.00 H ATOM 38 HD12 ILE B 170 11.068 36.825 7.359 1.00 0.00 H ATOM 39 HD13 ILE B 170 9.486 36.988 6.557 1.00 0.00 H ATOM 40 HG21 ILE B 170 14.518 36.893 6.000 1.00 0.00 H ATOM 41 HG22 ILE B 170 13.536 38.371 6.144 1.00 0.00 H ATOM 42 HG23 ILE B 170 13.134 36.936 7.119 1.00 0.00 H ATOM 43 H ILE B 170 11.549 36.114 2.835 1.00 0.00 H ATOM 44 N LYS B 171 15.571 37.343 3.762 1.00 13.76 N ATOM 45 CA LYS B 171 16.918 36.816 3.595 1.00 13.77 C ATOM 46 C LYS B 171 17.693 36.732 4.904 1.00 13.63 C ATOM 47 O LYS B 171 17.687 37.663 5.707 1.00 13.95 O ATOM 48 CB LYS B 171 17.704 37.671 2.601 1.00 15.62 C ATOM 49 CG LYS B 171 17.221 37.559 1.167 1.00 17.83 C ATOM 50 CD LYS B 171 17.549 36.197 0.573 1.00 20.23 C ATOM 51 CE LYS B 171 19.053 35.978 0.500 1.00 22.84 C ATOM 52 NZ LYS B 171 19.414 34.684 -0.141 1.00 24.90 N ATOM 53 HA LYS B 171 16.803 35.801 3.216 1.00 0.00 H ATOM 54 HB2 LYS B 171 18.736 37.321 2.621 1.00 0.00 H ATOM 55 HB3 LYS B 171 17.579 38.711 2.902 1.00 0.00 H ATOM 56 HG2 LYS B 171 17.721 38.324 0.573 1.00 0.00 H ATOM 57 HG3 LYS B 171 16.139 37.689 1.156 1.00 0.00 H ATOM 58 HD2 LYS B 171 17.141 36.150 -0.436 1.00 0.00 H ATOM 59 HD3 LYS B 171 17.115 35.426 1.209 1.00 0.00 H ATOM 60 HE2 LYS B 171 19.479 36.780 -0.102 1.00 0.00 H ATOM 61 HE3 LYS B 171 19.440 35.966 1.519 1.00 0.00 H ATOM 62 HZ1 LYS B 171 19.011 33.916 0.396 1.00 0.00 H ATOM 63 HZ2 LYS B 171 19.048 34.664 -1.093 1.00 0.00 H ATOM 64 HZ3 LYS B 171 20.429 34.589 -0.164 1.00 0.00 H ATOM 65 H LYS B 171 15.444 38.291 4.117 1.00 0.00 H ATOM 66 N HIS B 172 18.353 35.598 5.102 1.00 13.17 N ATOM 67 CA HIS B 172 19.170 35.346 6.279 1.00 14.94 C ATOM 68 C HIS B 172 18.530 35.658 7.632 1.00 14.10 C ATOM 69 O HIS B 172 19.176 36.216 8.518 1.00 16.59 O ATOM 70 CB HIS B 172 20.490 36.110 6.166 1.00 17.90 C ATOM 71 CG HIS B 172 21.639 35.430 6.839 1.00 19.64 C ATOM 72 ND1 HIS B 172 22.576 36.113 7.583 1.00 19.99 N ATOM 73 CD2 HIS B 172 22.022 34.130 6.855 1.00 20.37 C ATOM 74 CE1 HIS B 172 23.487 35.265 8.028 1.00 20.93 C ATOM 75 NE2 HIS B 172 23.173 34.056 7.598 1.00 20.40 N ATOM 76 HA HIS B 172 19.314 34.266 6.277 1.00 0.00 H ATOM 77 HB2 HIS B 172 20.351 37.074 6.655 1.00 0.00 H ATOM 78 HB3 HIS B 172 20.732 36.186 5.106 1.00 0.00 H ATOM 79 HD2 HIS B 172 21.511 33.299 6.369 1.00 0.00 H ATOM 80 HE1 HIS B 172 24.349 35.520 8.644 1.00 0.00 H ATOM 81 H HIS B 172 18.284 34.867 4.394 1.00 0.00 H ATOM 82 N MET B 173 17.261 35.310 7.793 1.00 12.26 N ATOM 83 CA MET B 173 16.591 35.515 9.064 1.00 11.25 C ATOM 84 C MET B 173 16.172 34.143 9.559 1.00 10.74 C ATOM 85 O MET B 173 15.811 33.270 8.776 1.00 11.38 O ATOM 86 CB MET B 173 15.400 36.465 8.933 1.00 11.83 C ATOM 87 CG MET B 173 15.833 37.927 8.899 1.00 12.84 C ATOM 88 SD MET B 173 14.480 39.104 9.034 1.00 14.75 S ATOM 89 CE MET B 173 14.122 38.999 10.795 1.00 14.36 C ATOM 90 HA MET B 173 17.260 35.993 9.780 1.00 0.00 H ATOM 91 HB2 MET B 173 14.754 36.322 9.799 1.00 0.00 H ATOM 92 HB3 MET B 173 14.887 36.240 7.998 1.00 0.00 H ATOM 93 HG2 MET B 173 16.485 38.088 9.758 1.00 0.00 H ATOM 94 HG3 MET B 173 16.311 38.097 7.934 1.00 0.00 H ATOM 95 HE1 MET B 173 13.840 37.977 11.047 1.00 0.00 H ATOM 96 HE2 MET B 173 15.008 39.283 11.362 1.00 0.00 H ATOM 97 HE3 MET B 173 13.301 39.674 11.039 1.00 0.00 H ATOM 98 H MET B 173 16.750 34.893 7.015 1.00 0.00 H ATOM 99 N ARG B 174 16.226 33.966 10.870 1.00 10.63 N ATOM 100 CA ARG B 174 15.952 32.688 11.499 1.00 9.68 C ATOM 101 C ARG B 174 15.094 32.851 12.737 1.00 8.26 C ATOM 102 O ARG B 174 15.092 33.906 13.384 1.00 9.67 O ATOM 103 CB ARG B 174 17.278 32.050 11.930 1.00 11.16 C ATOM 104 CG ARG B 174 18.371 32.044 10.866 1.00 16.44 C ATOM 105 CD ARG B 174 18.133 30.947 9.860 1.00 16.47 C ATOM 106 NE ARG B 174 19.199 30.888 8.849 1.00 18.68 N ATOM 107 CZ ARG B 174 19.089 31.373 7.612 1.00 16.42 C ATOM 108 NH1 ARG B 174 17.974 31.962 7.206 1.00 15.68 N ATOM 109 NH2 ARG B 174 20.101 31.233 6.764 1.00 18.37 N ATOM 110 HA ARG B 174 15.423 32.066 10.777 1.00 0.00 H ATOM 111 HB2 ARG B 174 17.063 31.007 12.164 1.00 0.00 H ATOM 112 HB3 ARG B 174 17.655 32.643 12.763 1.00 0.00 H ATOM 113 HG2 ARG B 174 19.332 31.874 11.351 1.00 0.00 H ATOM 114 HG3 ARG B 174 18.363 33.003 10.348 1.00 0.00 H ATOM 115 HD2 ARG B 174 18.113 29.995 10.391 1.00 0.00 H ATOM 116 HD3 ARG B 174 17.191 31.149 9.351 1.00 0.00 H ATOM 117 HE ARG B 174 20.081 30.447 9.111 1.00 0.00 H ATOM 118 HH12 ARG B 174 17.907 32.327 6.256 1.00 0.00 H ATOM 119 HH11 ARG B 174 17.182 32.050 7.843 1.00 0.00 H ATOM 120 HH22 ARG B 174 20.026 31.601 5.816 1.00 0.00 H ATOM 121 HH21 ARG B 174 20.953 30.758 7.061 1.00 0.00 H ATOM 122 H ARG B 174 16.470 34.760 11.462 1.00 0.00 H ATOM 123 N ALA B 175 14.363 31.796 13.068 1.00 8.72 N ATOM 124 CA ALA B 175 13.553 31.812 14.277 1.00 8.77 C ATOM 125 C ALA B 175 13.692 30.484 14.989 1.00 8.51 C ATOM 126 O ALA B 175 13.586 29.416 14.362 1.00 10.17 O ATOM 127 CB ALA B 175 12.090 32.074 13.956 1.00 11.42 C ATOM 128 HA ALA B 175 13.906 32.618 14.920 1.00 0.00 H ATOM 129 HB1 ALA B 175 11.995 33.040 13.461 1.00 0.00 H ATOM 130 HB2 ALA B 175 11.718 31.289 13.298 1.00 0.00 H ATOM 131 HB3 ALA B 175 11.512 32.080 14.880 1.00 0.00 H ATOM 132 H ALA B 175 14.368 30.968 12.472 1.00 0.00 H ATOM 133 N GLU B 176 13.913 30.541 16.294 1.00 8.64 N ATOM 134 CA GLU B 176 14.013 29.310 17.073 1.00 8.19 C ATOM 135 C GLU B 176 12.663 28.968 17.687 1.00 7.66 C ATOM 136 O GLU B 176 12.038 29.806 18.321 1.00 8.50 O ATOM 137 CB GLU B 176 15.011 29.457 18.224 1.00 7.70 C ATOM 138 CG GLU B 176 15.124 28.142 18.997 1.00 8.40 C ATOM 139 CD GLU B 176 16.035 28.216 20.196 1.00 10.22 C ATOM 140 OE1 GLU B 176 16.794 29.197 20.322 1.00 11.62 O ATOM 141 OE2 GLU B 176 16.013 27.271 21.022 1.00 10.45 O ATOM 142 HA GLU B 176 14.346 28.527 16.391 1.00 0.00 H ATOM 143 HB2 GLU B 176 14.664 30.239 18.899 1.00 0.00 H ATOM 144 HB3 GLU B 176 15.988 29.717 17.818 1.00 0.00 H ATOM 145 HG2 GLU B 176 15.543 27.400 18.317 1.00 0.00 H ATOM 146 HG3 GLU B 176 14.127 27.893 19.361 1.00 0.00 H ATOM 147 H GLU B 176 14.013 31.445 16.755 1.00 0.00 H ATOM 148 N ALA B 177 12.230 27.731 17.504 1.00 9.05 N ATOM 149 CA ALA B 177 11.010 27.274 18.135 1.00 8.50 C ATOM 150 C ALA B 177 11.213 27.221 19.656 1.00 8.95 C ATOM 151 O ALA B 177 12.197 26.651 20.147 1.00 9.30 O ATOM 152 CB ALA B 177 10.654 25.884 17.624 1.00 10.72 C ATOM 153 HA ALA B 177 10.200 27.964 17.896 1.00 0.00 H ATOM 154 HB1 ALA B 177 10.510 25.921 16.544 1.00 0.00 H ATOM 155 HB2 ALA B 177 11.463 25.193 17.860 1.00 0.00 H ATOM 156 HB3 ALA B 177 9.735 25.547 18.103 1.00 0.00 H ATOM 157 H ALA B 177 12.762 27.093 16.912 1.00 0.00 H ATOM 158 N LEU B 178 10.289 27.819 20.398 1.00 8.46 N ATOM 159 CA LEU B 178 10.357 27.773 21.850 1.00 9.50 C ATOM 160 C LEU B 178 9.369 26.751 22.393 1.00 9.77 C ATOM 161 O LEU B 178 9.413 26.426 23.585 1.00 10.48 O ATOM 162 CB LEU B 178 10.064 29.147 22.444 1.00 11.13 C ATOM 163 CG LEU B 178 11.107 30.206 22.067 1.00 10.85 C ATOM 164 CD1 LEU B 178 10.775 31.531 22.735 1.00 16.63 C ATOM 165 CD2 LEU B 178 12.491 29.738 22.506 1.00 15.01 C ATOM 166 HA LEU B 178 11.366 27.477 22.136 1.00 0.00 H ATOM 167 HB2 LEU B 178 10.075 29.046 23.529 1.00 0.00 H ATOM 168 HB3 LEU B 178 9.102 29.477 22.051 1.00 0.00 H ATOM 169 HG LEU B 178 11.097 30.346 20.986 1.00 0.00 H ATOM 170 HD21 LEU B 178 12.497 29.590 23.586 1.00 0.00 H ATOM 171 HD22 LEU B 178 12.730 28.799 22.008 1.00 0.00 H ATOM 172 HD23 LEU B 178 13.230 30.492 22.237 1.00 0.00 H ATOM 173 HD11 LEU B 178 9.791 31.866 22.406 1.00 0.00 H ATOM 174 HD12 LEU B 178 10.773 31.400 23.817 1.00 0.00 H ATOM 175 HD13 LEU B 178 11.524 32.273 22.459 1.00 0.00 H ATOM 176 H LEU B 178 9.523 28.316 19.945 1.00 0.00 H ATOM 177 N PHE B 179 8.508 26.240 21.506 1.00 9.57 N ATOM 178 CA PHE B 179 7.472 25.249 21.824 1.00 10.45 C ATOM 179 C PHE B 179 7.288 24.347 20.620 1.00 11.00 C ATOM 180 O PHE B 179 7.528 24.762 19.485 1.00 12.30 O ATOM 181 CB PHE B 179 6.129 25.946 22.085 1.00 11.54 C ATOM 182 CG PHE B 179 6.182 26.950 23.184 1.00 9.68 C ATOM 183 CD1 PHE B 179 6.012 26.556 24.508 1.00 11.51 C ATOM 184 CD2 PHE B 179 6.454 28.289 22.908 1.00 10.96 C ATOM 185 CE1 PHE B 179 6.111 27.483 25.547 1.00 11.84 C ATOM 186 CE2 PHE B 179 6.558 29.219 23.930 1.00 10.54 C ATOM 187 CZ PHE B 179 6.386 28.817 25.260 1.00 13.14 C ATOM 188 HA PHE B 179 7.777 24.688 22.708 1.00 0.00 H ATOM 189 HB2 PHE B 179 5.414 25.178 22.378 1.00 0.00 H ATOM 190 HB3 PHE B 179 5.852 26.474 21.173 1.00 0.00 H ATOM 191 HD2 PHE B 179 6.587 28.609 21.874 1.00 0.00 H ATOM 192 HE2 PHE B 179 6.773 30.262 23.699 1.00 0.00 H ATOM 193 HZ PHE B 179 6.467 29.545 26.067 1.00 0.00 H ATOM 194 HE1 PHE B 179 5.973 27.163 26.580 1.00 0.00 H ATOM 195 HD1 PHE B 179 5.799 25.512 24.736 1.00 0.00 H ATOM 196 H PHE B 179 8.576 26.561 20.540 1.00 0.00 H ATOM 197 N ASP B 180 6.860 23.110 20.848 1.00 10.14 N ATOM 198 CA ASP B 180 6.594 22.186 19.750 1.00 10.98 C ATOM 199 C ASP B 180 5.341 22.694 19.015 1.00 11.19 C ATOM 200 O ASP B 180 4.426 23.269 19.614 1.00 11.62 O ATOM 201 CB ASP B 180 6.235 20.781 20.254 1.00 11.70 C ATOM 202 CG ASP B 180 7.363 20.067 20.979 1.00 13.74 C ATOM 203 OD1 ASP B 180 8.545 20.468 20.940 1.00 14.81 O ATOM 204 OD2 ASP B 180 7.022 19.032 21.611 1.00 18.93 O ATOM 205 HA ASP B 180 7.488 22.136 19.128 1.00 0.00 H ATOM 206 HB2 ASP B 180 5.987 20.181 19.379 1.00 0.00 H ATOM 207 HB3 ASP B 180 5.419 20.896 20.967 1.00 0.00 H ATOM 208 H ASP B 180 6.715 22.800 21.809 1.00 0.00 H ATOM 209 N PHE B 181 5.300 22.463 17.711 1.00 11.99 N ATOM 210 CA PHE B 181 4.126 22.812 16.930 1.00 11.93 C ATOM 211 C PHE B 181 3.873 21.672 15.965 1.00 12.05 C ATOM 212 O PHE B 181 4.777 21.255 15.235 1.00 12.44 O ATOM 213 CB PHE B 181 4.323 24.105 16.126 1.00 12.63 C ATOM 214 CG PHE B 181 3.140 24.461 15.259 1.00 12.04 C ATOM 215 CD1 PHE B 181 1.914 24.791 15.833 1.00 12.01 C ATOM 216 CD2 PHE B 181 3.243 24.427 13.870 1.00 11.28 C ATOM 217 CE1 PHE B 181 0.796 25.083 15.031 1.00 12.01 C ATOM 218 CE2 PHE B 181 2.131 24.714 13.062 1.00 11.26 C ATOM 219 CZ PHE B 181 0.910 25.043 13.643 1.00 10.89 C ATOM 220 HA PHE B 181 3.288 22.976 17.608 1.00 0.00 H ATOM 221 HB2 PHE B 181 5.178 23.954 15.467 1.00 0.00 H ATOM 222 HB3 PHE B 181 4.462 24.917 16.840 1.00 0.00 H ATOM 223 HD2 PHE B 181 4.196 24.175 13.406 1.00 0.00 H ATOM 224 HE2 PHE B 181 2.224 24.679 11.977 1.00 0.00 H ATOM 225 HZ PHE B 181 0.048 25.268 13.016 1.00 0.00 H ATOM 226 HE1 PHE B 181 -0.157 25.340 15.494 1.00 0.00 H ATOM 227 HD1 PHE B 181 1.820 24.823 16.918 1.00 0.00 H ATOM 228 H PHE B 181 6.103 22.035 17.250 1.00 0.00 H ATOM 229 N THR B 182 2.645 21.157 15.971 1.00 14.24 N ATOM 230 CA THR B 182 2.259 20.101 15.051 1.00 16.04 C ATOM 231 C THR B 182 1.135 20.691 14.198 1.00 15.86 C ATOM 232 O THR B 182 0.086 21.054 14.716 1.00 18.87 O ATOM 233 CB THR B 182 1.754 18.863 15.810 1.00 16.61 C ATOM 234 OG1 THR B 182 2.770 18.433 16.723 1.00 21.52 O ATOM 235 CG2 THR B 182 1.459 17.722 14.842 1.00 19.99 C ATOM 236 HA THR B 182 3.106 19.775 14.447 1.00 0.00 H ATOM 237 HB THR B 182 0.840 19.126 16.341 1.00 0.00 H ATOM 238 HG1 THR B 182 2.462 17.660 17.201 1.00 0.00 H ATOM 239 HG23 THR B 182 0.686 18.034 14.139 1.00 0.00 H ATOM 240 HG21 THR B 182 2.367 17.467 14.296 1.00 0.00 H ATOM 241 HG22 THR B 182 1.114 16.853 15.402 1.00 0.00 H ATOM 242 H THR B 182 1.959 21.512 16.637 1.00 0.00 H ATOM 243 N GLY B 183 1.369 20.798 12.894 1.00 17.12 N ATOM 244 CA GLY B 183 0.369 21.371 12.006 1.00 18.07 C ATOM 245 C GLY B 183 -0.871 20.518 11.856 1.00 21.01 C ATOM 246 O GLY B 183 -0.846 19.327 12.114 1.00 20.93 O ATOM 247 HA3 GLY B 183 0.059 22.324 12.435 1.00 0.00 H ATOM 248 HA2 GLY B 183 0.823 21.462 11.019 1.00 0.00 H ATOM 249 H GLY B 183 2.258 20.475 12.512 1.00 0.00 H ATOM 250 N ASN B 184 -1.958 21.133 11.413 1.00 23.16 N ATOM 251 CA ASN B 184 -3.222 20.419 11.227 1.00 26.14 C ATOM 252 C ASN B 184 -3.446 20.198 9.735 1.00 26.74 C ATOM 253 O ASN B 184 -4.372 19.500 9.302 1.00 28.66 O ATOM 254 CB ASN B 184 -4.354 21.246 11.839 1.00 28.13 C ATOM 255 CG ASN B 184 -5.706 20.576 11.720 1.00 29.35 C ATOM 256 OD1 ASN B 184 -6.237 20.417 10.625 1.00 31.09 O ATOM 257 ND2 ASN B 184 -6.273 20.188 12.854 1.00 30.60 N ATOM 258 HA ASN B 184 -3.196 19.449 11.723 1.00 0.00 H ATOM 259 HB2 ASN B 184 -4.403 22.192 11.300 1.00 0.00 H ATOM 260 HB3 ASN B 184 -4.138 21.372 12.900 1.00 0.00 H ATOM 261 HD22 ASN B 184 -5.795 20.341 13.742 1.00 0.00 H ATOM 262 HD21 ASN B 184 -7.188 19.737 12.839 1.00 0.00 H ATOM 263 H ASN B 184 -1.913 22.129 11.196 1.00 0.00 H ATOM 264 N SER B 185 -2.567 20.782 8.941 1.00 26.43 N ATOM 265 CA SER B 185 -2.650 20.657 7.502 1.00 26.45 C ATOM 266 C SER B 185 -1.271 20.532 6.867 1.00 25.30 C ATOM 267 O SER B 185 -0.257 20.846 7.493 1.00 22.68 O ATOM 268 CB SER B 185 -3.383 21.870 6.930 1.00 28.63 C ATOM 269 OG SER B 185 -2.813 22.235 5.690 1.00 28.57 O ATOM 270 HA SER B 185 -3.201 19.746 7.270 1.00 0.00 H ATOM 271 HB2 SER B 185 -4.433 21.619 6.783 1.00 0.00 H ATOM 272 HB3 SER B 185 -3.295 22.704 7.626 1.00 0.00 H ATOM 273 HG SER B 185 -3.278 22.997 5.337 1.00 0.00 H ATOM 274 H SER B 185 -1.813 21.333 9.351 1.00 0.00 H ATOM 275 N LYS B 186 -1.229 20.078 5.616 1.00 23.81 N ATOM 276 CA LYS B 186 0.029 19.928 4.900 1.00 21.85 C ATOM 277 C LYS B 186 0.596 21.312 4.565 1.00 18.28 C ATOM 278 O LYS B 186 1.727 21.436 4.108 1.00 18.84 O ATOM 279 CB LYS B 186 -0.184 19.126 3.611 1.00 24.95 C ATOM 280 CG LYS B 186 -1.375 18.170 3.656 1.00 28.31 C ATOM 281 CD LYS B 186 -1.324 17.243 4.862 1.00 30.79 C ATOM 282 CE LYS B 186 -2.678 16.594 5.115 1.00 31.77 C ATOM 283 NZ LYS B 186 -2.633 15.711 6.309 1.00 31.52 N ATOM 284 HA LYS B 186 0.735 19.390 5.532 1.00 0.00 H ATOM 285 HB2 LYS B 186 0.709 18.520 3.459 1.00 0.00 H ATOM 286 HB3 LYS B 186 -0.379 19.844 2.814 1.00 0.00 H ATOM 287 HG2 LYS B 186 -1.351 17.556 2.756 1.00 0.00 H ATOM 288 HG3 LYS B 186 -2.285 18.766 3.725 1.00 0.00 H ATOM 289 HD2 LYS B 186 -1.049 17.828 5.739 1.00 0.00 H ATOM 290 HD3 LYS B 186 -0.593 16.458 4.667 1.00 0.00 H ATOM 291 HE2 LYS B 186 -3.414 17.379 5.289 1.00 0.00 H ATOM 292 HE3 LYS B 186 -2.944 15.992 4.246 1.00 0.00 H ATOM 293 HZ1 LYS B 186 -1.941 14.976 6.161 1.00 0.00 H ATOM 294 HZ2 LYS B 186 -2.376 16.262 7.128 1.00 0.00 H ATOM 295 HZ3 LYS B 186 -3.551 15.291 6.454 1.00 0.00 H ATOM 296 H LYS B 186 -2.100 19.829 5.148 1.00 0.00 H ATOM 297 N LEU B 187 -0.195 22.351 4.817 1.00 18.89 N ATOM 298 CA LEU B 187 0.255 23.725 4.567 1.00 14.93 C ATOM 299 C LEU B 187 1.020 24.256 5.759 1.00 13.97 C ATOM 300 O LEU B 187 1.716 25.256 5.657 1.00 11.98 O ATOM 301 CB LEU B 187 -0.928 24.643 4.328 1.00 15.67 C ATOM 302 CG LEU B 187 -1.676 24.422 3.023 1.00 16.45 C ATOM 303 CD1 LEU B 187 -3.043 25.084 3.097 1.00 19.90 C ATOM 304 CD2 LEU B 187 -0.836 24.963 1.881 1.00 17.58 C ATOM 305 HA LEU B 187 0.895 23.703 3.685 1.00 0.00 H ATOM 306 HB2 LEU B 187 -0.531 25.657 4.290 1.00 0.00 H ATOM 307 HB3 LEU B 187 -1.639 24.447 5.130 1.00 0.00 H ATOM 308 HG LEU B 187 -1.842 23.359 2.848 1.00 0.00 H ATOM 309 HD21 LEU B 187 -0.662 26.028 2.032 1.00 0.00 H ATOM 310 HD22 LEU B 187 0.119 24.438 1.854 1.00 0.00 H ATOM 311 HD23 LEU B 187 -1.363 24.810 0.939 1.00 0.00 H ATOM 312 HD11 LEU B 187 -3.612 24.649 3.918 1.00 0.00 H ATOM 313 HD12 LEU B 187 -2.919 26.154 3.266 1.00 0.00 H ATOM 314 HD13 LEU B 187 -3.575 24.923 2.159 1.00 0.00 H ATOM 315 H LEU B 187 -1.130 22.190 5.190 1.00 0.00 H ATOM 316 N GLU B 188 0.899 23.554 6.877 1.00 13.30 N ATOM 317 CA GLU B 188 1.560 23.963 8.110 1.00 11.61 C ATOM 318 C GLU B 188 2.845 23.197 8.353 1.00 11.82 C ATOM 319 O GLU B 188 3.007 22.047 7.936 1.00 14.83 O ATOM 320 CB GLU B 188 0.604 23.806 9.297 1.00 11.69 C ATOM 321 CG GLU B 188 -0.591 24.735 9.104 1.00 16.20 C ATOM 322 CD GLU B 188 -1.637 24.683 10.175 1.00 18.96 C ATOM 323 OE1 GLU B 188 -1.466 23.965 11.175 1.00 18.44 O ATOM 324 OE2 GLU B 188 -2.658 25.383 9.999 1.00 21.81 O ATOM 325 HA GLU B 188 1.831 25.013 8.005 1.00 0.00 H ATOM 326 HB2 GLU B 188 1.122 24.063 10.221 1.00 0.00 H ATOM 327 HB3 GLU B 188 0.259 22.774 9.355 1.00 0.00 H ATOM 328 HG2 GLU B 188 -1.079 24.421 8.181 1.00 0.00 H ATOM 329 HG3 GLU B 188 -0.195 25.751 9.109 1.00 0.00 H ATOM 330 H GLU B 188 0.330 22.708 6.874 1.00 0.00 H ATOM 331 N LEU B 189 3.786 23.871 8.997 1.00 11.65 N ATOM 332 CA LEU B 189 5.070 23.290 9.334 1.00 12.15 C ATOM 333 C LEU B 189 4.911 22.433 10.601 1.00 13.72 C ATOM 334 O LEU B 189 3.863 22.428 11.250 1.00 16.99 O ATOM 335 CB LEU B 189 6.074 24.438 9.550 1.00 13.48 C ATOM 336 CG LEU B 189 7.587 24.190 9.437 1.00 12.07 C ATOM 337 CD1 LEU B 189 7.937 23.595 8.061 1.00 12.47 C ATOM 338 CD2 LEU B 189 8.323 25.517 9.646 1.00 11.87 C ATOM 339 HA LEU B 189 5.439 22.647 8.535 1.00 0.00 H ATOM 340 HB2 LEU B 189 5.928 24.727 10.591 1.00 0.00 H ATOM 341 HB3 LEU B 189 5.857 25.137 8.742 1.00 0.00 H ATOM 342 HG LEU B 189 7.895 23.475 10.200 1.00 0.00 H ATOM 343 HD21 LEU B 189 8.008 26.230 8.884 1.00 0.00 H ATOM 344 HD22 LEU B 189 8.086 25.911 10.634 1.00 0.00 H ATOM 345 HD23 LEU B 189 9.397 25.351 9.568 1.00 0.00 H ATOM 346 HD11 LEU B 189 7.413 22.648 7.932 1.00 0.00 H ATOM 347 HD12 LEU B 189 7.633 24.290 7.278 1.00 0.00 H ATOM 348 HD13 LEU B 189 9.012 23.427 8.002 1.00 0.00 H ATOM 349 H LEU B 189 3.599 24.837 9.266 1.00 0.00 H ATOM 350 N ASN B 190 5.922 21.632 10.900 1.00 11.54 N ATOM 351 CA ASN B 190 5.929 20.816 12.110 1.00 12.64 C ATOM 352 C ASN B 190 7.321 20.994 12.677 1.00 11.73 C ATOM 353 O ASN B 190 8.299 20.957 11.934 1.00 12.84 O ATOM 354 CB ASN B 190 5.747 19.329 11.797 1.00 14.38 C ATOM 355 CG ASN B 190 4.376 19.002 11.264 1.00 18.22 C ATOM 356 OD1 ASN B 190 3.430 18.842 12.026 1.00 18.88 O ATOM 357 ND2 ASN B 190 4.264 18.894 9.942 1.00 20.89 N ATOM 358 HA ASN B 190 5.122 21.115 12.778 1.00 0.00 H ATOM 359 HB2 ASN B 190 5.882 18.775 12.726 1.00 0.00 H ATOM 360 HB3 ASN B 190 6.474 19.060 11.030 1.00 0.00 H ATOM 361 HD22 ASN B 190 5.081 19.036 9.348 1.00 0.00 H ATOM 362 HD21 ASN B 190 3.361 18.669 9.523 1.00 0.00 H ATOM 363 H ASN B 190 6.720 21.584 10.266 1.00 0.00 H ATOM 364 N PHE B 191 7.423 21.205 13.981 1.00 10.61 N ATOM 365 CA PHE B 191 8.747 21.351 14.561 1.00 10.54 C ATOM 366 C PHE B 191 8.744 21.087 16.050 1.00 10.53 C ATOM 367 O PHE B 191 7.677 20.973 16.673 1.00 10.78 O ATOM 368 CB PHE B 191 9.361 22.745 14.253 1.00 11.77 C ATOM 369 CG PHE B 191 8.472 23.928 14.587 1.00 10.61 C ATOM 370 CD1 PHE B 191 8.261 24.336 15.897 1.00 10.38 C ATOM 371 CD2 PHE B 191 7.904 24.672 13.561 1.00 9.61 C ATOM 372 CE1 PHE B 191 7.493 25.478 16.178 1.00 11.54 C ATOM 373 CE2 PHE B 191 7.140 25.809 13.837 1.00 10.50 C ATOM 374 CZ PHE B 191 6.935 26.212 15.136 1.00 9.62 C ATOM 375 HA PHE B 191 9.376 20.596 14.091 1.00 0.00 H ATOM 376 HB2 PHE B 191 9.538 22.779 13.178 1.00 0.00 H ATOM 377 HB3 PHE B 191 10.253 22.838 14.872 1.00 0.00 H ATOM 378 HD2 PHE B 191 8.056 24.365 12.526 1.00 0.00 H ATOM 379 HE2 PHE B 191 6.704 26.380 13.018 1.00 0.00 H ATOM 380 HZ PHE B 191 6.340 27.100 15.348 1.00 0.00 H ATOM 381 HE1 PHE B 191 7.334 25.789 17.211 1.00 0.00 H ATOM 382 HD1 PHE B 191 8.696 23.764 16.716 1.00 0.00 H ATOM 383 H PHE B 191 6.589 21.264 14.566 1.00 0.00 H ATOM 384 N LYS B 192 9.940 20.959 16.616 1.00 10.99 N ATOM 385 CA LYS B 192 10.096 20.737 18.053 1.00 11.63 C ATOM 386 C LYS B 192 10.842 21.907 18.681 1.00 11.41 C ATOM 387 O LYS B 192 11.652 22.566 18.020 1.00 11.66 O ATOM 388 CB LYS B 192 10.897 19.469 18.343 1.00 13.55 C ATOM 389 CG LYS B 192 10.203 18.179 17.955 1.00 16.42 C ATOM 390 CD LYS B 192 11.118 16.979 18.176 1.00 16.29 C ATOM 391 CE LYS B 192 10.425 15.696 17.779 1.00 20.36 C ATOM 392 NZ LYS B 192 9.145 15.584 18.514 1.00 21.38 N ATOM 393 HA LYS B 192 9.095 20.638 18.473 1.00 0.00 H ATOM 394 HB2 LYS B 192 11.054 19.433 19.421 1.00 0.00 H ATOM 395 HB3 LYS B 192 11.810 19.528 17.751 1.00 0.00 H ATOM 396 HG2 LYS B 192 9.939 18.228 16.899 1.00 0.00 H ATOM 397 HG3 LYS B 192 9.314 18.060 18.574 1.00 0.00 H ATOM 398 HD2 LYS B 192 11.379 16.925 19.233 1.00 0.00 H ATOM 399 HD3 LYS B 192 12.011 17.100 17.563 1.00 0.00 H ATOM 400 HE2 LYS B 192 10.231 15.703 16.706 1.00 0.00 H ATOM 401 HE3 LYS B 192 11.062 14.846 18.024 1.00 0.00 H ATOM 402 HZ1 LYS B 192 9.330 15.577 19.517 1.00 0.00 H ATOM 403 HZ2 LYS B 192 8.551 16.380 18.282 1.00 0.00 H ATOM 404 HZ3 LYS B 192 8.676 14.719 18.247 1.00 0.00 H ATOM 405 H LYS B 192 10.773 21.017 16.031 1.00 0.00 H ATOM 406 N ALA B 193 10.561 22.162 19.956 1.00 9.98 N ATOM 407 CA ALA B 193 11.234 23.235 20.680 1.00 10.79 C ATOM 408 C ALA B 193 12.740 23.039 20.494 1.00 9.79 C ATOM 409 O ALA B 193 13.261 21.910 20.619 1.00 11.56 O ATOM 410 CB ALA B 193 10.872 23.176 22.160 1.00 11.55 C ATOM 411 HA ALA B 193 10.926 24.209 20.299 1.00 0.00 H ATOM 412 HB1 ALA B 193 9.794 23.288 22.274 1.00 0.00 H ATOM 413 HB2 ALA B 193 11.184 22.216 22.571 1.00 0.00 H ATOM 414 HB3 ALA B 193 11.380 23.982 22.689 1.00 0.00 H ATOM 415 H ALA B 193 9.861 21.596 20.437 1.00 0.00 H ATOM 416 N GLY B 194 13.438 24.134 20.185 1.00 8.62 N ATOM 417 CA GLY B 194 14.871 24.074 19.970 1.00 9.30 C ATOM 418 C GLY B 194 15.254 24.130 18.502 1.00 8.25 C ATOM 419 O GLY B 194 16.364 24.512 18.154 1.00 10.08 O ATOM 420 HA3 GLY B 194 15.317 24.938 20.462 1.00 0.00 H ATOM 421 HA2 GLY B 194 15.227 23.125 20.370 1.00 0.00 H ATOM 422 H GLY B 194 12.955 25.028 20.099 1.00 0.00 H ATOM 423 N ASP B 195 14.330 23.744 17.628 1.00 8.91 N ATOM 424 CA ASP B 195 14.619 23.770 16.183 1.00 9.12 C ATOM 425 C ASP B 195 14.799 25.215 15.713 1.00 10.27 C ATOM 426 O ASP B 195 14.164 26.145 16.226 1.00 9.85 O ATOM 427 CB ASP B 195 13.465 23.201 15.353 1.00 8.32 C ATOM 428 CG ASP B 195 13.277 21.708 15.503 1.00 11.12 C ATOM 429 OD1 ASP B 195 14.166 21.010 16.053 1.00 11.54 O ATOM 430 OD2 ASP B 195 12.228 21.223 15.023 1.00 10.22 O ATOM 431 HA ASP B 195 15.518 23.170 16.041 1.00 0.00 H ATOM 432 HB2 ASP B 195 13.694 23.394 14.305 1.00 0.00 H ATOM 433 HB3 ASP B 195 12.550 23.679 15.702 1.00 0.00 H ATOM 434 H ASP B 195 13.418 23.429 17.958 1.00 0.00 H ATOM 435 N VAL B 196 15.668 25.404 14.732 1.00 9.56 N ATOM 436 CA VAL B 196 15.859 26.731 14.151 1.00 10.01 C ATOM 437 C VAL B 196 15.352 26.697 12.708 1.00 10.33 C ATOM 438 O VAL B 196 15.845 25.963 11.848 1.00 13.01 O ATOM 439 CB VAL B 196 17.324 27.201 14.282 1.00 10.01 C ATOM 440 CG1 VAL B 196 17.534 28.538 13.525 1.00 12.56 C ATOM 441 CG2 VAL B 196 17.630 27.428 15.769 1.00 12.05 C ATOM 442 HA VAL B 196 15.281 27.475 14.699 1.00 0.00 H ATOM 443 HB VAL B 196 17.983 26.444 13.857 1.00 0.00 H ATOM 444 HG11 VAL B 196 17.299 28.397 12.470 1.00 0.00 H ATOM 445 HG12 VAL B 196 16.878 29.300 13.946 1.00 0.00 H ATOM 446 HG13 VAL B 196 18.572 28.854 13.629 1.00 0.00 H ATOM 447 HG21 VAL B 196 16.957 28.189 16.165 1.00 0.00 H ATOM 448 HG22 VAL B 196 17.487 26.495 16.315 1.00 0.00 H ATOM 449 HG23 VAL B 196 18.662 27.761 15.880 1.00 0.00 H ATOM 450 H VAL B 196 16.210 24.615 14.378 1.00 0.00 H ATOM 451 N ILE B 197 14.325 27.509 12.487 1.00 9.19 N ATOM 452 CA ILE B 197 13.596 27.638 11.232 1.00 9.22 C ATOM 453 C ILE B 197 14.170 28.722 10.337 1.00 8.49 C ATOM 454 O ILE B 197 14.487 29.817 10.810 1.00 9.87 O ATOM 455 CB ILE B 197 12.115 28.017 11.556 1.00 8.83 C ATOM 456 CG1 ILE B 197 11.489 26.972 12.476 1.00 9.90 C ATOM 457 CG2 ILE B 197 11.276 28.153 10.279 1.00 9.19 C ATOM 458 CD1 ILE B 197 10.343 27.547 13.293 1.00 11.38 C ATOM 459 HA ILE B 197 13.672 26.686 10.706 1.00 0.00 H ATOM 460 HB ILE B 197 12.126 28.983 12.060 1.00 0.00 H ATOM 461 HG12 ILE B 197 12.257 26.621 13.165 1.00 0.00 H ATOM 462 HG13 ILE B 197 11.096 26.165 11.858 1.00 0.00 H ATOM 463 HD11 ILE B 197 10.713 28.366 13.909 1.00 0.00 H ATOM 464 HD12 ILE B 197 9.569 27.917 12.621 1.00 0.00 H ATOM 465 HD13 ILE B 197 9.928 26.768 13.933 1.00 0.00 H ATOM 466 HG21 ILE B 197 11.702 28.933 9.647 1.00 0.00 H ATOM 467 HG22 ILE B 197 11.280 27.205 9.741 1.00 0.00 H ATOM 468 HG23 ILE B 197 10.252 28.417 10.545 1.00 0.00 H ATOM 469 H ILE B 197 14.019 28.094 13.264 1.00 0.00 H ATOM 470 N PHE B 198 14.306 28.411 9.051 1.00 9.97 N ATOM 471 CA PHE B 198 14.775 29.388 8.070 1.00 9.58 C ATOM 472 C PHE B 198 13.537 30.151 7.618 1.00 9.43 C ATOM 473 O PHE B 198 12.599 29.563 7.072 1.00 10.86 O ATOM 474 CB PHE B 198 15.449 28.673 6.894 1.00 13.36 C ATOM 475 CG PHE B 198 16.863 28.253 7.182 1.00 17.79 C ATOM 476 CD1 PHE B 198 17.208 27.705 8.419 1.00 21.66 C ATOM 477 CD2 PHE B 198 17.854 28.407 6.219 1.00 22.10 C ATOM 478 CE1 PHE B 198 18.516 27.315 8.690 1.00 22.60 C ATOM 479 CE2 PHE B 198 19.162 28.022 6.478 1.00 24.16 C ATOM 480 CZ PHE B 198 19.493 27.472 7.717 1.00 23.11 C ATOM 481 HA PHE B 198 15.517 30.066 8.491 1.00 0.00 H ATOM 482 HB2 PHE B 198 15.478 29.371 6.058 1.00 0.00 H ATOM 483 HB3 PHE B 198 14.874 27.771 6.685 1.00 0.00 H ATOM 484 HD2 PHE B 198 17.601 28.835 5.249 1.00 0.00 H ATOM 485 HE2 PHE B 198 19.930 28.149 5.715 1.00 0.00 H ATOM 486 HZ PHE B 198 20.519 27.166 7.921 1.00 0.00 H ATOM 487 HE1 PHE B 198 18.772 26.889 9.660 1.00 0.00 H ATOM 488 HD1 PHE B 198 16.441 27.581 9.184 1.00 0.00 H ATOM 489 H PHE B 198 14.077 27.466 8.741 1.00 0.00 H ATOM 490 N LEU B 199 13.511 31.459 7.869 1.00 9.36 N ATOM 491 CA LEU B 199 12.330 32.242 7.523 1.00 9.62 C ATOM 492 C LEU B 199 12.234 32.557 6.049 1.00 11.40 C ATOM 493 O LEU B 199 13.243 32.857 5.414 1.00 13.28 O ATOM 494 CB LEU B 199 12.293 33.542 8.335 1.00 9.20 C ATOM 495 CG LEU B 199 12.188 33.357 9.843 1.00 9.46 C ATOM 496 CD1 LEU B 199 12.106 34.725 10.511 1.00 11.02 C ATOM 497 CD2 LEU B 199 10.945 32.521 10.200 1.00 10.40 C ATOM 498 HA LEU B 199 11.469 31.622 7.772 1.00 0.00 H ATOM 499 HB2 LEU B 199 11.400 34.083 8.022 1.00 0.00 H ATOM 500 HB3 LEU B 199 13.235 34.058 8.146 1.00 0.00 H ATOM 501 HG LEU B 199 13.071 32.827 10.200 1.00 0.00 H ATOM 502 HD21 LEU B 199 10.051 33.031 9.843 1.00 0.00 H ATOM 503 HD22 LEU B 199 11.019 31.542 9.727 1.00 0.00 H ATOM 504 HD23 LEU B 199 10.888 32.400 11.282 1.00 0.00 H ATOM 505 HD11 LEU B 199 13.002 35.298 10.274 1.00 0.00 H ATOM 506 HD12 LEU B 199 11.227 35.255 10.145 1.00 0.00 H ATOM 507 HD13 LEU B 199 12.031 34.597 11.591 1.00 0.00 H ATOM 508 H LEU B 199 14.316 31.912 8.302 1.00 0.00 H ATOM 509 N LEU B 200 11.011 32.493 5.513 1.00 9.91 N ATOM 510 CA LEU B 200 10.778 32.778 4.091 1.00 10.39 C ATOM 511 C LEU B 200 9.842 33.954 3.860 1.00 10.65 C ATOM 512 O LEU B 200 10.144 34.834 3.060 1.00 12.23 O ATOM 513 CB LEU B 200 10.201 31.549 3.363 1.00 11.06 C ATOM 514 CG LEU B 200 11.104 30.303 3.282 1.00 13.16 C ATOM 515 CD1 LEU B 200 10.326 29.104 2.717 1.00 11.99 C ATOM 516 CD2 LEU B 200 12.335 30.614 2.440 1.00 15.09 C ATOM 517 HA LEU B 200 11.757 33.035 3.686 1.00 0.00 H ATOM 518 HB2 LEU B 200 10.031 31.863 2.333 1.00 0.00 H ATOM 519 HB3 LEU B 200 9.324 31.247 3.935 1.00 0.00 H ATOM 520 HG LEU B 200 11.433 30.034 4.286 1.00 0.00 H ATOM 521 HD21 LEU B 200 12.024 30.901 1.436 1.00 0.00 H ATOM 522 HD22 LEU B 200 12.889 31.433 2.898 1.00 0.00 H ATOM 523 HD23 LEU B 200 12.970 29.730 2.386 1.00 0.00 H ATOM 524 HD11 LEU B 200 9.478 28.884 3.366 1.00 0.00 H ATOM 525 HD12 LEU B 200 9.966 29.345 1.717 1.00 0.00 H ATOM 526 HD13 LEU B 200 10.983 28.236 2.669 1.00 0.00 H ATOM 527 H LEU B 200 10.220 32.240 6.106 1.00 0.00 H ATOM 528 N SER B 201 8.703 33.988 4.545 1.00 10.51 N ATOM 529 CA SER B 201 7.771 35.083 4.319 1.00 10.13 C ATOM 530 C SER B 201 6.789 35.295 5.459 1.00 10.00 C ATOM 531 O SER B 201 6.666 34.466 6.362 1.00 10.07 O ATOM 532 CB SER B 201 6.993 34.848 3.029 1.00 13.20 C ATOM 533 OG SER B 201 5.975 33.877 3.202 1.00 15.08 O ATOM 534 HA SER B 201 8.378 35.985 4.249 1.00 0.00 H ATOM 535 HB2 SER B 201 6.526 35.787 2.733 1.00 0.00 H ATOM 536 HB3 SER B 201 7.687 34.487 2.270 1.00 0.00 H ATOM 537 HG SER B 201 6.370 33.045 3.473 1.00 0.00 H ATOM 538 H SER B 201 8.485 33.256 5.221 1.00 0.00 H ATOM 539 N ARG B 202 6.107 36.433 5.416 1.00 10.45 N ATOM 540 CA ARG B 202 5.094 36.795 6.410 1.00 9.54 C ATOM 541 C ARG B 202 3.747 36.428 5.793 1.00 10.01 C ATOM 542 O ARG B 202 3.416 36.882 4.698 1.00 11.99 O ATOM 543 CB ARG B 202 5.146 38.311 6.696 1.00 10.83 C ATOM 544 CG ARG B 202 4.090 38.799 7.687 1.00 10.31 C ATOM 545 CD ARG B 202 4.203 40.340 7.860 1.00 12.12 C ATOM 546 NE ARG B 202 3.202 40.892 8.783 1.00 11.11 N ATOM 547 CZ ARG B 202 1.909 41.073 8.511 1.00 12.22 C ATOM 548 NH1 ARG B 202 1.398 40.754 7.330 1.00 11.77 N ATOM 549 NH2 ARG B 202 1.107 41.590 9.437 1.00 14.56 N ATOM 550 HA ARG B 202 5.259 36.275 7.354 1.00 0.00 H ATOM 551 HB2 ARG B 202 4.961 38.823 5.751 1.00 0.00 H ATOM 552 HB3 ARG B 202 6.121 38.522 7.136 1.00 0.00 H ATOM 553 HG2 ARG B 202 4.249 38.315 8.651 1.00 0.00 H ATOM 554 HG3 ARG B 202 3.098 38.550 7.309 1.00 0.00 H ATOM 555 HD2 ARG B 202 5.188 40.555 8.273 1.00 0.00 H ATOM 556 HD3 ARG B 202 4.039 40.796 6.883 1.00 0.00 H ATOM 557 HE ARG B 202 3.524 41.160 9.713 1.00 0.00 H ATOM 558 HH12 ARG B 202 0.406 40.902 7.147 1.00 0.00 H ATOM 559 HH11 ARG B 202 1.997 40.360 6.605 1.00 0.00 H ATOM 560 HH22 ARG B 202 0.117 41.730 9.234 1.00 0.00 H ATOM 561 HH21 ARG B 202 1.481 41.846 10.351 1.00 0.00 H ATOM 562 H ARG B 202 6.297 37.086 4.656 1.00 0.00 H ATOM 563 N ILE B 203 2.962 35.597 6.479 1.00 10.99 N ATOM 564 CA ILE B 203 1.657 35.206 5.962 1.00 10.30 C ATOM 565 C ILE B 203 0.599 36.217 6.420 1.00 10.64 C ATOM 566 O ILE B 203 -0.240 36.677 5.625 1.00 11.02 O ATOM 567 CB ILE B 203 1.292 33.778 6.437 1.00 11.30 C ATOM 568 CG1 ILE B 203 2.347 32.782 5.936 1.00 11.83 C ATOM 569 CG2 ILE B 203 -0.106 33.384 5.935 1.00 11.68 C ATOM 570 CD1 ILE B 203 2.378 32.581 4.396 1.00 11.96 C ATOM 571 HA ILE B 203 1.691 35.200 4.873 1.00 0.00 H ATOM 572 HB ILE B 203 1.277 33.759 7.527 1.00 0.00 H ATOM 573 HG12 ILE B 203 2.102 31.815 6.375 1.00 0.00 H ATOM 574 HG13 ILE B 203 3.320 33.183 6.221 1.00 0.00 H ATOM 575 HD11 ILE B 203 1.410 32.208 4.060 1.00 0.00 H ATOM 576 HD12 ILE B 203 2.591 33.534 3.911 1.00 0.00 H ATOM 577 HD13 ILE B 203 3.155 31.860 4.140 1.00 0.00 H ATOM 578 HG21 ILE B 203 -0.842 34.086 6.326 1.00 0.00 H ATOM 579 HG22 ILE B 203 -0.120 33.409 4.845 1.00 0.00 H ATOM 580 HG23 ILE B 203 -0.344 32.378 6.279 1.00 0.00 H ATOM 581 H ILE B 203 3.279 35.230 7.377 1.00 0.00 H ATOM 582 N ASN B 204 0.594 36.523 7.713 1.00 9.13 N ATOM 583 CA ASN B 204 -0.298 37.559 8.241 1.00 8.89 C ATOM 584 C ASN B 204 0.278 37.959 9.584 1.00 10.42 C ATOM 585 O ASN B 204 1.408 37.582 9.872 1.00 10.66 O ATOM 586 CB ASN B 204 -1.781 37.107 8.294 1.00 10.05 C ATOM 587 CG ASN B 204 -2.127 36.296 9.507 1.00 12.22 C ATOM 588 OD1 ASN B 204 -1.263 35.708 10.134 1.00 11.21 O ATOM 589 ND2 ASN B 204 -3.419 36.247 9.843 1.00 16.02 N ATOM 590 HA ASN B 204 -0.337 38.425 7.580 1.00 0.00 H ATOM 591 HB2 ASN B 204 -1.959 36.478 7.422 1.00 0.00 H ATOM 592 HB3 ASN B 204 -2.393 38.008 8.322 1.00 0.00 H ATOM 593 HD22 ASN B 204 -4.109 36.755 9.290 1.00 0.00 H ATOM 594 HD21 ASN B 204 -3.715 35.702 10.653 1.00 0.00 H ATOM 595 H ASN B 204 1.221 36.029 8.348 1.00 0.00 H ATOM 596 N LYS B 205 -0.457 38.697 10.408 1.00 10.86 N ATOM 597 CA LYS B 205 0.141 39.129 11.667 1.00 11.85 C ATOM 598 C LYS B 205 0.474 38.015 12.650 1.00 12.05 C ATOM 599 O LYS B 205 1.353 38.190 13.500 1.00 13.11 O ATOM 600 CB LYS B 205 -0.759 40.140 12.378 1.00 13.78 C ATOM 601 CG LYS B 205 -2.077 39.564 12.806 1.00 18.31 C ATOM 602 CD LYS B 205 -2.857 40.572 13.600 1.00 21.68 C ATOM 603 CE LYS B 205 -4.175 39.983 14.033 1.00 25.00 C ATOM 604 NZ LYS B 205 -4.960 40.959 14.820 1.00 28.99 N ATOM 605 HA LYS B 205 1.089 39.575 11.366 1.00 0.00 H ATOM 606 HB2 LYS B 205 -0.965 40.948 11.676 1.00 0.00 H ATOM 607 HB3 LYS B 205 -0.237 40.471 13.276 1.00 0.00 H ATOM 608 HG2 LYS B 205 -1.896 38.687 13.427 1.00 0.00 H ATOM 609 HG3 LYS B 205 -2.649 39.291 11.919 1.00 0.00 H ATOM 610 HD2 LYS B 205 -3.044 41.449 12.980 1.00 0.00 H ATOM 611 HD3 LYS B 205 -2.283 40.853 14.483 1.00 0.00 H ATOM 612 HE2 LYS B 205 -4.745 39.712 13.144 1.00 0.00 H ATOM 613 HE3 LYS B 205 -3.980 39.109 14.655 1.00 0.00 H ATOM 614 HZ1 LYS B 205 -4.432 41.227 15.651 1.00 0.00 H ATOM 615 HZ2 LYS B 205 -5.142 41.785 14.250 1.00 0.00 H ATOM 616 HZ3 LYS B 205 -5.845 40.535 15.099 1.00 0.00 H ATOM 617 H LYS B 205 -1.414 38.955 10.167 1.00 0.00 H ATOM 618 N ASP B 206 -0.201 36.877 12.524 1.00 10.43 N ATOM 619 CA ASP B 206 0.018 35.761 13.444 1.00 11.41 C ATOM 620 C ASP B 206 0.799 34.599 12.875 1.00 10.54 C ATOM 621 O ASP B 206 1.240 33.749 13.645 1.00 11.31 O ATOM 622 CB ASP B 206 -1.320 35.184 13.943 1.00 12.89 C ATOM 623 CG ASP B 206 -2.159 36.198 14.689 1.00 15.43 C ATOM 624 OD1 ASP B 206 -1.588 36.919 15.518 1.00 17.80 O ATOM 625 OD2 ASP B 206 -3.380 36.260 14.437 1.00 18.95 O ATOM 626 HA ASP B 206 0.607 36.208 14.245 1.00 0.00 H ATOM 627 HB2 ASP B 206 -1.094 34.369 14.631 1.00 0.00 H ATOM 628 HB3 ASP B 206 -1.888 34.860 13.071 1.00 0.00 H ATOM 629 H ASP B 206 -0.884 36.780 11.772 1.00 0.00 H ATOM 630 N TRP B 207 0.953 34.536 11.556 1.00 9.75 N ATOM 631 CA TRP B 207 1.614 33.414 10.913 1.00 10.03 C ATOM 632 C TRP B 207 2.760 33.794 9.998 1.00 9.55 C ATOM 633 O TRP B 207 2.688 34.792 9.283 1.00 10.03 O ATOM 634 CB TRP B 207 0.608 32.603 10.079 1.00 9.97 C ATOM 635 CG TRP B 207 -0.524 31.991 10.873 1.00 9.09 C ATOM 636 CD1 TRP B 207 -1.659 32.626 11.320 1.00 11.13 C ATOM 637 CD2 TRP B 207 -0.618 30.632 11.331 1.00 9.50 C ATOM 638 NE1 TRP B 207 -2.453 31.740 12.033 1.00 11.69 N ATOM 639 CE2 TRP B 207 -1.833 30.515 12.056 1.00 10.14 C ATOM 640 CE3 TRP B 207 0.203 29.499 11.198 1.00 9.92 C ATOM 641 CZ2 TRP B 207 -2.242 29.306 12.648 1.00 9.97 C ATOM 642 CZ3 TRP B 207 -0.208 28.292 11.784 1.00 11.15 C ATOM 643 CH2 TRP B 207 -1.421 28.211 12.501 1.00 10.96 C ATOM 644 HA TRP B 207 2.027 32.833 11.737 1.00 0.00 H ATOM 645 HB2 TRP B 207 1.161 31.779 9.629 1.00 0.00 H ATOM 646 HB3 TRP B 207 0.158 33.294 9.366 1.00 0.00 H ATOM 647 HE1 TRP B 207 -3.349 31.962 12.468 1.00 0.00 H ATOM 648 HD1 TRP B 207 -1.900 33.674 11.140 1.00 0.00 H ATOM 649 HZ2 TRP B 207 -3.177 29.239 13.204 1.00 0.00 H ATOM 650 HH2 TRP B 207 -1.714 27.261 12.948 1.00 0.00 H ATOM 651 HZ3 TRP B 207 0.418 27.405 11.684 1.00 0.00 H ATOM 652 HE3 TRP B 207 1.143 29.557 10.649 1.00 0.00 H ATOM 653 H TRP B 207 0.597 35.298 10.979 1.00 0.00 H ATOM 654 N LEU B 208 3.817 32.985 10.054 1.00 9.22 N ATOM 655 CA LEU B 208 4.993 33.137 9.191 1.00 8.91 C ATOM 656 C LEU B 208 5.162 31.861 8.380 1.00 9.82 C ATOM 657 O LEU B 208 4.541 30.839 8.673 1.00 11.11 O ATOM 658 CB LEU B 208 6.269 33.352 10.012 1.00 11.13 C ATOM 659 CG LEU B 208 6.338 34.602 10.896 1.00 10.44 C ATOM 660 CD1 LEU B 208 7.694 34.619 11.613 1.00 12.67 C ATOM 661 CD2 LEU B 208 6.161 35.863 10.073 1.00 11.89 C ATOM 662 HA LEU B 208 4.839 34.006 8.551 1.00 0.00 H ATOM 663 HB2 LEU B 208 7.072 33.463 9.283 1.00 0.00 H ATOM 664 HB3 LEU B 208 6.324 32.505 10.696 1.00 0.00 H ATOM 665 HG LEU B 208 5.529 34.572 11.626 1.00 0.00 H ATOM 666 HD21 LEU B 208 6.951 35.921 9.324 1.00 0.00 H ATOM 667 HD22 LEU B 208 5.190 35.839 9.578 1.00 0.00 H ATOM 668 HD23 LEU B 208 6.215 36.733 10.727 1.00 0.00 H ATOM 669 HD11 LEU B 208 7.790 33.723 12.227 1.00 0.00 H ATOM 670 HD12 LEU B 208 8.494 34.642 10.873 1.00 0.00 H ATOM 671 HD13 LEU B 208 7.758 35.504 12.246 1.00 0.00 H ATOM 672 H LEU B 208 3.808 32.222 10.731 1.00 0.00 H ATOM 673 N GLU B 209 6.018 31.925 7.371 1.00 9.94 N ATOM 674 CA GLU B 209 6.310 30.757 6.548 1.00 9.53 C ATOM 675 C GLU B 209 7.803 30.506 6.662 1.00 9.45 C ATOM 676 O GLU B 209 8.608 31.445 6.623 1.00 10.55 O ATOM 677 CB GLU B 209 5.970 31.004 5.087 1.00 11.72 C ATOM 678 CG GLU B 209 6.084 29.756 4.254 1.00 12.64 C ATOM 679 CD GLU B 209 6.353 30.011 2.782 1.00 12.79 C ATOM 680 OE1 GLU B 209 6.333 31.164 2.306 1.00 13.99 O ATOM 681 OE2 GLU B 209 6.606 29.006 2.078 1.00 17.56 O ATOM 682 HA GLU B 209 5.716 29.909 6.890 1.00 0.00 H ATOM 683 HB2 GLU B 209 6.675 31.737 4.695 1.00 0.00 H ATOM 684 HB3 GLU B 209 4.938 31.352 5.034 1.00 0.00 H ATOM 685 HG2 GLU B 209 5.128 29.237 4.320 1.00 0.00 H ATOM 686 HG3 GLU B 209 6.930 29.188 4.641 1.00 0.00 H ATOM 687 H GLU B 209 6.482 32.810 7.165 1.00 0.00 H ATOM 688 N GLY B 210 8.181 29.237 6.791 1.00 8.79 N ATOM 689 CA GLY B 210 9.581 28.915 6.894 1.00 8.97 C ATOM 690 C GLY B 210 9.877 27.482 6.539 1.00 8.59 C ATOM 691 O GLY B 210 8.983 26.733 6.176 1.00 9.83 O ATOM 692 HA3 GLY B 210 10.123 29.551 6.194 1.00 0.00 H ATOM 693 HA2 GLY B 210 9.885 29.072 7.929 1.00 0.00 H ATOM 694 H GLY B 210 7.482 28.495 6.817 1.00 0.00 H ATOM 695 N THR B 211 11.150 27.121 6.659 1.00 9.62 N ATOM 696 CA THR B 211 11.619 25.784 6.344 1.00 9.99 C ATOM 697 C THR B 211 12.414 25.214 7.511 1.00 10.82 C ATOM 698 O THR B 211 13.257 25.884 8.102 1.00 11.79 O ATOM 699 CB THR B 211 12.519 25.826 5.095 1.00 11.45 C ATOM 700 OG1 THR B 211 11.756 26.327 3.985 1.00 13.95 O ATOM 701 CG2 THR B 211 13.066 24.431 4.760 1.00 11.79 C ATOM 702 HA THR B 211 10.753 25.150 6.154 1.00 0.00 H ATOM 703 HB THR B 211 13.366 26.482 5.295 1.00 0.00 H ATOM 704 HG1 THR B 211 11.007 25.748 3.826 1.00 0.00 H ATOM 705 HG23 THR B 211 13.644 24.056 5.605 1.00 0.00 H ATOM 706 HG21 THR B 211 12.235 23.755 4.558 1.00 0.00 H ATOM 707 HG22 THR B 211 13.706 24.495 3.880 1.00 0.00 H ATOM 708 H THR B 211 11.825 27.812 6.986 1.00 0.00 H ATOM 709 N VAL B 212 12.103 23.973 7.857 1.00 10.01 N ATOM 710 CA VAL B 212 12.794 23.259 8.927 1.00 11.15 C ATOM 711 C VAL B 212 12.532 21.748 8.755 1.00 11.88 C ATOM 712 O VAL B 212 11.474 21.331 8.250 1.00 11.49 O ATOM 713 CB VAL B 212 12.330 23.749 10.319 1.00 12.31 C ATOM 714 CG1 VAL B 212 10.985 23.115 10.685 1.00 13.45 C ATOM 715 CG2 VAL B 212 13.414 23.460 11.359 1.00 13.48 C ATOM 716 HA VAL B 212 13.864 23.456 8.864 1.00 0.00 H ATOM 717 HB VAL B 212 12.177 24.828 10.297 1.00 0.00 H ATOM 718 HG11 VAL B 212 10.239 23.395 9.942 1.00 0.00 H ATOM 719 HG12 VAL B 212 11.090 22.030 10.706 1.00 0.00 H ATOM 720 HG13 VAL B 212 10.673 23.470 11.667 1.00 0.00 H ATOM 721 HG21 VAL B 212 13.601 22.387 11.398 1.00 0.00 H ATOM 722 HG22 VAL B 212 14.331 23.980 11.081 1.00 0.00 H ATOM 723 HG23 VAL B 212 13.080 23.808 12.336 1.00 0.00 H ATOM 724 H VAL B 212 11.352 23.498 7.356 1.00 0.00 H ATOM 725 N ARG B 213 13.512 20.940 9.157 1.00 11.67 N ATOM 726 CA ARG B 213 13.411 19.482 9.026 1.00 12.16 C ATOM 727 C ARG B 213 13.072 19.062 7.590 1.00 13.84 C ATOM 728 O ARG B 213 12.343 18.107 7.366 1.00 15.52 O ATOM 729 CB ARG B 213 12.383 18.929 10.018 1.00 12.75 C ATOM 730 CG ARG B 213 12.871 19.015 11.448 1.00 14.06 C ATOM 731 CD ARG B 213 11.775 18.715 12.444 1.00 14.85 C ATOM 732 NE ARG B 213 12.309 18.838 13.795 1.00 15.70 N ATOM 733 CZ ARG B 213 12.821 17.834 14.492 1.00 19.22 C ATOM 734 NH1 ARG B 213 12.837 16.615 13.971 1.00 20.55 N ATOM 735 NH2 ARG B 213 13.397 18.068 15.663 1.00 17.55 N ATOM 736 HA ARG B 213 14.386 19.057 9.262 1.00 0.00 H ATOM 737 HB2 ARG B 213 12.210 17.880 9.780 1.00 0.00 H ATOM 738 HB3 ARG B 213 11.473 19.523 9.932 1.00 0.00 H ATOM 739 HG2 ARG B 213 13.222 20.031 11.626 1.00 0.00 H ATOM 740 HG3 ARG B 213 13.662 18.277 11.581 1.00 0.00 H ATOM 741 HD2 ARG B 213 10.955 19.420 12.309 1.00 0.00 H ATOM 742 HD3 ARG B 213 11.405 17.702 12.287 1.00 0.00 H ATOM 743 HE ARG B 213 12.287 19.759 14.233 1.00 0.00 H ATOM 744 HH12 ARG B 213 13.230 15.838 14.503 1.00 0.00 H ATOM 745 HH11 ARG B 213 12.457 16.454 13.038 1.00 0.00 H ATOM 746 HH22 ARG B 213 13.792 17.296 16.201 1.00 0.00 H ATOM 747 HH21 ARG B 213 13.446 19.020 16.026 1.00 0.00 H ATOM 748 H ARG B 213 14.354 21.345 9.566 1.00 0.00 H ATOM 749 N GLY B 214 13.606 19.789 6.616 1.00 13.80 N ATOM 750 CA GLY B 214 13.372 19.432 5.216 1.00 13.97 C ATOM 751 C GLY B 214 11.962 19.635 4.681 1.00 15.43 C ATOM 752 O GLY B 214 11.566 19.037 3.676 1.00 17.87 O ATOM 753 HA3 GLY B 214 14.012 20.091 4.629 1.00 0.00 H ATOM 754 HA2 GLY B 214 13.568 18.362 5.144 1.00 0.00 H ATOM 755 H GLY B 214 14.182 20.600 6.844 1.00 0.00 H ATOM 756 N ALA B 215 11.189 20.475 5.351 1.00 12.64 N ATOM 757 CA ALA B 215 9.834 20.752 4.902 1.00 12.67 C ATOM 758 C ALA B 215 9.556 22.256 5.005 1.00 11.37 C ATOM 759 O ALA B 215 10.240 22.975 5.723 1.00 11.96 O ATOM 760 CB ALA B 215 8.835 19.966 5.732 1.00 13.29 C ATOM 761 HA ALA B 215 9.730 20.444 3.862 1.00 0.00 H ATOM 762 HB1 ALA B 215 9.035 18.900 5.626 1.00 0.00 H ATOM 763 HB2 ALA B 215 8.930 20.252 6.779 1.00 0.00 H ATOM 764 HB3 ALA B 215 7.825 20.183 5.384 1.00 0.00 H ATOM 765 H ALA B 215 11.547 20.932 6.190 1.00 0.00 H ATOM 766 N THR B 216 8.567 22.722 4.257 1.00 12.14 N ATOM 767 CA THR B 216 8.211 24.142 4.234 1.00 10.58 C ATOM 768 C THR B 216 6.736 24.308 4.531 1.00 12.52 C ATOM 769 O THR B 216 5.905 23.519 4.072 1.00 14.36 O ATOM 770 CB THR B 216 8.526 24.731 2.848 1.00 12.16 C ATOM 771 OG1 THR B 216 9.932 24.631 2.610 1.00 13.87 O ATOM 772 CG2 THR B 216 8.116 26.182 2.760 1.00 12.59 C ATOM 773 HA THR B 216 8.791 24.668 4.993 1.00 0.00 H ATOM 774 HB THR B 216 7.965 24.170 2.101 1.00 0.00 H ATOM 775 HG1 THR B 216 10.406 25.121 3.286 1.00 0.00 H ATOM 776 HG23 THR B 216 7.044 26.267 2.940 1.00 0.00 H ATOM 777 HG21 THR B 216 8.659 26.758 3.510 1.00 0.00 H ATOM 778 HG22 THR B 216 8.350 26.565 1.767 1.00 0.00 H ATOM 779 H THR B 216 8.036 22.071 3.678 1.00 0.00 H ATOM 780 N GLY B 217 6.397 25.330 5.309 1.00 10.42 N ATOM 781 CA GLY B 217 4.996 25.547 5.623 1.00 10.81 C ATOM 782 C GLY B 217 4.822 26.717 6.574 1.00 9.48 C ATOM 783 O GLY B 217 5.800 27.392 6.928 1.00 10.70 O ATOM 784 HA3 GLY B 217 4.462 25.767 4.699 1.00 0.00 H ATOM 785 HA2 GLY B 217 4.603 24.649 6.100 1.00 0.00 H ATOM 786 H GLY B 217 7.112 25.955 5.681 1.00 0.00 H ATOM 787 N ILE B 218 3.582 26.945 7.010 1.00 9.36 N ATOM 788 CA ILE B 218 3.308 28.078 7.883 1.00 9.57 C ATOM 789 C ILE B 218 3.229 27.680 9.360 1.00 9.56 C ATOM 790 O ILE B 218 2.979 26.517 9.709 1.00 9.77 O ATOM 791 CB ILE B 218 2.013 28.843 7.433 1.00 9.30 C ATOM 792 CG1 ILE B 218 0.742 28.044 7.740 1.00 9.88 C ATOM 793 CG2 ILE B 218 2.082 29.136 5.901 1.00 9.96 C ATOM 794 CD1 ILE B 218 -0.538 28.891 7.592 1.00 11.97 C ATOM 795 HA ILE B 218 4.156 28.756 7.787 1.00 0.00 H ATOM 796 HB ILE B 218 1.968 29.776 7.995 1.00 0.00 H ATOM 797 HG12 ILE B 218 0.801 27.702 8.773 1.00 0.00 H ATOM 798 HG13 ILE B 218 0.683 27.219 7.030 1.00 0.00 H ATOM 799 HD11 ILE B 218 -0.496 29.734 8.282 1.00 0.00 H ATOM 800 HD12 ILE B 218 -0.612 29.260 6.569 1.00 0.00 H ATOM 801 HD13 ILE B 218 -1.408 28.276 7.821 1.00 0.00 H ATOM 802 HG21 ILE B 218 2.958 29.750 5.689 1.00 0.00 H ATOM 803 HG22 ILE B 218 2.155 28.195 5.355 1.00 0.00 H ATOM 804 HG23 ILE B 218 1.181 29.667 5.593 1.00 0.00 H ATOM 805 H ILE B 218 2.823 26.323 6.731 1.00 0.00 H ATOM 806 N PHE B 219 3.457 28.650 10.235 1.00 8.52 N ATOM 807 CA PHE B 219 3.450 28.361 11.672 1.00 8.23 C ATOM 808 C PHE B 219 3.199 29.647 12.443 1.00 8.41 C ATOM 809 O PHE B 219 3.354 30.746 11.899 1.00 8.77 O ATOM 810 CB PHE B 219 4.794 27.734 12.077 1.00 9.13 C ATOM 811 CG PHE B 219 5.974 28.639 11.864 1.00 8.84 C ATOM 812 CD1 PHE B 219 6.364 29.522 12.867 1.00 8.58 C ATOM 813 CD2 PHE B 219 6.654 28.674 10.630 1.00 9.92 C ATOM 814 CE1 PHE B 219 7.412 30.437 12.654 1.00 9.23 C ATOM 815 CE2 PHE B 219 7.687 29.574 10.414 1.00 8.54 C ATOM 816 CZ PHE B 219 8.074 30.462 11.421 1.00 9.68 C ATOM 817 HA PHE B 219 2.655 27.653 11.906 1.00 0.00 H ATOM 818 HB2 PHE B 219 4.943 26.853 11.452 1.00 0.00 H ATOM 819 HB3 PHE B 219 4.742 27.514 13.143 1.00 0.00 H ATOM 820 HD2 PHE B 219 6.365 27.986 9.836 1.00 0.00 H ATOM 821 HE2 PHE B 219 8.200 29.589 9.452 1.00 0.00 H ATOM 822 HZ PHE B 219 8.885 31.169 11.248 1.00 0.00 H ATOM 823 HE1 PHE B 219 7.707 31.124 13.447 1.00 0.00 H ATOM 824 HD1 PHE B 219 5.852 29.505 13.829 1.00 0.00 H ATOM 825 H PHE B 219 3.638 29.599 9.907 1.00 0.00 H ATOM 826 N PRO B 220 2.799 29.541 13.725 1.00 8.37 N ATOM 827 CA PRO B 220 2.537 30.744 14.519 1.00 8.16 C ATOM 828 C PRO B 220 3.771 31.476 15.026 1.00 9.57 C ATOM 829 O PRO B 220 4.666 30.868 15.630 1.00 9.33 O ATOM 830 CB PRO B 220 1.707 30.221 15.703 1.00 10.11 C ATOM 831 CG PRO B 220 1.245 28.843 15.282 1.00 9.65 C ATOM 832 CD PRO B 220 2.407 28.333 14.481 1.00 9.79 C ATOM 833 HA PRO B 220 2.042 31.493 13.901 1.00 0.00 H ATOM 834 HD3 PRO B 220 2.159 27.483 13.846 1.00 0.00 H ATOM 835 HD2 PRO B 220 3.210 27.922 15.092 1.00 0.00 H ATOM 836 HG3 PRO B 220 0.999 28.201 16.128 1.00 0.00 H ATOM 837 HG2 PRO B 220 0.315 28.862 14.715 1.00 0.00 H ATOM 838 HB2 PRO B 220 0.866 30.877 15.927 1.00 0.00 H ATOM 839 HB3 PRO B 220 2.292 30.187 16.622 1.00 0.00 H ATOM 840 N LEU B 221 3.789 32.786 14.809 1.00 8.78 N ATOM 841 CA LEU B 221 4.853 33.652 15.283 1.00 8.29 C ATOM 842 C LEU B 221 5.015 33.486 16.805 1.00 8.89 C ATOM 843 O LEU B 221 6.130 33.519 17.326 1.00 9.21 O ATOM 844 CB LEU B 221 4.487 35.116 14.973 1.00 11.30 C ATOM 845 CG LEU B 221 5.317 36.223 15.614 1.00 13.12 C ATOM 846 CD1 LEU B 221 6.739 36.117 15.092 1.00 13.98 C ATOM 847 CD2 LEU B 221 4.699 37.595 15.306 1.00 14.11 C ATOM 848 HA LEU B 221 5.786 33.387 14.786 1.00 0.00 H ATOM 849 HB2 LEU B 221 3.480 35.249 15.369 1.00 0.00 H ATOM 850 HB3 LEU B 221 4.642 35.228 13.900 1.00 0.00 H ATOM 851 HG LEU B 221 5.328 36.113 16.698 1.00 0.00 H ATOM 852 HD21 LEU B 221 4.673 37.747 14.227 1.00 0.00 H ATOM 853 HD22 LEU B 221 3.685 37.633 15.704 1.00 0.00 H ATOM 854 HD23 LEU B 221 5.302 38.376 15.770 1.00 0.00 H ATOM 855 HD11 LEU B 221 7.149 35.142 15.355 1.00 0.00 H ATOM 856 HD12 LEU B 221 6.736 36.231 14.008 1.00 0.00 H ATOM 857 HD13 LEU B 221 7.349 36.902 15.540 1.00 0.00 H ATOM 858 H LEU B 221 3.020 33.203 14.285 1.00 0.00 H ATOM 859 N SER B 222 3.911 33.292 17.520 1.00 9.39 N ATOM 860 CA SER B 222 4.013 33.195 18.964 1.00 8.91 C ATOM 861 C SER B 222 4.746 31.973 19.488 1.00 9.43 C ATOM 862 O SER B 222 5.085 31.921 20.664 1.00 10.96 O ATOM 863 CB SER B 222 2.616 33.245 19.580 1.00 10.05 C ATOM 864 OG SER B 222 1.891 32.117 19.190 1.00 11.28 O ATOM 865 HA SER B 222 4.621 34.049 19.263 1.00 0.00 H ATOM 866 HB2 SER B 222 2.700 33.264 20.667 1.00 0.00 H ATOM 867 HB3 SER B 222 2.101 34.143 19.237 1.00 0.00 H ATOM 868 HG SER B 222 1.014 32.152 19.579 1.00 0.00 H ATOM 869 H SER B 222 3.004 33.212 17.059 1.00 0.00 H ATOM 870 N PHE B 223 5.015 31.012 18.622 1.00 7.65 N ATOM 871 CA PHE B 223 5.695 29.800 19.056 1.00 7.71 C ATOM 872 C PHE B 223 7.210 29.901 18.923 1.00 9.22 C ATOM 873 O PHE B 223 7.917 28.977 19.308 1.00 9.66 O ATOM 874 CB PHE B 223 5.203 28.615 18.220 1.00 8.58 C ATOM 875 CG PHE B 223 3.918 27.992 18.707 1.00 8.49 C ATOM 876 CD1 PHE B 223 2.761 28.754 18.860 1.00 9.34 C ATOM 877 CD2 PHE B 223 3.860 26.632 18.980 1.00 8.99 C ATOM 878 CE1 PHE B 223 1.564 28.147 19.281 1.00 8.80 C ATOM 879 CE2 PHE B 223 2.673 26.035 19.396 1.00 9.24 C ATOM 880 CZ PHE B 223 1.531 26.798 19.543 1.00 10.36 C ATOM 881 HA PHE B 223 5.462 29.658 20.111 1.00 0.00 H ATOM 882 HB2 PHE B 223 5.972 27.844 18.278 1.00 0.00 H ATOM 883 HB3 PHE B 223 5.012 28.992 17.215 1.00 0.00 H ATOM 884 HD2 PHE B 223 4.757 26.023 18.867 1.00 0.00 H ATOM 885 HE2 PHE B 223 2.645 24.966 19.606 1.00 0.00 H ATOM 886 HZ PHE B 223 0.602 26.329 19.867 1.00 0.00 H ATOM 887 HE1 PHE B 223 0.662 28.747 19.400 1.00 0.00 H ATOM 888 HD1 PHE B 223 2.784 29.824 18.653 1.00 0.00 H ATOM 889 H PHE B 223 4.745 31.120 17.644 1.00 0.00 H ATOM 890 N VAL B 224 7.710 31.026 18.423 1.00 8.27 N ATOM 891 CA VAL B 224 9.136 31.170 18.154 1.00 9.15 C ATOM 892 C VAL B 224 9.757 32.460 18.642 1.00 9.42 C ATOM 893 O VAL B 224 9.064 33.404 19.030 1.00 10.36 O ATOM 894 CB VAL B 224 9.405 31.099 16.602 1.00 8.88 C ATOM 895 CG1 VAL B 224 8.731 29.871 16.019 1.00 9.55 C ATOM 896 CG2 VAL B 224 8.885 32.374 15.901 1.00 8.76 C ATOM 897 HA VAL B 224 9.595 30.350 18.706 1.00 0.00 H ATOM 898 HB VAL B 224 10.480 31.030 16.437 1.00 0.00 H ATOM 899 HG11 VAL B 224 9.132 28.977 16.496 1.00 0.00 H ATOM 900 HG12 VAL B 224 7.657 29.929 16.197 1.00 0.00 H ATOM 901 HG13 VAL B 224 8.921 29.828 14.947 1.00 0.00 H ATOM 902 HG21 VAL B 224 7.812 32.468 16.070 1.00 0.00 H ATOM 903 HG22 VAL B 224 9.396 33.246 16.309 1.00 0.00 H ATOM 904 HG23 VAL B 224 9.081 32.304 14.831 1.00 0.00 H ATOM 905 H VAL B 224 7.083 31.805 18.223 1.00 0.00 H ATOM 906 N LYS B 225 11.086 32.461 18.638 1.00 9.08 N ATOM 907 CA LYS B 225 11.863 33.649 18.954 1.00 9.40 C ATOM 908 C LYS B 225 12.597 34.028 17.669 1.00 9.39 C ATOM 909 O LYS B 225 13.319 33.200 17.111 1.00 10.19 O ATOM 910 CB LYS B 225 12.906 33.364 20.036 1.00 11.31 C ATOM 911 CG LYS B 225 13.857 34.533 20.229 1.00 11.78 C ATOM 912 CD LYS B 225 14.974 34.202 21.211 1.00 13.10 C ATOM 913 CE LYS B 225 15.899 35.397 21.353 1.00 15.21 C ATOM 914 NZ LYS B 225 16.899 35.229 22.445 1.00 16.63 N ATOM 915 HA LYS B 225 11.207 34.438 19.321 1.00 0.00 H ATOM 916 HB2 LYS B 225 13.489 32.496 19.728 1.00 0.00 H ATOM 917 HB3 LYS B 225 12.384 33.190 20.977 1.00 0.00 H ATOM 918 HG2 LYS B 225 13.289 35.373 20.629 1.00 0.00 H ATOM 919 HG3 LYS B 225 14.308 34.769 19.265 1.00 0.00 H ATOM 920 HD2 LYS B 225 15.541 33.348 20.840 1.00 0.00 H ATOM 921 HD3 LYS B 225 14.542 33.961 22.182 1.00 0.00 H ATOM 922 HE2 LYS B 225 16.445 35.509 20.416 1.00 0.00 H ATOM 923 HE3 LYS B 225 15.286 36.266 21.593 1.00 0.00 H ATOM 924 HZ1 LYS B 225 16.413 35.104 23.333 1.00 0.00 H ATOM 925 HZ2 LYS B 225 17.476 34.410 22.253 1.00 0.00 H ATOM 926 HZ3 LYS B 225 17.490 36.059 22.493 1.00 0.00 H ATOM 927 H LYS B 225 11.578 31.598 18.405 1.00 0.00 H ATOM 928 N ILE B 226 12.379 35.238 17.163 1.00 8.95 N ATOM 929 CA ILE B 226 13.108 35.709 15.982 1.00 10.38 C ATOM 930 C ILE B 226 14.540 35.966 16.469 1.00 9.71 C ATOM 931 O ILE B 226 14.731 36.687 17.438 1.00 10.65 O ATOM 932 CB ILE B 226 12.514 37.024 15.447 1.00 10.93 C ATOM 933 CG1 ILE B 226 11.033 36.829 15.107 1.00 15.71 C ATOM 934 CG2 ILE B 226 13.298 37.505 14.219 1.00 10.64 C ATOM 935 CD1 ILE B 226 10.763 35.760 14.079 1.00 16.54 C ATOM 936 HA ILE B 226 13.056 34.979 15.174 1.00 0.00 H ATOM 937 HB ILE B 226 12.594 37.789 16.219 1.00 0.00 H ATOM 938 HG12 ILE B 226 10.675 37.770 14.690 1.00 0.00 H ATOM 939 HG13 ILE B 226 10.533 36.522 16.025 1.00 0.00 H ATOM 940 HD11 ILE B 226 11.271 36.015 13.149 1.00 0.00 H ATOM 941 HD12 ILE B 226 11.133 34.803 14.446 1.00 0.00 H ATOM 942 HD13 ILE B 226 9.690 35.692 13.901 1.00 0.00 H ATOM 943 HG21 ILE B 226 14.339 37.672 14.497 1.00 0.00 H ATOM 944 HG22 ILE B 226 13.246 36.748 13.437 1.00 0.00 H ATOM 945 HG23 ILE B 226 12.864 38.436 13.854 1.00 0.00 H ATOM 946 H ILE B 226 11.692 35.849 17.605 1.00 0.00 H ATOM 947 N LEU B 227 15.532 35.377 15.802 1.00 9.48 N ATOM 948 CA LEU B 227 16.917 35.526 16.226 1.00 9.70 C ATOM 949 C LEU B 227 17.572 36.784 15.673 1.00 11.23 C ATOM 950 O LEU B 227 17.087 37.386 14.707 1.00 12.51 O ATOM 951 CB LEU B 227 17.717 34.271 15.837 1.00 11.45 C ATOM 952 CG LEU B 227 17.120 32.952 16.375 1.00 10.37 C ATOM 953 CD1 LEU B 227 17.977 31.773 15.970 1.00 11.51 C ATOM 954 CD2 LEU B 227 17.003 33.008 17.894 1.00 11.37 C ATOM 955 HA LEU B 227 16.918 35.636 17.310 1.00 0.00 H ATOM 956 HB2 LEU B 227 18.712 34.375 16.270 1.00 0.00 H ATOM 957 HB3 LEU B 227 17.710 34.208 14.749 1.00 0.00 H ATOM 958 HG LEU B 227 16.127 32.826 15.944 1.00 0.00 H ATOM 959 HD21 LEU B 227 17.992 33.156 18.328 1.00 0.00 H ATOM 960 HD22 LEU B 227 16.353 33.836 18.177 1.00 0.00 H ATOM 961 HD23 LEU B 227 16.581 32.072 18.259 1.00 0.00 H ATOM 962 HD11 LEU B 227 18.029 31.719 14.883 1.00 0.00 H ATOM 963 HD12 LEU B 227 18.980 31.898 16.377 1.00 0.00 H ATOM 964 HD13 LEU B 227 17.537 30.855 16.360 1.00 0.00 H ATOM 965 H LEU B 227 15.317 34.812 14.980 1.00 0.00 H ATOM 966 N LYS B 228 18.664 37.184 16.315 1.00 13.74 N ATOM 967 CA LYS B 228 19.440 38.367 15.925 1.00 16.71 C ATOM 968 C LYS B 228 20.824 37.923 15.484 1.00 19.57 C ATOM 969 O LYS B 228 21.426 38.607 14.622 1.00 21.23 O ATOM 970 CB LYS B 228 19.569 39.328 17.108 1.00 18.90 C ATOM 971 CG LYS B 228 18.237 39.807 17.605 1.00 21.99 C ATOM 972 CD LYS B 228 18.370 40.839 18.702 1.00 26.25 C ATOM 973 CE LYS B 228 17.015 41.117 19.314 1.00 28.93 C ATOM 974 NZ LYS B 228 15.989 41.359 18.260 1.00 32.79 N ATOM 975 HA LYS B 228 18.931 38.880 15.109 1.00 0.00 H ATOM 976 HB2 LYS B 228 20.137 40.197 16.776 1.00 0.00 H ATOM 977 HB3 LYS B 228 20.061 38.796 17.922 1.00 0.00 H ATOM 978 HG2 LYS B 228 17.700 38.950 18.011 1.00 0.00 H ATOM 979 HG3 LYS B 228 17.711 40.268 16.769 1.00 0.00 H ATOM 980 HD2 LYS B 228 18.771 41.761 18.281 1.00 0.00 H ATOM 981 HD3 LYS B 228 19.042 40.460 19.472 1.00 0.00 H ATOM 982 HE2 LYS B 228 16.713 40.250 19.902 1.00 0.00 H ATOM 983 HE3 LYS B 228 17.090 42.007 19.938 1.00 0.00 H ATOM 984 HZ1 LYS B 228 16.265 42.164 17.697 1.00 0.00 H ATOM 985 HZ2 LYS B 228 15.915 40.535 17.664 1.00 0.00 H ATOM 986 HZ3 LYS B 228 15.088 41.543 18.701 1.00 0.00 H ATOM 987 H LYS B 228 18.979 36.642 17.119 1.00 0.00 H TER 988 LYS B 228 ATOM 989 N LYS D 360 4.242 22.588 30.947 1.00 28.97 N ATOM 990 CA LYS D 360 4.147 24.039 31.086 1.00 27.53 C ATOM 991 C LYS D 360 3.092 24.569 30.121 1.00 24.64 C ATOM 992 O LYS D 360 2.748 23.903 29.149 1.00 24.24 O ATOM 993 CB LYS D 360 5.502 24.681 30.791 1.00 28.82 C ATOM 994 HA LYS D 360 3.859 24.289 32.107 1.00 0.00 H ATOM 995 HB2 LYS D 360 6.244 24.300 31.493 1.00 0.00 H ATOM 996 HB3 LYS D 360 5.805 24.436 29.773 1.00 0.00 H ATOM 997 HN3 LYS D 360 4.506 22.356 29.990 1.00 0.00 H ATOM 998 HN2 LYS D 360 3.338 22.167 31.163 1.00 0.00 H ATOM 999 HN1 LYS D 360 4.947 22.231 31.592 1.00 0.00 H ATOM 1000 N PRO D 361 2.555 25.772 30.384 1.00 24.07 N ATOM 1001 CA PRO D 361 1.538 26.319 29.481 1.00 21.80 C ATOM 1002 C PRO D 361 2.165 26.530 28.100 1.00 21.15 C ATOM 1003 O PRO D 361 3.374 26.714 27.982 1.00 22.92 O ATOM 1004 CB PRO D 361 1.162 27.644 30.143 1.00 23.05 C ATOM 1005 CG PRO D 361 1.476 27.395 31.624 1.00 24.19 C ATOM 1006 CD PRO D 361 2.789 26.678 31.524 1.00 23.88 C ATOM 1007 HA PRO D 361 0.669 25.678 29.332 1.00 0.00 H ATOM 1008 HD3 PRO D 361 3.068 26.157 32.440 1.00 0.00 H ATOM 1009 HD2 PRO D 361 3.637 27.347 31.378 1.00 0.00 H ATOM 1010 HG3 PRO D 361 1.515 28.304 32.224 1.00 0.00 H ATOM 1011 HG2 PRO D 361 0.705 26.830 32.148 1.00 0.00 H ATOM 1012 HB2 PRO D 361 0.121 27.919 29.974 1.00 0.00 H ATOM 1013 HB3 PRO D 361 1.712 28.491 29.732 1.00 0.00 H ATOM 1014 N GLN D 362 1.346 26.495 27.056 1.00 19.06 N ATOM 1015 CA GLN D 362 1.846 26.690 25.703 1.00 17.66 C ATOM 1016 C GLN D 362 1.101 27.875 25.082 1.00 16.81 C ATOM 1017 O GLN D 362 0.038 28.263 25.557 1.00 16.35 O ATOM 1018 CB GLN D 362 1.578 25.435 24.863 1.00 17.83 C ATOM 1019 CG GLN D 362 2.060 24.119 25.490 1.00 16.99 C ATOM 1020 CD GLN D 362 3.579 23.997 25.535 1.00 16.04 C ATOM 1021 OE1 GLN D 362 4.237 23.807 24.506 1.00 18.62 O ATOM 1022 NE2 GLN D 362 4.141 24.106 26.734 1.00 16.06 N ATOM 1023 HA GLN D 362 2.919 26.880 25.728 1.00 0.00 H ATOM 1024 HB2 GLN D 362 2.127 25.558 23.929 1.00 0.00 H ATOM 1025 HB3 GLN D 362 0.496 25.354 24.755 1.00 0.00 H ATOM 1026 HG2 GLN D 362 1.681 23.302 24.876 1.00 0.00 H ATOM 1027 HG3 GLN D 362 1.695 24.089 26.517 1.00 0.00 H ATOM 1028 HE22 GLN D 362 3.560 24.263 27.557 1.00 0.00 H ATOM 1029 HE21 GLN D 362 5.154 24.033 26.831 1.00 0.00 H ATOM 1030 H GLN D 362 0.351 26.329 27.204 1.00 0.00 H ATOM 1031 N PRO D 363 1.676 28.516 24.060 1.00 14.53 N ATOM 1032 CA PRO D 363 0.941 29.637 23.465 1.00 13.07 C ATOM 1033 C PRO D 363 -0.259 29.032 22.755 1.00 11.74 C ATOM 1034 O PRO D 363 -0.208 27.892 22.326 1.00 13.51 O ATOM 1035 CB PRO D 363 1.923 30.214 22.437 1.00 14.48 C ATOM 1036 CG PRO D 363 3.268 29.746 22.916 1.00 18.47 C ATOM 1037 CD PRO D 363 3.020 28.377 23.476 1.00 17.72 C ATOM 1038 HA PRO D 363 0.602 30.395 24.171 1.00 0.00 H ATOM 1039 HD3 PRO D 363 3.773 28.067 24.201 1.00 0.00 H ATOM 1040 HD2 PRO D 363 3.082 27.589 22.726 1.00 0.00 H ATOM 1041 HG3 PRO D 363 4.002 29.728 22.110 1.00 0.00 H ATOM 1042 HG2 PRO D 363 3.690 30.419 23.662 1.00 0.00 H ATOM 1043 HB2 PRO D 363 1.863 31.300 22.373 1.00 0.00 H ATOM 1044 HB3 PRO D 363 1.705 29.877 21.424 1.00 0.00 H ATOM 1045 N ALA D 364 -1.331 29.802 22.632 1.00 10.97 N ATOM 1046 CA ALA D 364 -2.511 29.335 21.920 1.00 10.38 C ATOM 1047 C ALA D 364 -2.249 29.347 20.417 1.00 11.01 C ATOM 1048 O ALA D 364 -1.526 30.216 19.916 1.00 11.19 O ATOM 1049 CB ALA D 364 -3.682 30.252 22.215 1.00 11.94 C ATOM 1050 HA ALA D 364 -2.740 28.321 22.247 1.00 0.00 H ATOM 1051 HB1 ALA D 364 -3.882 30.251 23.287 1.00 0.00 H ATOM 1052 HB2 ALA D 364 -3.440 31.264 21.890 1.00 0.00 H ATOM 1053 HB3 ALA D 364 -4.563 29.898 21.680 1.00 0.00 H ATOM 1054 H ALA D 364 -1.329 30.736 23.043 1.00 0.00 H ATOM 1055 N VAL D 365 -2.817 28.390 19.699 1.00 11.14 N ATOM 1056 CA VAL D 365 -2.698 28.408 18.257 1.00 11.02 C ATOM 1057 C VAL D 365 -3.695 29.482 17.814 1.00 12.69 C ATOM 1058 O VAL D 365 -4.892 29.427 18.130 1.00 12.96 O ATOM 1059 CB VAL D 365 -3.065 27.057 17.656 1.00 11.02 C ATOM 1060 CG1 VAL D 365 -3.113 27.149 16.115 1.00 13.65 C ATOM 1061 CG2 VAL D 365 -2.041 26.043 18.085 1.00 12.73 C ATOM 1062 HA VAL D 365 -1.679 28.615 17.930 1.00 0.00 H ATOM 1063 HB VAL D 365 -4.052 26.756 18.008 1.00 0.00 H ATOM 1064 HG11 VAL D 365 -3.861 27.885 15.819 1.00 0.00 H ATOM 1065 HG12 VAL D 365 -2.135 27.452 15.740 1.00 0.00 H ATOM 1066 HG13 VAL D 365 -3.377 26.175 15.702 1.00 0.00 H ATOM 1067 HG21 VAL D 365 -1.057 26.351 17.732 1.00 0.00 H ATOM 1068 HG22 VAL D 365 -2.033 25.975 19.173 1.00 0.00 H ATOM 1069 HG23 VAL D 365 -2.294 25.071 17.660 1.00 0.00 H ATOM 1070 H VAL D 365 -3.336 27.643 20.161 1.00 0.00 H ATOM 1071 N PRO D 366 -3.210 30.495 17.091 1.00 11.90 N ATOM 1072 CA PRO D 366 -4.064 31.582 16.624 1.00 13.10 C ATOM 1073 C PRO D 366 -4.992 31.173 15.484 1.00 14.04 C ATOM 1074 O PRO D 366 -4.859 30.097 14.904 1.00 14.64 O ATOM 1075 CB PRO D 366 -3.049 32.659 16.230 1.00 13.86 C ATOM 1076 CG PRO D 366 -1.915 31.837 15.683 1.00 13.31 C ATOM 1077 CD PRO D 366 -1.817 30.669 16.639 1.00 12.14 C ATOM 1078 HA PRO D 366 -4.771 31.924 17.380 1.00 0.00 H ATOM 1079 HD3 PRO D 366 -1.125 30.852 17.461 1.00 0.00 H ATOM 1080 HD2 PRO D 366 -1.409 29.773 16.172 1.00 0.00 H ATOM 1081 HG3 PRO D 366 -2.094 31.517 14.656 1.00 0.00 H ATOM 1082 HG2 PRO D 366 -0.985 32.403 15.624 1.00 0.00 H ATOM 1083 HB2 PRO D 366 -2.755 33.299 17.062 1.00 0.00 H ATOM 1084 HB3 PRO D 366 -3.442 33.381 15.514 1.00 0.00 H ATOM 1085 N PRO D 367 -5.974 32.030 15.179 1.00 17.35 N ATOM 1086 CA PRO D 367 -6.925 31.756 14.100 1.00 18.20 C ATOM 1087 C PRO D 367 -6.138 31.580 12.805 1.00 18.62 C ATOM 1088 O PRO D 367 -5.170 32.320 12.567 1.00 18.03 O ATOM 1089 CB PRO D 367 -7.788 33.022 14.070 1.00 20.15 C ATOM 1090 CG PRO D 367 -7.718 33.520 15.475 1.00 20.32 C ATOM 1091 CD PRO D 367 -6.268 33.310 15.837 1.00 18.80 C ATOM 1092 HA PRO D 367 -7.528 30.857 14.232 1.00 0.00 H ATOM 1093 HD3 PRO D 367 -6.088 33.295 16.912 1.00 0.00 H ATOM 1094 HD2 PRO D 367 -5.619 34.123 15.512 1.00 0.00 H ATOM 1095 HG3 PRO D 367 -8.031 34.560 15.571 1.00 0.00 H ATOM 1096 HG2 PRO D 367 -8.401 32.996 16.144 1.00 0.00 H ATOM 1097 HB2 PRO D 367 -8.810 32.825 13.745 1.00 0.00 H ATOM 1098 HB3 PRO D 367 -7.431 33.756 13.347 1.00 0.00 H ATOM 1099 N ARG D 368 -6.522 30.614 11.972 1.00 21.27 N ATOM 1100 CA ARG D 368 -5.799 30.416 10.723 1.00 22.29 C ATOM 1101 C ARG D 368 -5.966 31.650 9.838 1.00 22.77 C ATOM 1102 O ARG D 368 -6.989 32.335 9.879 1.00 23.96 O ATOM 1103 CB ARG D 368 -6.241 29.127 10.015 1.00 24.89 C ATOM 1104 CG ARG D 368 -5.286 27.925 10.250 1.00 25.61 C ATOM 1105 CD ARG D 368 -5.339 27.353 11.682 1.00 27.63 C ATOM 1106 NE ARG D 368 -4.335 26.303 11.890 1.00 27.65 N ATOM 1107 CZ ARG D 368 -4.255 25.535 12.974 1.00 26.53 C ATOM 1108 NH1 ARG D 368 -5.124 25.686 13.960 1.00 29.32 N ATOM 1109 NH2 ARG D 368 -3.291 24.630 13.086 1.00 26.60 N ATOM 1110 HA ARG D 368 -4.738 30.292 10.940 1.00 0.00 H ATOM 1111 HB2 ARG D 368 -6.250 29.331 8.944 1.00 0.00 H ATOM 1112 HB3 ARG D 368 -7.216 28.852 10.418 1.00 0.00 H ATOM 1113 HG2 ARG D 368 -4.270 28.281 10.081 1.00 0.00 H ATOM 1114 HG3 ARG D 368 -5.595 27.129 9.572 1.00 0.00 H ATOM 1115 HD2 ARG D 368 -5.135 28.164 12.381 1.00 0.00 H ATOM 1116 HD3 ARG D 368 -6.326 26.918 11.840 1.00 0.00 H ATOM 1117 HE ARG D 368 -3.649 26.151 11.151 1.00 0.00 H ATOM 1118 HH12 ARG D 368 -5.061 25.096 14.790 1.00 0.00 H ATOM 1119 HH11 ARG D 368 -5.857 26.392 13.890 1.00 0.00 H ATOM 1120 HH22 ARG D 368 -3.235 24.045 13.919 1.00 0.00 H ATOM 1121 HH21 ARG D 368 -2.606 24.520 12.339 1.00 0.00 H ATOM 1122 H ARG D 368 -7.316 30.018 12.207 1.00 0.00 H ATOM 1123 N PRO D 369 -4.946 31.951 9.025 1.00 22.25 N ATOM 1124 CA PRO D 369 -4.969 33.119 8.146 1.00 24.51 C ATOM 1125 C PRO D 369 -6.020 33.150 7.049 1.00 26.18 C ATOM 1126 O PRO D 369 -6.789 34.133 7.062 1.00 29.24 O ATOM 1127 CB PRO D 369 -3.536 33.173 7.617 1.00 23.84 C ATOM 1128 CG PRO D 369 -3.143 31.735 7.550 1.00 22.00 C ATOM 1129 CD PRO D 369 -3.737 31.137 8.801 1.00 21.55 C ATOM 1130 HA PRO D 369 -5.280 34.004 8.702 1.00 0.00 H ATOM 1131 HD3 PRO D 369 -3.050 31.165 9.647 1.00 0.00 H ATOM 1132 HD2 PRO D 369 -3.960 30.075 8.694 1.00 0.00 H ATOM 1133 HG3 PRO D 369 -3.508 31.248 6.645 1.00 0.00 H ATOM 1134 HG2 PRO D 369 -2.062 31.603 7.502 1.00 0.00 H ATOM 1135 HB2 PRO D 369 -2.875 33.760 8.254 1.00 0.00 H ATOM 1136 HB3 PRO D 369 -3.463 33.674 6.652 1.00 0.00 H ATOM 1137 N SER D 370 -6.058 32.223 6.212 1.00 28.97 N ATOM 1138 HN3 SER D 370 -5.912 32.604 5.277 1.00 0.00 H ATOM 1139 HN2 SER D 370 -6.968 31.765 6.255 1.00 0.00 H ATOM 1140 HN1 SER D 370 -5.325 31.546 6.423 1.00 0.00 H TER 1141 SER D 370 HETATM 1142 C1 NON A 1 8.132 38.810 3.306 1.00 0.15 C HETATM 1143 C2 NON A 1 8.410 39.535 4.639 1.00 0.44 C HETATM 1144 F1 NON A 1 9.455 40.320 4.698 1.00 -0.17 F HETATM 1145 F2 NON A 1 7.374 40.321 4.909 1.00 -0.17 F HETATM 1146 F3 NON A 1 8.543 38.765 5.808 1.00 -0.17 F HETATM 1147 O NON A 1 7.031 38.184 3.176 1.00 -0.54 O HETATM 1148 OXT NON A 1 9.001 38.870 2.466 1.00 -0.54 O CONECT 4 5 22 23 24 CONECT 22 4 CONECT 23 4 CONECT 24 4 CONECT 989 990 997 998 999 CONECT 997 989 CONECT 998 989 CONECT 999 989 CONECT 1137 1125 1138 1139 1140 CONECT 1138 1137 CONECT 1139 1137 CONECT 1140 1137 CONECT 1142 1143 1147 1148 CONECT 1143 1142 1144 1145 1146 CONECT 1144 1143 CONECT 1145 1143 CONECT 1146 1143 CONECT 1147 1142 CONECT 1148 1142 MASTER 0 0 0 0 0 0 0 0 1145 3 19 7 END
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Entry Information
PDB ID
1w70
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
neutrophil cytosol factor 4
Ligand Name
15-mer
EC.Number
E.C.-.-.-.-
Resolution
1.46(Å)
Affinity (Kd/Ki/IC50)
Kd=200uM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
J.Biol.Chem.v280;pp.13752
Ligand Properties
Formula
C
2
HF
3
O
2
Molecular Weight
114.023
Exact Mass
113.993
No. of atoms
8
No. of bonds
7
Polar Surface Area
37.3
LOGP Value
1.79 (
Computed with XLOGP3
)
0.63 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
Canonical SMILES
OC(=O)C(F)(F)F
InChI String
InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)
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):
Q15080
P14598
Entrez Gene ID
NCBI Entrez Gene ID:
4689
653361
ASD
Information of known allosteric effects of PDB entries
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