[gmx-users] pdb file
leila karami
karami.leila1 at gmail.com
Fri Aug 6 14:59:49 CEST 2010
Hi gromacs users
I obtained pdb input file for gromacs from STRAP program. this pdb
file coantains protein and dna. this pdb file was obtaind form
superposition of 2 other pdb files. there is one problem: when I see
pdb file obtained from STRAP program by VMD, some bonds are
disappeared whereas when I open same file by text editor all things
are normal.as I can not attached this pdb file, I put residues 10-40
corresponding to protein from pdb.
please guide me
ATOM 95 N GLY A 10 -1.818 -6.947 -14.722 1.00 0.00 N
ATOM 96 CA GLY A 10 -1.256 -7.638 -13.576 1.00 0.00 C
ATOM 97 C GLY A 10 -2.311 -8.357 -12.758 1.00 0.00 C
ATOM 98 O GLY A 10 -3.368 -7.797 -12.468 1.00 0.00 O
ATOM 99 H GLY A 10 -2.768 -7.530 -14.939 1.00 0.00 H
ATOM 100 HA2 GLY A 10 -0.531 -8.359 -13.923 1.00 0.00 H
ATOM 101 HA3 GLY A 10 -0.758 -6.916 -12.944 1.00 0.00 H
ATOM 102 N GLN A 11 -2.230 -9.602 -12.388 1.00 0.00 N
ATOM 103 CA GLN A 11 -2.957 -10.399 -11.600 1.00 0.00 C
ATOM 104 C GLN A 11 -2.588 -10.366 -10.121 1.00 0.00 C
ATOM 105 O GLN A 11 -1.978 -11.302 -9.604 1.00 0.00 O
ATOM 106 CB GLN A 11 -2.977 -11.843 -12.104 1.00 0.00 C
ATOM 107 CG GLN A 11 -3.963 -12.790 -13.236 1.00 0.00 C
ATOM 108 CD GLN A 11 -5.336 -11.508 -12.942 1.00 0.00 C
ATOM 109 OE1 GLN A 11 -5.869 -11.673 -11.845 1.00 0.00 O
ATOM 110 NE2 GLN A 11 -5.918 -10.829 -13.926 1.00 0.00 N
ATOM 111 H GLN A 11 -1.164 -9.991 -12.649 1.00 0.00 H
ATOM 112 HA GLN A 11 -3.941 -9.972 -11.722 1.00 0.00 H
ATOM 113 HB2 GLN A 11 -1.990 -12.102 -12.454 1.00 0.00 H
ATOM 114 HB3 GLN A 11 -3.242 -12.493 -11.282 1.00 0.00 H
ATOM 115 HG2 GLN A 11 -3.582 -11.616 -14.132 1.00 0.00 H
ATOM 116 HG3 GLN A 11 -4.590 -13.144 -13.395 1.00 0.00 H
ATOM 117 HE21 GLN A 11 -5.434 -10.739 -14.774 1.00 0.00 H
ATOM 118 HE22 GLN A 11 -6.805 -10.449 -13.763 1.00 0.00 H
ATOM 119 N VAL A 12 -2.960 -9.284 -9.446 1.00 0.00 N
ATOM 120 CA VAL A 12 -2.670 -9.130 -8.270 1.00 0.00 C
ATOM 121 C VAL A 12 -3.937 -8.829 -7.235 1.00 0.00 C
ATOM 122 O VAL A 12 -4.775 -8.340 -7.664 1.00 0.00 O
ATOM 123 CB VAL A 12 -1.644 -8.800 -7.782 1.00 0.00 C
ATOM 124 CG1 VAL A 12 -1.342 -7.874 -6.296 1.00 0.00 C
ATOM 125 CG2 VAL A 12 -0.370 -8.270 -8.571 1.00 0.00 C
ATOM 126 H VAL A 12 -3.444 -8.572 -9.914 1.00 0.00 H
ATOM 127 HA VAL A 12 -2.246 -10.600 -7.670 1.00 0.00 H
ATOM 128 HB VAL A 12 -2.710 -7.780 -8.126 1.00 0.00 H
ATOM 129 HG11 VAL A 12 -2.268 -7.887 -5.739 1.00 0.00 H
ATOM 130 HG12 VAL A 12 -0.718 -8.697 -5.980 1.00 0.00 H
ATOM 131 HG13 VAL A 12 -0.828 -6.941 -6.117 1.00 0.00 H
ATOM 132 HG21 VAL A 12 0.203 -9.430 -8.830 1.00 0.00 H
ATOM 133 HG22 VAL A 12 -0.625 -8.588 -9.572 1.00 0.00 H
ATOM 134 HG23 VAL A 12 0.215 -7.363 -8.621 1.00 0.00 H
ATOM 135 N ARG A 13 -4.710 -9.465 -6.760 1.00 0.00 N
ATOM 136 CA ARG A 13 -5.236 -9.265 -5.223 1.00 0.00 C
ATOM 137 C ARG A 13 -5.140 -9.881 -3.845 1.00 0.00 C
ATOM 138 O ARG A 13 -4.412 -10.947 -3.720 1.00 0.00 O
ATOM 139 CB ARG A 13 -6.480 -9.873 -5.874 1.00 0.00 C
ATOM 140 CG ARG A 13 -7.779 -9.475 -5.194 1.00 0.00 C
ATOM 141 CD ARG A 13 -8.147 -10.444 -4.830 1.00 0.00 C
ATOM 142 NE ARG A 13 -8.819 -11.635 -4.596 1.00 0.00 N
ATOM 143 CZ ARG A 13 -10.800 -11.611 -5.186 1.00 0.00 C
ATOM 144 NH1 ARG A 13 -10.654 -10.463 -5.337 1.00 0.00 N
ATOM 145 NH2 ARG A 13 -10.555 -12.737 -5.628 1.00 0.00 N
ATOM 146 H ARG A 13 -3.368 -10.860 -5.788 1.00 0.00 H
ATOM 147 HA ARG A 13 -5.385 -8.201 -5.110 1.00 0.00 H
ATOM 148 HB2 ARG A 13 -6.526 -9.555 -6.904 1.00 0.00 H
ATOM 149 HB3 ARG A 13 -6.397 -10.949 -5.841 1.00 0.00 H
ATOM 150 HG2 ARG A 13 -7.665 -8.487 -4.770 1.00 0.00 H
ATOM 151 HG3 ARG A 13 -8.571 -9.465 -5.928 1.00 0.00 H
ATOM 152 HD2 ARG A 13 -7.245 -10.744 -3.571 1.00 0.00 H
ATOM 153 HD3 ARG A 13 -8.805 -9.942 -3.388 1.00 0.00 H
ATOM 154 HE ARG A 13 -8.359 -12.494 -4.493 1.00 0.00 H
ATOM 155 HH11 ARG A 13 -10.244 -9.612 -5.700 1.00 0.00 H
ATOM 156 HH12 ARG A 13 -11.548 -10.447 -5.784 1.00 0.00 H
ATOM 157 HH21 ARG A 13 -10.710 -13.604 -5.514 1.00 0.00 H
ATOM 158 HH22 ARG A 13 -11.449 -12.718 -6.720 1.00 0.00 H
ATOM 159 N PHE A 14 -5.506 -9.204 -2.814 1.00 0.00 N
ATOM 160 CA PHE A 14 -5.361 -9.684 -1.444 1.00 0.00 C
ATOM 161 C PHE A 14 -6.629 -9.416 -0.638 1.00 0.00 C
ATOM 162 O PHE A 14 -7.910 -8.279 -0.546 1.00 0.00 O
ATOM 163 CB PHE A 14 -4.163 -9.120 -0.770 1.00 0.00 C
ATOM 164 CG PHE A 14 -2.845 -9.366 -1.399 1.00 0.00 C
ATOM 165 CD1 PHE A 14 -2.352 -8.633 -2.466 1.00 0.00 C
ATOM 166 CD2 PHE A 14 -2.101 -10.434 -0.922 1.00 0.00 C
ATOM 167 CE1 PHE A 14 -1.139 -8.956 -3.460 1.00 0.00 C
ATOM 168 CE2 PHE A 14 -0.888 -10.762 -1.499 1.00 0.00 C
ATOM 169 CZ PHE A 14 -0.407 -10.220 -2.562 1.00 0.00 C
ATOM 170 H PHE A 14 -5.978 -8.359 -2.977 1.00 0.00 H
ATOM 171 HA PHE A 14 -5.191 -10.748 -1.483 1.00 0.00 H
ATOM 172 HB2 PHE A 14 -4.280 -7.940 -0.828 1.00 0.00 H
ATOM 173 HB3 PHE A 14 -4.129 -9.312 0.266 1.00 0.00 H
ATOM 174 HD1 PHE A 14 -2.926 -7.798 -2.845 1.00 0.00 H
ATOM 175 HD2 PHE A 14 -2.474 -11.130 -0.920 1.00 0.00 H
ATOM 176 HE1 PHE A 14 -0.768 -8.376 -3.878 1.00 0.00 H
ATOM 177 HE2 PHE A 14 -0.317 -11.595 -1.120 1.00 0.00 H
ATOM 178 HZ PHE A 14 0.540 -10.277 -3.150 1.00 0.00 H
ATOM 179 N SER A 15 -7.184 -10.473 -0.540 1.00 0.00 N
ATOM 180 CA SER A 15 -8.402 -10.355 0.740 1.00 0.00 C
ATOM 181 C SER A 15 -8.269 -9.239 1.773 1.00 0.00 C
ATOM 182 O SER A 15 -7.164 -8.798 2.880 1.00 0.00 O
ATOM 183 CB SER A 15 -8.708 -11.680 1.442 1.00 0.00 C
ATOM 184 OG SER A 15 -10.980 -11.824 1.675 1.00 0.00 O
ATOM 185 H SER A 15 -6.769 -11.354 -0.166 1.00 0.00 H
ATOM 186 HA SER A 15 -9.213 -10.116 0.710 1.00 0.00 H
ATOM 187 HB2 SER A 15 -8.373 -12.499 0.822 1.00 0.00 H
ATOM 188 HB3 SER A 15 -8.189 -11.711 2.388 1.00 0.00 H
ATOM 189 HG SER A 15 -10.276 -11.739 2.615 1.00 0.00 H
ATOM 190 N ASN A 16 -9.404 -8.788 2.296 1.00 0.00 N
ATOM 191 CA ASN A 16 -9.416 -7.723 3.292 1.00 0.00 C
ATOM 192 C ASN A 16 -8.428 -8.200 4.416 1.00 0.00 C
ATOM 193 O ASN A 16 -7.487 -7.260 4.646 1.00 0.00 O
ATOM 194 CB ASN A 16 -10.824 -7.551 3.867 1.00 0.00 C
ATOM 195 CG ASN A 16 -10.822 -6.795 5.180 1.00 0.00 C
ATOM 196 OD1 ASN A 16 -10.442 -7.334 6.219 1.00 0.00 O
ATOM 197 ND2 ASN A 16 -11.250 -5.538 5.140 1.00 0.00 N
ATOM 198 H ASN A 16 -10.253 -9.180 2.500 1.00 0.00 H
ATOM 199 HA ASN A 16 -9.121 -6.808 2.802 1.00 0.00 H
ATOM 200 HB2 ASN A 16 -11.430 -7.200 3.158 1.00 0.00 H
ATOM 201 HB3 ASN A 16 -11.262 -8.524 4.320 1.00 0.00 H
ATOM 202 HD21 ASN A 16 -11.538 -5.173 4.277 1.00 0.00 H
ATOM 203 HD22 ASN A 16 -11.260 -5.260 5.975 1.00 0.00 H
ATOM 204 N ASP A 17 -8.649 -9.128 5.113 1.00 0.00 N
ATOM 205 CA ASP A 17 -7.778 -9.527 6.212 1.00 0.00 C
ATOM 206 C ASP A 17 -6.354 -9.760 5.721 1.00 0.00 C
ATOM 207 O ASP A 17 -5.394 -9.267 6.311 1.00 0.00 O
ATOM 208 CB ASP A 17 -8.314 -10.793 6.882 1.00 0.00 C
ATOM 209 CG ASP A 17 -9.409 -10.498 7.888 1.00 0.00 C
ATOM 210 OD1 ASP A 17 -9.166 -9.694 8.812 1.00 0.00 O
ATOM 211 OD2 ASP A 17 -10.510 -11.690 7.750 1.00 0.00 O
ATOM 212 H ASP A 17 -9.416 -9.694 4.881 1.00 0.00 H
ATOM 213 HA ASP A 17 -7.769 -8.725 6.935 1.00 0.00 H
ATOM 214 HB2 ASP A 17 -8.713 -11.451 6.125 1.00 0.00 H
ATOM 215 HB3 ASP A 17 -7.504 -11.291 7.395 1.00 0.00 H
ATOM 216 N GLN A 18 -6.224 -10.517 4.635 1.00 0.00 N
ATOM 217 CA GLN A 18 -4.916 -10.817 4.650 1.00 0.00 C
ATOM 218 C GLN A 18 -4.470 -9.564 4.600 1.00 0.00 C
ATOM 219 O GLN A 18 -2.973 -9.513 4.605 1.00 0.00 O
ATOM 220 CB GLN A 18 -5.720 -11.411 2.664 1.00 0.00 C
ATOM 221 CG GLN A 18 -5.251 -12.920 2.658 1.00 0.00 C
ATOM 222 CD GLN A 18 -5.576 -13.465 1.282 1.00 0.00 C
ATOM 223 OE1 GLN A 18 -5.567 -12.730 0.293 1.00 0.00 O
ATOM 224 NE2 GLN A 18 -5.863 -14.760 1.210 1.00 0.00 N
ATOM 225 H GLN A 18 -7.260 -10.881 4.209 1.00 0.00 H
ATOM 226 HA GLN A 18 -4.435 -11.543 4.703 1.00 0.00 H
ATOM 227 HB2 GLN A 18 -5.934 -10.965 2.190 1.00 0.00 H
ATOM 228 HB3 GLN A 18 -4.190 -11.173 2.850 1.00 0.00 H
ATOM 229 HG2 GLN A 18 -4.337 -13.381 3.500 1.00 0.00 H
ATOM 230 HG3 GLN A 18 -6.590 -13.176 3.331 1.00 0.00 H
ATOM 231 HE21 GLN A 18 -5.852 -15.282 2.390 1.00 0.00 H
ATOM 232 HE22 GLN A 18 -6.780 -15.138 0.333 1.00 0.00 H
ATOM 233 N THR A 19 -4.519 -8.557 3.279 1.00 0.00 N
ATOM 234 CA THR A 19 -3.786 -7.306 3.141 1.00 0.00 C
ATOM 235 C THR A 19 -3.420 -6.729 4.504 1.00 0.00 C
ATOM 236 O THR A 19 -2.276 -6.335 4.735 1.00 0.00 O
ATOM 237 CB THR A 19 -4.600 -6.261 2.355 1.00 0.00 C
ATOM 238 OG1 THR A 19 -4.914 -6.763 1.520 1.00 0.00 O
ATOM 239 CG2 THR A 19 -3.828 -4.955 2.230 1.00 0.00 C
ATOM 240 H THR A 19 -5.381 -8.659 2.825 1.00 0.00 H
ATOM 241 HA THR A 19 -2.878 -7.510 2.592 1.00 0.00 H
ATOM 242 HB THR A 19 -5.519 -6.670 2.889 1.00 0.00 H
ATOM 243 HG1 THR A 19 -5.120 -7.717 1.900 1.00 0.00 H
ATOM 244 HG21 THR A 19 -3.194 -4.995 1.356 1.00 0.00 H
ATOM 245 HG22 THR A 19 -3.222 -4.810 3.111 1.00 0.00 H
ATOM 246 HG23 THR A 19 -4.524 -4.135 2.131 1.00 0.00 H
ATOM 247 N ILE A 20 -4.396 -6.682 5.402 1.00 0.00 N
ATOM 248 CA ILE A 20 -4.176 -6.155 6.743 1.00 0.00 C
ATOM 249 C ILE A 20 -2.922 -6.756 7.370 1.00 0.00 C
ATOM 250 O ILE A 20 -1.944 -6.530 7.619 1.00 0.00 O
ATOM 251 CB ILE A 20 -5.380 -6.432 7.663 1.00 0.00 C
ATOM 252 CG1 ILE A 20 -6.610 -5.663 7.175 1.00 0.00 C
ATOM 253 CG2 ILE A 20 -5.470 -6.530 9.980 1.00 0.00 C
ATOM 254 CD1 ILE A 20 -7.909 -6.165 7.763 1.00 0.00 C
ATOM 255 H ILE A 20 -5.287 -7.110 5.158 1.00 0.00 H
ATOM 256 HA ILE A 20 -4.470 -5.850 6.664 1.00 0.00 H
ATOM 257 HB ILE A 20 -5.591 -7.489 7.633 1.00 0.00 H
ATOM 258 HG12 ILE A 20 -6.506 -4.623 7.441 1.00 0.00 H
ATOM 259 HG13 ILE A 20 -6.675 -5.750 6.990 1.00 0.00 H
ATOM 260 HG21 ILE A 20 -4.118 -6.519 9.387 1.00 0.00 H
ATOM 261 HG22 ILE A 20 -4.952 -4.981 9.175 1.00 0.00 H
ATOM 262 HG23 ILE A 20 -5.837 -6.393 9.751 1.00 0.00 H
ATOM 263 HD11 ILE A 20 -8.454 -6.718 7.120 1.00 0.00 H
ATOM 264 HD12 ILE A 20 -7.699 -6.808 8.604 1.00 0.00 H
ATOM 265 HD13 ILE A 20 -8.505 -5.324 8.900 1.00 0.00 H
ATOM 266 N GLU A 21 -2.960 -8.620 7.622 1.00 0.00 N
ATOM 267 CA GLU A 21 -1.828 -8.758 8.220 1.00 0.00 C
ATOM 268 C GLU A 21 -0.555 -8.522 7.408 1.00 0.00 C
ATOM 269 O GLU A 21 0.458 -8.710 7.941 1.00 0.00 O
ATOM 270 CB GLU A 21 -2.114 -10.258 8.314 1.00 0.00 C
ATOM 271 CG GLU A 21 -3.620 -10.625 9.444 1.00 0.00 C
ATOM 272 CD GLU A 21 -2.835 -12.320 9.961 1.00 0.00 C
ATOM 273 OE1 GLU A 21 -1.673 -12.375 10.260 1.00 0.00 O
ATOM 274 OE2 GLU A 21 -3.822 -12.791 10.640 1.00 0.00 O
ATOM 275 H GLU A 21 -3.770 -8.567 7.401 1.00 0.00 H
ATOM 276 HA GLU A 21 -1.684 -8.364 9.213 1.00 0.00 H
ATOM 277 HB2 GLU A 21 -2.549 -10.588 7.383 1.00 0.00 H
ATOM 278 HB3 GLU A 21 -1.182 -10.779 8.470 1.00 0.00 H
ATOM 279 HG2 GLU A 21 -2.917 -9.932 10.258 1.00 0.00 H
ATOM 280 HG3 GLU A 21 -4.780 -10.548 9.830 1.00 0.00 H
ATOM 281 N LEU A 22 -0.619 -8.831 6.118 1.00 0.00 N
ATOM 282 CA LEU A 22 0.527 -8.654 5.232 1.00 0.00 C
ATOM 283 C LEU A 22 1.302 -7.390 5.592 1.00 0.00 C
ATOM 284 O LEU A 22 2.532 -7.373 5.550 1.00 0.00 O
ATOM 285 CB LEU A 22 0.640 -8.586 3.776 1.00 0.00 C
ATOM 286 CG LEU A 22 -0.261 -9.925 3.112 1.00 0.00 C
ATOM 287 CD1 LEU A 22 -1.700 -9.708 1.843 1.00 0.00 C
ATOM 288 CD2 LEU A 22 1.160 -10.694 2.808 1.00 0.00 C
ATOM 289 H LEU A 22 -1.453 -9.187 5.751 1.00 0.00 H
ATOM 290 HA LEU A 22 1.177 -9.508 5.357 1.00 0.00 H
ATOM 291 HB2 LEU A 22 -0.823 -7.974 3.738 1.00 0.00 H
ATOM 292 HB3 LEU A 22 0.850 -8.114 3.203 1.00 0.00 H
ATOM 293 HG LEU A 22 -0.856 -10.520 3.792 1.00 0.00 H
ATOM 294 HD11 LEU A 22 -0.754 -8.793 1.366 1.00 0.00 H
ATOM 295 HD12 LEU A 22 -2.118 -9.640 2.940 1.00 0.00 H
ATOM 296 HD13 LEU A 22 -0.913 -10.538 1.171 1.00 0.00 H
ATOM 297 HD21 LEU A 22 0.970 -11.810 1.800 1.00 0.00 H
ATOM 298 HD22 LEU A 22 1.118 -11.513 3.505 1.00 0.00 H
ATOM 299 HD23 LEU A 22 1.865 -10.340 2.901 1.00 0.00 H
ATOM 300 N GLU A 23 0.574 -6.335 5.946 1.00 0.00 N
ATOM 301 CA GLU A 23 1.195 -5.680 6.314 1.00 0.00 C
ATOM 302 C GLU A 23 1.865 -5.166 7.680 1.00 0.00 C
ATOM 303 O GLU A 23 3.790 -5.700 7.802 1.00 0.00 O
ATOM 304 CB GLU A 23 0.152 -3.948 6.323 1.00 0.00 C
ATOM 305 CG GLU A 23 -0.460 -3.676 4.960 1.00 0.00 C
ATOM 306 CD GLU A 23 -0.952 -2.247 4.817 1.00 0.00 C
ATOM 307 OE1 GLU A 23 -1.677 -1.777 5.721 1.00 0.00 O
ATOM 308 OE2 GLU A 23 -0.615 -1.601 3.805 1.00 0.00 O
ATOM 309 H GLU A 23 -0.402 -6.412 5.960 1.00 0.00 H
ATOM 310 HA GLU A 23 1.947 -4.841 5.572 1.00 0.00 H
ATOM 311 HB2 GLU A 23 -0.641 -4.217 7.600 1.00 0.00 H
ATOM 312 HB3 GLU A 23 0.621 -3.400 6.672 1.00 0.00 H
ATOM 313 HG2 GLU A 23 0.284 -3.861 4.202 1.00 0.00 H
ATOM 314 HG3 GLU A 23 -1.296 -4.344 4.815 1.00 0.00 H
ATOM 315 N LYS A 24 1.640 -5.430 8.708 1.00 0.00 N
ATOM 316 CA LYS A 24 1.578 -5.552 10.670 1.00 0.00 C
ATOM 317 C LYS A 24 2.895 -6.319 10.850 1.00 0.00 C
ATOM 318 O LYS A 24 3.710 -6.153 10.994 1.00 0.00 O
ATOM 319 CB LYS A 24 0.552 -6.256 10.960 1.00 0.00 C
ATOM 320 CG LYS A 24 -0.756 -5.500 11.950 1.00 0.00 C
ATOM 321 CD LYS A 24 -1.701 -6.192 12.620 1.00 0.00 C
ATOM 322 CE LYS A 24 -2.650 -5.202 12.722 1.00 0.00 C
ATOM 323 NZ LYS A 24 -3.881 -4.989 11.911 1.00 0.00 N
ATOM 324 H LYS A 24 0.104 -5.546 8.548 1.00 0.00 H
ATOM 325 HA LYS A 24 1.749 -4.555 10.446 1.00 0.00 H
ATOM 326 HB2 LYS A 24 0.342 -7.230 10.545 1.00 0.00 H
ATOM 327 HB3 LYS A 24 0.977 -6.378 11.947 1.00 0.00 H
ATOM 328 HG2 LYS A 24 -0.551 -4.505 11.460 1.00 0.00 H
ATOM 329 HG3 LYS A 24 -1.230 -5.440 10.126 1.00 0.00 H
ATOM 330 HD2 LYS A 24 -2.283 -6.925 11.524 1.00 0.00 H
ATOM 331 HD3 LYS A 24 -1.121 -6.685 12.829 1.00 0.00 H
ATOM 332 HE2 LYS A 24 -2.928 -5.580 13.692 1.00 0.00 H
ATOM 333 HE3 LYS A 24 -2.138 -4.257 12.836 1.00 0.00 H
ATOM 334 HZ1 LYS A 24 -4.725 -5.171 12.492 1.00 0.00 H
ATOM 335 HZ2 LYS A 24 -3.889 -5.638 11.970 1.00 0.00 H
ATOM 336 HZ3 LYS A 24 -3.915 -4.110 11.562 1.00 0.00 H
ATOM 337 N LYS A 25 3.101 -7.156 9.740 1.00 0.00 N
ATOM 338 CA LYS A 25 4.322 -7.946 8.970 1.00 0.00 C
ATOM 339 C LYS A 25 5.463 -7.111 8.399 1.00 0.00 C
ATOM 340 O LYS A 25 6.493 -6.921 9.480 1.00 0.00 O
ATOM 341 CB LYS A 25 4.850 -9.175 8.920 1.00 0.00 C
ATOM 342 CG LYS A 25 5.136 -10.258 8.265 1.00 0.00 C
ATOM 343 CD LYS A 25 5.184 -10.767 9.696 1.00 0.00 C
ATOM 344 CE LYS A 25 5.946 -12.790 9.796 1.00 0.00 C
ATOM 345 NZ LYS A 25 5.669 -12.784 11.790 1.00 0.00 N
ATOM 346 H LYS A 25 2.415 -7.243 8.378 1.00 0.00 H
ATOM 347 HA LYS A 25 4.592 -8.270 9.965 1.00 0.00 H
ATOM 348 HB2 LYS A 25 3.121 -9.597 8.335 1.00 0.00 H
ATOM 349 HB3 LYS A 25 4.830 -8.868 7.560 1.00 0.00 H
ATOM 350 HG2 LYS A 25 4.901 -11.830 7.609 1.00 0.00 H
ATOM 351 HG3 LYS A 25 6.104 -9.854 8.300 1.00 0.00 H
ATOM 352 HD2 LYS A 25 5.675 -10.290 10.314 1.00 0.00 H
ATOM 353 HD3 LYS A 25 4.173 -10.918 10.480 1.00 0.00 H
ATOM 354 HE2 LYS A 25 5.651 -12.715 8.975 1.00 0.00 H
ATOM 355 HE3 LYS A 25 7.400 -11.871 9.730 1.00 0.00 H
ATOM 356 HZ1 LYS A 25 6.105 -12.270 11.869 1.00 0.00 H
ATOM 357 HZ2 LYS A 25 6.590 -13.748 11.480 1.00 0.00 H
ATOM 358 HZ3 LYS A 25 4.643 -12.843 11.239 1.00 0.00 H
ATOM 359 N PHE A 26 5.276 -6.616 7.180 1.00 0.00 N
ATOM 360 CA PHE A 26 6.290 -5.801 6.522 1.00 0.00 C
ATOM 361 C PHE A 26 6.831 -4.735 7.469 1.00 0.00 C
ATOM 362 O PHE A 26 8.100 -4.357 7.394 1.00 0.00 O
ATOM 363 CB PHE A 26 5.710 -5.139 5.269 1.00 0.00 C
ATOM 364 CG PHE A 26 6.532 -3.988 4.764 1.00 0.00 C
ATOM 365 CD1 PHE A 26 6.343 -2.711 5.268 1.00 0.00 C
ATOM 366 CD2 PHE A 26 7.493 -4.184 3.786 1.00 0.00 C
ATOM 367 CE1 PHE A 26 7.980 -1.651 4.802 1.00 0.00 C
ATOM 368 CE2 PHE A 26 8.251 -3.128 3.319 1.00 0.00 C
ATOM 369 CZ PHE A 26 8.550 -1.860 3.828 1.00 0.00 C
ATOM 370 H PHE A 26 4.434 -6.802 6.713 1.00 0.00 H
ATOM 371 HA PHE A 26 7.100 -6.453 6.232 1.00 0.00 H
ATOM 372 HB2 PHE A 26 5.646 -5.874 4.480 1.00 0.00 H
ATOM 373 HB3 PHE A 26 4.721 -4.770 5.493 1.00 0.00 H
ATOM 374 HD1 PHE A 26 5.597 -2.547 6.310 1.00 0.00 H
ATOM 375 HD2 PHE A 26 7.650 -5.177 3.387 1.00 0.00 H
ATOM 376 HE1 PHE A 26 6.941 -0.661 5.203 1.00 0.00 H
ATOM 377 HE2 PHE A 26 8.998 -3.295 2.555 1.00 0.00 H
ATOM 378 HZ PHE A 26 8.645 -1.320 3.463 1.00 0.00 H
ATOM 379 N GLU A 27 5.970 -4.251 8.362 1.00 0.00 N
ATOM 380 CA GLU A 27 6.361 -3.227 9.322 1.00 0.00 C
ATOM 381 C GLU A 27 7.430 -3.756 10.276 1.00 0.00 C
ATOM 382 O GLU A 27 8.467 -3.119 10.479 1.00 0.00 O
ATOM 383 CB GLU A 27 5.144 -2.753 10.119 1.00 0.00 C
ATOM 384 CG GLU A 27 3.954 -2.384 9.248 1.00 0.00 C
ATOM 385 CD GLU A 27 4.370 -0.964 8.718 1.00 0.00 C
ATOM 386 OE1 GLU A 27 4.697 -0.127 9.366 1.00 0.00 O
ATOM 387 OE2 GLU A 27 3.440 -0.694 7.656 1.00 0.00 O
ATOM 388 H GLU A 27 5.520 -4.592 8.371 1.00 0.00 H
ATOM 389 HA GLU A 27 6.768 -2.394 8.772 1.00 0.00 H
ATOM 390 HB2 GLU A 27 4.841 -3.539 10.793 1.00 0.00 H
ATOM 391 HB3 GLU A 27 5.425 -1.884 10.696 1.00 0.00 H
ATOM 392 HG2 GLU A 27 3.914 -3.620 8.409 1.00 0.00 H
ATOM 393 HG3 GLU A 27 3.520 -2.481 9.833 1.00 0.00 H
ATOM 394 N THR A 28 7.173 -4.922 10.857 1.00 0.00 N
ATOM 395 CA THR A 28 8.111 -5.536 11.788 1.00 0.00 C
ATOM 396 C THR A 28 9.331 -6.860 11.590 1.00 0.00 C
ATOM 397 O THR A 28 10.402 -6.235 11.647 1.00 0.00 O
ATOM 398 CB THR A 28 7.447 -6.673 12.586 1.00 0.00 C
ATOM 399 OG1 THR A 28 6.815 -7.596 11.692 1.00 0.00 O
ATOM 400 CG2 THR A 28 6.420 -6.123 13.564 1.00 0.00 C
ATOM 401 H THR A 28 6.331 -5.381 10.654 1.00 0.00 H
ATOM 402 HA THR A 28 8.434 -4.776 12.486 1.00 0.00 H
ATOM 403 HB THR A 28 8.211 -7.195 13.145 1.00 0.00 H
ATOM 404 HG1 THR A 28 7.451 -8.258 11.413 1.00 0.00 H
ATOM 405 HG21 THR A 28 5.737 -6.908 13.850 1.00 0.00 H
ATOM 406 HG22 THR A 28 5.869 -5.322 13.930 1.00 0.00 H
ATOM 407 HG23 THR A 28 6.925 -5.746 14.441 1.00 0.00 H
ATOM 408 N GLN A 29 9.161 -6.387 9.776 1.00 0.00 N
ATOM 409 CA GLN A 29 10.250 -6.921 8.965 1.00 0.00 C
ATOM 410 C GLN A 29 9.998 -6.671 7.482 1.00 0.00 C
ATOM 411 O GLN A 29 9.830 -7.244 6.893 1.00 0.00 O
ATOM 412 CB GLN A 29 10.416 -8.420 9.222 1.00 0.00 C
ATOM 413 CG GLN A 29 11.845 -8.911 9.500 1.00 0.00 C
ATOM 414 CD GLN A 29 11.934 -10.421 8.956 1.00 0.00 C
ATOM 415 OE1 GLN A 29 11.190 -11.142 9.621 1.00 0.00 O
ATOM 416 NE2 GLN A 29 12.850 -10.909 8.128 1.00 0.00 N
ATOM 417 H GLN A 29 8.284 -6.245 9.364 1.00 0.00 H
ATOM 418 HA GLN A 29 11.157 -6.413 9.255 1.00 0.00 H
ATOM 419 HB2 GLN A 29 10.102 -8.637 10.232 1.00 0.00 H
ATOM 420 HB3 GLN A 29 9.786 -8.963 8.534 1.00 0.00 H
ATOM 421 HG2 GLN A 29 12.253 -8.486 8.147 1.00 0.00 H
ATOM 422 HG3 GLN A 29 12.428 -8.581 9.897 1.00 0.00 H
ATOM 423 HE21 GLN A 29 13.409 -10.276 7.631 1.00 0.00 H
ATOM 424 HE22 GLN A 29 12.930 -11.883 8.480 1.00 0.00 H
ATOM 425 N LYS A 30 10.817 -5.813 6.885 1.00 0.00 N
ATOM 426 CA LYS A 30 10.685 -5.487 5.469 1.00 0.00 C
ATOM 427 C LYS A 30 10.743 -6.749 4.613 1.00 0.00 C
ATOM 428 O LYS A 30 10.140 -6.812 3.542 1.00 0.00 O
ATOM 429 CB LYS A 30 11.788 -4.518 5.430 1.00 0.00 C
ATOM 430 CG LYS A 30 11.829 -3.243 5.867 1.00 0.00 C
ATOM 431 CD LYS A 30 10.746 -2.266 5.439 1.00 0.00 C
ATOM 432 CE LYS A 30 10.347 -1.342 6.579 1.00 0.00 C
ATOM 433 NZ LYS A 30 9.569 -2.590 7.628 1.00 0.00 N
ATOM 434 H LYS A 30 11.529 -5.388 7.408 1.00 0.00 H
ATOM 435 HA LYS A 30 9.725 -5.130 5.327 1.00 0.00 H
ATOM 436 HB2 LYS A 30 12.743 -5.130 5.137 1.00 0.00 H
ATOM 437 HB3 LYS A 30 11.633 -4.248 4.700 1.00 0.00 H
ATOM 438 HG2 LYS A 30 11.684 -3.492 6.907 1.00 0.00 H
ATOM 439 HG3 LYS A 30 12.795 -2.773 5.738 1.00 0.00 H
ATOM 440 HD2 LYS A 30 11.116 -1.669 4.618 1.00 0.00 H
ATOM 441 HD3 LYS A 30 9.878 -2.825 5.118 1.00 0.00 H
ATOM 442 HE2 LYS A 30 11.241 -0.932 7.240 1.00 0.00 H
ATOM 443 HE3 LYS A 30 9.743 -0.541 6.180 1.00 0.00 H
ATOM 444 HZ1 LYS A 30 8.550 -1.940 7.461 1.00 0.00 H
ATOM 445 HZ2 LYS A 30 9.803 -1.680 8.567 1.00 0.00 H
ATOM 446 HZ3 LYS A 30 9.795 -3.750 7.610 1.00 0.00 H
ATOM 447 N TYR A 31 11.470 -7.750 5.930 1.00 0.00 N
ATOM 448 CA TYR A 31 11.607 -9.100 4.372 1.00 0.00 C
ATOM 449 C TYR A 31 11.289 -10.196 5.278 1.00 0.00 C
ATOM 450 O TYR A 31 11.620 -10.310 6.479 1.00 0.00 O
ATOM 451 CB TYR A 31 13.220 -9.149 3.809 1.00 0.00 C
ATOM 452 CG TYR A 31 13.295 -8.251 2.624 1.00 0.00 C
ATOM 453 CD1 TYR A 31 13.447 -6.880 2.786 1.00 0.00 C
ATOM 454 CD2 TYR A 31 13.397 -8.774 1.341 1.00 0.00 C
ATOM 455 CE1 TYR A 31 13.694 -6.560 1.704 1.00 0.00 C
ATOM 456 CE2 TYR A 31 13.647 -7.959 0.254 1.00 0.00 C
ATOM 457 CZ TYR A 31 13.793 -6.599 0.442 1.00 0.00 C
ATOM 458 OH TYR A 31 14.410 -5.782 -0.637 1.00 0.00 O
ATOM 459 H TYR A 31 11.927 -7.642 5.953 1.00 0.00 H
ATOM 460 HA TYR A 31 10.904 -9.100 3.552 1.00 0.00 H
ATOM 461 HB2 TYR A 31 13.736 -8.902 4.581 1.00 0.00 H
ATOM 462 HB3 TYR A 31 13.180 -10.170 3.496 1.00 0.00 H
ATOM 463 HD1 TYR A 31 13.369 -6.456 3.777 1.00 0.00 H
ATOM 464 HD2 TYR A 31 13.282 -9.840 1.197 1.00 0.00 H
ATOM 465 HE1 TYR A 31 13.809 -4.992 1.851 1.00 0.00 H
ATOM 466 HE2 TYR A 31 13.723 -8.383 -0.735 1.00 0.00 H
ATOM 467 HH TYR A 31 13.836 -6.254 -1.449 1.00 0.00 H
ATOM 468 N LEU A 32 11.277 -11.390 4.697 1.00 0.00 N
ATOM 469 CA LEU A 32 10.987 -12.604 5.452 1.00 0.00 C
ATOM 470 C LEU A 32 11.680 -13.812 4.826 1.00 0.00 C
ATOM 471 O LEU A 32 11.489 -14.105 3.644 1.00 0.00 O
ATOM 472 CB LEU A 32 9.477 -12.843 5.513 1.00 0.00 C
ATOM 473 CG LEU A 32 8.647 -11.725 6.144 1.00 0.00 C
ATOM 474 CD1 LEU A 32 7.204 -11.800 5.670 1.00 0.00 C
ATOM 475 CD2 LEU A 32 8.717 -11.800 7.663 1.00 0.00 C
ATOM 476 H LEU A 32 11.465 -11.458 3.738 1.00 0.00 H
ATOM 477 HA LEU A 32 11.364 -12.470 6.454 1.00 0.00 H
ATOM 478 HB2 LEU A 32 9.125 -12.989 4.506 1.00 0.00 H
ATOM 479 HB3 LEU A 32 9.310 -13.744 6.860 1.00 0.00 H
ATOM 480 HG LEU A 32 9.500 -10.770 5.836 1.00 0.00 H
ATOM 481 HD11 LEU A 32 6.543 -11.609 6.500 1.00 0.00 H
ATOM 482 HD12 LEU A 32 7.700 -12.784 5.270 1.00 0.00 H
ATOM 483 HD13 LEU A 32 7.390 -11.590 4.901 1.00 0.00 H
ATOM 484 HD21 LEU A 32 8.590 -12.824 7.978 1.00 0.00 H
ATOM 485 HD22 LEU A 32 7.929 -11.194 8.880 1.00 0.00 H
ATOM 486 HD23 LEU A 32 9.675 -11.434 7.998 1.00 0.00 H
ATOM 487 N SER A 33 12.480 -14.508 5.625 1.00 0.00 N
ATOM 488 CA SER A 33 13.201 -15.683 5.147 1.00 0.00 C
ATOM 489 C SER A 33 12.234 -16.743 4.633 1.00 0.00 C
ATOM 490 O SER A 33 11.670 -16.798 5.260 1.00 0.00 O
ATOM 491 CB SER A 33 14.660 -16.265 6.268 1.00 0.00 C
ATOM 492 OG SER A 33 14.698 -15.237 7.110 1.00 0.00 O
ATOM 493 H SER A 33 12.592 -14.225 6.555 1.00 0.00 H
ATOM 494 HA SER A 33 13.842 -15.373 4.335 1.00 0.00 H
ATOM 495 HB2 SER A 33 13.447 -16.845 6.934 1.00 0.00 H
ATOM 496 HB3 SER A 33 14.826 -16.902 5.837 1.00 0.00 H
ATOM 497 HG SER A 33 14.940 -14.906 7.678 1.00 0.00 H
ATOM 498 N PRO A 34 12.727 -17.609 3.735 1.00 0.00 N
ATOM 499 CA PRO A 34 11.923 -18.685 3.148 1.00 0.00 C
ATOM 500 C PRO A 34 11.151 -19.472 4.201 1.00 0.00 C
ATOM 501 O PRO A 34 9.970 -19.781 4.380 1.00 0.00 O
ATOM 502 CB PRO A 34 12.965 -19.576 2.470 1.00 0.00 C
ATOM 503 CG PRO A 34 14.104 -18.666 2.167 1.00 0.00 C
ATOM 504 CD PRO A 34 14.107 -17.603 3.223 1.00 0.00 C
ATOM 505 HA PRO A 34 11.234 -18.305 2.407 1.00 0.00 H
ATOM 506 HB2 PRO A 34 13.260 -20.368 3.145 1.00 0.00 H
ATOM 507 HB3 PRO A 34 12.550 -20.000 1.569 1.00 0.00 H
ATOM 508 HG2 PRO A 34 15.320 -19.215 2.200 1.00 0.00 H
ATOM 509 HG3 PRO A 34 13.967 -18.215 1.195 1.00 0.00 H
ATOM 510 HD2 PRO A 34 14.809 -17.854 4.500 1.00 0.00 H
ATOM 511 HD3 PRO A 34 14.353 -16.645 2.788 1.00 0.00 H
ATOM 512 N PRO A 35 11.831 -19.806 5.308 1.00 0.00 N
ATOM 513 CA PRO A 35 11.227 -20.562 6.409 1.00 0.00 C
ATOM 514 C PRO A 35 9.875 -19.996 6.828 1.00 0.00 C
ATOM 515 O PRO A 35 8.909 -20.739 7.000 1.00 0.00 O
ATOM 516 CB PRO A 35 12.244 -20.409 7.543 1.00 0.00 C
ATOM 517 CG PRO A 35 13.545 -20.174 6.855 1.00 0.00 C
ATOM 518 CD PRO A 35 13.241 -19.472 5.569 1.00 0.00 C
ATOM 519 HA PRO A 35 11.118 -21.607 6.160 1.00 0.00 H
ATOM 520 HB2 PRO A 35 11.968 -19.569 8.166 1.00 0.00 H
ATOM 521 HB3 PRO A 35 12.267 -21.311 8.135 1.00 0.00 H
ATOM 522 HG2 PRO A 35 14.178 -19.554 7.471 1.00 0.00 H
ATOM 523 HG3 PRO A 35 14.270 -21.118 6.651 1.00 0.00 H
ATOM 524 HD2 PRO A 35 13.368 -18.406 5.687 1.00 0.00 H
ATOM 525 HD3 PRO A 35 13.878 -19.845 4.781 1.00 0.00 H
ATOM 526 N GLU A 36 9.812 -18.679 6.988 1.00 0.00 N
ATOM 527 CA GLU A 36 8.576 -18.140 7.387 1.00 0.00 C
ATOM 528 C GLU A 36 7.651 -17.823 6.189 1.00 0.00 C
ATOM 529 O GLU A 36 6.557 -18.385 6.142 1.00 0.00 O
ATOM 530 CB GLU A 36 8.883 -16.660 8.290 1.00 0.00 C
ATOM 531 CG GLU A 36 10.120 -16.711 9.460 1.00 0.00 C
ATOM 532 CD GLU A 36 9.519 -17.000 10.451 1.00 0.00 C
ATOM 533 OE1 GLU A 36 8.428 -16.510 10.810 1.00 0.00 O
ATOM 534 OE2 GLU A 36 10.223 -17.718 11.190 1.00 0.00 O
ATOM 535 H GLU A 36 10.618 -18.139 6.836 1.00 0.00 H
ATOM 536 HA GLU A 36 8.830 -18.644 8.112 1.00 0.00 H
ATOM 537 HB2 GLU A 36 9.156 -15.961 7.254 1.00 0.00 H
ATOM 538 HB3 GLU A 36 7.993 -16.302 8.527 1.00 0.00 H
ATOM 539 HG2 GLU A 36 10.704 -17.486 8.758 1.00 0.00 H
ATOM 540 HG3 GLU A 36 10.520 -15.757 9.500 1.00 0.00 H
ATOM 541 N ARG A 37 8.100 -17.270 5.223 1.00 0.00 N
ATOM 542 CA ARG A 37 7.311 -16.760 4.260 1.00 0.00 C
ATOM 543 C ARG A 37 6.501 -17.989 3.624 1.00 0.00 C
ATOM 544 O ARG A 37 5.342 -17.878 3.223 1.00 0.00 O
ATOM 545 CB ARG A 37 8.223 -16.336 2.874 1.00 0.00 C
ATOM 546 CG ARG A 37 7.497 -15.597 1.763 1.00 0.00 C
ATOM 547 CD ARG A 37 8.312 -15.581 0.479 1.00 0.00 C
ATOM 548 NE ARG A 37 8.576 -16.930 -0.170 1.00 0.00 N
ATOM 549 CZ ARG A 37 9.347 -17.187 -1.670 1.00 0.00 C
ATOM 550 NH1 ARG A 37 9.925 -16.194 -1.730 1.00 0.00 N
ATOM 551 NH2 ARG A 37 9.539 -18.440 -1.458 1.00 0.00 N
ATOM 552 H ARG A 37 8.979 -16.609 5.320 1.00 0.00 H
ATOM 553 HA ARG A 37 6.631 -15.953 4.250 1.00 0.00 H
ATOM 554 HB2 ARG A 37 8.996 -15.690 3.262 1.00 0.00 H
ATOM 555 HB3 ARG A 37 8.680 -17.218 2.450 1.00 0.00 H
ATOM 556 HG2 ARG A 37 6.554 -16.870 1.572 1.00 0.00 H
ATOM 557 HG3 ARG A 37 7.317 -14.579 2.780 1.00 0.00 H
ATOM 558 HD2 ARG A 37 7.763 -15.320 -0.273 1.00 0.00 H
ATOM 559 HD3 ARG A 37 9.251 -15.870 0.671 1.00 0.00 H
ATOM 560 HE ARG A 37 8.159 -17.677 0.457 1.00 0.00 H
ATOM 561 HH11 ARG A 37 9.782 -15.250 -1.437 1.00 0.00 H
ATOM 562 HH12 ARG A 37 10.506 -16.392 -2.519 1.00 0.00 H
ATOM 563 HH21 ARG A 37 9.105 -19.192 -0.962 1.00 0.00 H
ATOM 564 HH22 ARG A 37 10.119 -18.633 -2.250 1.00 0.00 H
ATOM 565 N LYS A 38 7.119 -19.160 3.731 1.00 0.00 N
ATOM 566 CA LYS A 38 6.458 -20.410 3.380 1.00 0.00 C
ATOM 567 C LYS A 38 5.197 -20.614 4.216 1.00 0.00 C
ATOM 568 O LYS A 38 4.104 -20.783 3.677 1.00 0.00 O
ATOM 569 CB LYS A 38 7.411 -21.590 3.579 1.00 0.00 C
ATOM 570 CG LYS A 38 8.461 -21.715 2.490 1.00 0.00 C
ATOM 571 CD LYS A 38 9.722 -22.388 3.600 1.00 0.00 C
ATOM 572 CE LYS A 38 9.562 -23.899 3.690 1.00 0.00 C
ATOM 573 NZ LYS A 38 10.842 -24.579 3.415 1.00 0.00 N
ATOM 574 H LYS A 38 8.450 -19.185 4.570 1.00 0.00 H
ATOM 575 HA LYS A 38 6.178 -20.357 2.338 1.00 0.00 H
ATOM 576 HB2 LYS A 38 7.916 -21.472 4.526 1.00 0.00 H
ATOM 577 HB3 LYS A 38 6.835 -22.505 3.601 1.00 0.00 H
ATOM 578 HG2 LYS A 38 8.600 -22.302 1.680 1.00 0.00 H
ATOM 579 HG3 LYS A 38 8.713 -20.726 2.131 1.00 0.00 H
ATOM 580 HD2 LYS A 38 10.543 -22.152 2.345 1.00 0.00 H
ATOM 581 HD3 LYS A 38 9.939 -22.140 3.997 1.00 0.00 H
ATOM 582 HE2 LYS A 38 8.824 -24.138 3.819 1.00 0.00 H
ATOM 583 HE3 LYS A 38 9.225 -24.253 2.107 1.00 0.00 H
ATOM 584 HZ1 LYS A 38 11.184 -24.246 4.340 1.00 0.00 H
ATOM 585 HZ2 LYS A 38 11.562 -24.371 2.696 1.00 0.00 H
ATOM 586 HZ3 LYS A 38 10.699 -25.607 3.460 1.00 0.00 H
ATOM 587 N ARG A 39 5.360 -20.594 5.534 1.00 0.00 N
ATOM 588 CA ARG A 39 4.236 -20.777 6.445 1.00 0.00 C
ATOM 589 C ARG A 39 3.203 -19.668 6.262 1.00 0.00 C
ATOM 590 O ARG A 39 2.160 -19.936 6.710 1.00 0.00 O
ATOM 591 CB ARG A 39 4.723 -20.798 7.894 1.00 0.00 C
ATOM 592 CG ARG A 39 5.231 -22.159 8.345 1.00 0.00 C
ATOM 593 CD ARG A 39 6.704 -22.341 8.120 1.00 0.00 C
ATOM 594 NE ARG A 39 7.107 -23.744 8.670 1.00 0.00 N
ATOM 595 CZ ARG A 39 8.373 -24.147 8.270 1.00 0.00 C
ATOM 596 NH1 ARG A 39 9.352 -23.259 7.936 1.00 0.00 N
ATOM 597 NH2 ARG A 39 8.659 -25.441 8.810 1.00 0.00 N
ATOM 598 H ARG A 39 6.256 -20.455 5.904 1.00 0.00 H
ATOM 599 HA ARG A 39 3.773 -21.725 6.216 1.00 0.00 H
ATOM 600 HB2 ARG A 39 5.527 -20.840 8.300 1.00 0.00 H
ATOM 601 HB3 ARG A 39 3.908 -20.510 8.541 1.00 0.00 H
ATOM 602 HG2 ARG A 39 5.103 -22.244 9.414 1.00 0.00 H
ATOM 603 HG3 ARG A 39 4.661 -22.929 7.848 1.00 0.00 H
ATOM 604 HD2 ARG A 39 6.885 -21.962 7.180 1.00 0.00 H
ATOM 605 HD3 ARG A 39 7.291 -21.780 8.723 1.00 0.00 H
ATOM 606 HE ARG A 39 6.399 -24.417 8.133 1.00 0.00 H
ATOM 607 HH11 ARG A 39 9.138 -22.283 7.897 1.00 0.00 H
ATOM 608 HH12 ARG A 39 10.303 -23.565 7.908 1.00 0.00 H
ATOM 609 HH21 ARG A 39 7.923 -26.114 8.149 1.00 0.00 H
ATOM 610 HH22 ARG A 39 9.612 -25.743 8.520 1.00 0.00 H
ATOM 611 N LEU A 40 3.661 -18.423 6.322 1.00 0.00 N
ATOM 612 CA LEU A 40 2.779 -17.274 6.164 1.00 0.00 C
ATOM 613 C LEU A 40 1.837 -17.469 4.980 1.00 0.00 C
ATOM 614 O LEU A 40 0.622 -17.322 5.111 1.00 0.00 O
ATOM 615 CB LEU A 40 3.599 -15.998 5.970 1.00 0.00 C
ATOM 616 CG LEU A 40 2.823 -14.682 6.440 1.00 0.00 C
ATOM 617 CD1 LEU A 40 2.332 -14.430 7.460 1.00 0.00 C
ATOM 618 CD2 LEU A 40 3.687 -13.524 5.564 1.00 0.00 C
ATOM 619 H LEU A 40 4.618 -18.272 6.478 1.00 0.00 H
ATOM 620 HA LEU A 40 2.190 -17.180 7.650 1.00 0.00 H
ATOM 621 HB2 LEU A 40 4.361 -15.975 6.736 1.00 0.00 H
ATOM 622 HB3 LEU A 40 4.700 -16.520 4.999 1.00 0.00 H
ATOM 623 HG LEU A 40 1.958 -14.746 5.397 1.00 0.00 H
ATOM 624 HD11 LEU A 40 3.158 -14.517 8.149 1.00 0.00 H
ATOM 625 HD12 LEU A 40 1.575 -15.157 7.713 1.00 0.00 H
ATOM 626 HD13 LEU A 40 1.912 -13.437 7.525 1.00 0.00 H
ATOM 627 HD21 LEU A 40 4.163 -13.550 6.412 1.00 0.00 H
ATOM 628 HD22 LEU A 40 3.690 -12.802 5.510 1.00 0.00 H
ATOM 629 HD23 LEU A 40 4.442 -13.897 4.888 1.00 0.00 H
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