Opened 7 years ago

Closed 7 years ago

#1343 closed defect (nonchimerax)

vr: VRInitError_Init_VRClientDLLNotFound

Reported by: eackad@… Owned by: Tom Goddard
Priority: normal Milestone:
Component: VR Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description 

The following bug report has been submitted:
Platform:        Linux-4.15.0-24-generic-x86_64-with-debian-stretch-sid
ChimeraX Version: 0.8 (2018-09-22)
Description
started steam, then steam VR in ubuntu 16.04. Opened ChimeraX using command line chimerax-daily and loaded the last pdb that I had opened. Then types the command vr on.

Log:
UCSF ChimeraX version: 0.8 (2018-09-22)  
How to cite UCSF ChimeraX  

open /home/eddie/code/namd/output/p450_diltiazem_C3/p450_diltiazem_ionized.pdb
↵

Summary of feedback from opening
/home/eddie/code/namd/output/p450_diltiazem_C3/p450_diltiazem_ionized.pdb  
---  
warnings | Ignored bad PDB record found on line 100001  
ATOM 186a0 OH2 TIP3W 47 -32.874 31.121 80.416 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100002  
ATOM 186a1 H1 TIP3W 47 -32.930 30.691 79.565 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100003  
ATOM 186a2 H2 TIP3W 47 -32.195 31.874 80.284 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100004  
ATOM 186a3 OH2 TIP3W 48 -46.250 25.264 85.468 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100005  
ATOM 186a4 H1 TIP3W 48 -46.890 24.710 85.837 1.00 0.00 WT6 H  
  
91 messages similar to the above omitted  
Duplicate atom serial number found: 18700  
Duplicate atom serial number found: 18701  
Duplicate atom serial number found: 18702  
Duplicate atom serial number found: 18703  
Duplicate atom serial number found: 18704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100107  
ATOM 1870a H1 TIP3W 466 -40.817 27.172 83.987 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100108  
ATOM 1870b H2 TIP3W 466 -40.611 26.481 85.373 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100109  
ATOM 1870c OH2 TIP3W 467 9.057 21.772 87.598 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100110  
ATOM 1870d H1 TIP3W 467 9.312 22.522 88.044 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100111  
ATOM 1870e H2 TIP3W 467 9.629 21.151 87.985 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18710  
Duplicate atom serial number found: 18711  
Duplicate atom serial number found: 18712  
Duplicate atom serial number found: 18713  
Duplicate atom serial number found: 18714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100123  
ATOM 1871a H2 TIP3W 485 -44.998 24.878 84.261 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100124  
ATOM 1871b OH2 TIP3W 486 -45.597 21.107 85.654 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100125  
ATOM 1871c H1 TIP3W 486 -45.891 21.691 84.936 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100126  
ATOM 1871d H2 TIP3W 486 -45.183 20.392 85.166 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100127  
ATOM 1871e OH2 TIP3W 492 14.953 35.739 86.032 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18720  
Duplicate atom serial number found: 18721  
Duplicate atom serial number found: 18722  
Duplicate atom serial number found: 18723  
Duplicate atom serial number found: 18724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100139  
ATOM 1872a OH2 TIP3W 512 -28.387 30.036 86.905 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100140  
ATOM 1872b H1 TIP3W 512 -28.261 30.378 86.057 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100141  
ATOM 1872c H2 TIP3W 512 -29.381 30.236 87.089 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100142  
ATOM 1872d OH2 TIP3W 529 -40.124 44.856 81.418 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100143  
ATOM 1872e H1 TIP3W 529 -39.773 43.996 81.197 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18730  
Duplicate atom serial number found: 18731  
Duplicate atom serial number found: 18732  
Duplicate atom serial number found: 18733  
Duplicate atom serial number found: 18734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100155  
ATOM 1873a H1 TIP3W 562 -47.728 37.700 77.431 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100156  
ATOM 1873b H2 TIP3W 562 -47.502 39.229 77.332 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100157  
ATOM 1873c OH2 TIP3W 568 -39.370 37.966 78.839 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100158  
ATOM 1873d H1 TIP3W 568 -39.399 38.891 78.482 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100159  
ATOM 1873e H2 TIP3W 568 -39.713 37.374 78.151 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18740  
Duplicate atom serial number found: 18741  
Duplicate atom serial number found: 18742  
Duplicate atom serial number found: 18743  
Duplicate atom serial number found: 18744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100171  
ATOM 1874a H2 TIP3W 591 -47.504 44.157 82.650 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100172  
ATOM 1874b OH2 TIP3W 592 -35.780 40.913 88.931 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100173  
ATOM 1874c H1 TIP3W 592 -36.109 41.802 89.126 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100174  
ATOM 1874d H2 TIP3W 592 -35.944 40.338 89.692 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100175  
ATOM 1874e OH2 TIP3W 593 -48.005 44.440 85.854 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18750  
Duplicate atom serial number found: 18751  
Duplicate atom serial number found: 18752  
Duplicate atom serial number found: 18753  
Duplicate atom serial number found: 18754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100187  
ATOM 1875a OH2 TIP3W 632 -40.819 39.884 83.476 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100188  
ATOM 1875b H1 TIP3W 632 -39.993 40.356 83.542 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100189  
ATOM 1875c H2 TIP3W 632 -41.483 40.536 83.151 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100190  
ATOM 1875d OH2 TIP3W 634 -38.071 31.170 81.557 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100191  
ATOM 1875e H1 TIP3W 634 -38.950 30.961 81.247 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18760  
Duplicate atom serial number found: 18761  
Duplicate atom serial number found: 18762  
Duplicate atom serial number found: 18763  
Duplicate atom serial number found: 18764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100203  
ATOM 1876a H1 TIP3W 887 -22.486 27.699 76.143 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100204  
ATOM 1876b H2 TIP3W 887 -21.125 28.347 76.392 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100205  
ATOM 1876c OH2 TIP3W 888 -40.764 24.406 76.483 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100206  
ATOM 1876d H1 TIP3W 888 -40.456 24.230 75.587 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100207  
ATOM 1876e H2 TIP3W 888 -39.935 24.199 76.924 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18770  
Duplicate atom serial number found: 18771  
Duplicate atom serial number found: 18772  
Duplicate atom serial number found: 18773  
Duplicate atom serial number found: 18774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100219  
ATOM 1877a H2 TIP3W 908 -45.829 23.740 88.383 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100220  
ATOM 1877b OH2 TIP3W 924 -36.507 25.871 78.054 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100221  
ATOM 1877c H1 TIP3W 924 -36.092 26.260 78.826 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100222  
ATOM 1877d H2 TIP3W 924 -36.018 25.060 77.878 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100223  
ATOM 1877e OH2 TIP3W 927 -37.823 26.030 83.767 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18780  
Duplicate atom serial number found: 18781  
Duplicate atom serial number found: 18782  
Duplicate atom serial number found: 18783  
Duplicate atom serial number found: 18784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100235  
ATOM 1878a OH2 TIP3W 952 -32.992 34.216 87.249 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100236  
ATOM 1878b H1 TIP3W 952 -32.305 34.121 86.523 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100237  
ATOM 1878c H2 TIP3W 952 -33.814 33.940 86.781 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100238  
ATOM 1878d OH2 TIP3W 964 -41.170 36.171 77.834 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100239  
ATOM 1878e H1 TIP3W 964 -41.743 36.290 77.086 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18790  
Duplicate atom serial number found: 18791  
Duplicate atom serial number found: 18792  
Duplicate atom serial number found: 18793  
Duplicate atom serial number found: 18794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100251  
ATOM 1879a H1 TIP3W 987 -44.358 38.580 75.258 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100252  
ATOM 1879b H2 TIP3W 987 -45.532 38.160 76.105 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100253  
ATOM 1879c OH2 TIP3W 988 -35.088 42.882 78.125 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100254  
ATOM 1879d H1 TIP3W 988 -35.333 43.808 78.378 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100255  
ATOM 1879e H2 TIP3W 988 -35.512 42.336 78.839 1.00 0.00 WT6 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 18800  
Duplicate atom serial number found: 18801  
Duplicate atom serial number found: 18802  
Duplicate atom serial number found: 18803  
Duplicate atom serial number found: 18804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100363  
ATOM 1880a H2 TIP3W1367 -38.892 33.121 81.824 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100364  
ATOM 1880b OH2 TIP3W1368 -26.588 24.025 88.504 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100365  
ATOM 1880c H1 TIP3W1368 -27.148 24.399 89.227 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100366  
ATOM 1880d H2 TIP3W1368 -27.042 23.189 88.332 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100367  
ATOM 1880e OH2 TIP3W1370 -44.346 22.136 80.862 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18810  
Duplicate atom serial number found: 18811  
Duplicate atom serial number found: 18812  
Duplicate atom serial number found: 18813  
Duplicate atom serial number found: 18814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100379  
ATOM 1881a OH2 TIP3W1386 16.334 17.122 75.857 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100380  
ATOM 1881b H1 TIP3W1386 15.846 17.952 75.568 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100381  
ATOM 1881c H2 TIP3W1386 15.719 16.607 76.425 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100382  
ATOM 1881d OH2 TIP3W1387 -45.314 24.773 79.240 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100383  
ATOM 1881e H1 TIP3W1387 -44.506 24.350 78.923 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18820  
Duplicate atom serial number found: 18821  
Duplicate atom serial number found: 18822  
Duplicate atom serial number found: 18823  
Duplicate atom serial number found: 18824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100395  
ATOM 1882a H1 TIP3W1408 -43.986 41.716 77.748 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100396  
ATOM 1882b H2 TIP3W1408 -45.372 41.447 77.352 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100397  
ATOM 1882c OH2 TIP3W1411 -38.970 27.861 79.273 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100398  
ATOM 1882d H1 TIP3W1411 -39.726 27.247 79.261 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100399  
ATOM 1882e H2 TIP3W1411 -38.467 27.781 78.500 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18830  
Duplicate atom serial number found: 18831  
Duplicate atom serial number found: 18832  
Duplicate atom serial number found: 18833  
Duplicate atom serial number found: 18834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100411  
ATOM 1883a H2 TIP3W1427 -37.343 26.810 76.819 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100412  
ATOM 1883b OH2 TIP3W1428 -35.932 19.334 85.988 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100413  
ATOM 1883c H1 TIP3W1428 -36.197 18.892 85.134 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100414  
ATOM 1883d H2 TIP3W1428 -34.990 19.268 85.951 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100415  
ATOM 1883e OH2 TIP3W1429 -43.550 25.487 81.176 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18840  
Duplicate atom serial number found: 18841  
Duplicate atom serial number found: 18842  
Duplicate atom serial number found: 18843  
Duplicate atom serial number found: 18844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100427  
ATOM 1884a OH2 TIP3W1452 -42.156 30.080 76.034 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100428  
ATOM 1884b H1 TIP3W1452 -41.300 29.899 75.541 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100429  
ATOM 1884c H2 TIP3W1452 -42.414 30.964 75.801 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100430  
ATOM 1884d OH2 TIP3W1453 -31.095 44.562 82.287 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100431  
ATOM 1884e H1 TIP3W1453 -31.826 44.925 81.801 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18850  
Duplicate atom serial number found: 18851  
Duplicate atom serial number found: 18852  
Duplicate atom serial number found: 18853  
Duplicate atom serial number found: 18854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100443  
ATOM 1885a H1 TIP3W1497 -42.893 28.170 82.639 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100444  
ATOM 1885b H2 TIP3W1497 -42.520 26.807 82.192 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100445  
ATOM 1885c OH2 TIP3W1512 -38.691 37.920 87.320 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100446  
ATOM 1885d H1 TIP3W1512 -37.986 37.347 87.024 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100447  
ATOM 1885e H2 TIP3W1512 -39.405 37.381 87.022 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18860  
Duplicate atom serial number found: 18861  
Duplicate atom serial number found: 18862  
Duplicate atom serial number found: 18863  
Duplicate atom serial number found: 18864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100459  
ATOM 1886a H2 TIP3W1621 8.581 40.605 83.647 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100460  
ATOM 1886b OH2 TIP3W1640 12.323 48.994 82.844 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100461  
ATOM 1886c H1 TIP3W1640 12.316 48.826 81.857 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100462  
ATOM 1886d H2 TIP3W1640 13.220 48.826 83.156 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100463  
ATOM 1886e OH2 TIP3W1707 -36.887 17.341 80.781 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18870  
Duplicate atom serial number found: 18871  
Duplicate atom serial number found: 18872  
Duplicate atom serial number found: 18873  
Duplicate atom serial number found: 18874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100475  
ATOM 1887a OH2 TIP3W1750 -41.939 41.392 78.382 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100476  
ATOM 1887b H1 TIP3W1750 -41.015 41.680 78.276 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100477  
ATOM 1887c H2 TIP3W1750 -41.849 40.423 78.284 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100478  
ATOM 1887d OH2 TIP3W1764 -43.859 18.031 76.338 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100479  
ATOM 1887e H1 TIP3W1764 -44.303 17.530 77.073 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18880  
Duplicate atom serial number found: 18881  
Duplicate atom serial number found: 18882  
Duplicate atom serial number found: 18883  
Duplicate atom serial number found: 18884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100491  
ATOM 1888a H1 TIP3W1789 -42.588 23.046 77.857 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100492  
ATOM 1888b H2 TIP3W1789 -43.791 22.376 77.273 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100493  
ATOM 1888c OH2 TIP3W1810 -18.333 37.896 77.271 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100494  
ATOM 1888d H1 TIP3W1810 -18.400 38.503 78.058 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100495  
ATOM 1888e H2 TIP3W1810 -19.272 37.662 77.113 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18890  
Duplicate atom serial number found: 18891  
Duplicate atom serial number found: 18892  
Duplicate atom serial number found: 18893  
Duplicate atom serial number found: 18894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100507  
ATOM 1889a H2 TIP3W1830 -34.622 30.044 79.325 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100508  
ATOM 1889b OH2 TIP3W1831 -41.686 16.648 84.991 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100509  
ATOM 1889c H1 TIP3W1831 -41.553 16.615 83.996 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100510  
ATOM 1889d H2 TIP3W1831 -40.781 16.755 85.265 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100511  
ATOM 1889e OH2 TIP3W1837 -39.737 44.694 88.262 1.00 0.00 WT6 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 18900  
Duplicate atom serial number found: 18901  
Duplicate atom serial number found: 18902  
Duplicate atom serial number found: 18903  
Duplicate atom serial number found: 18904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100619  
ATOM 1890a OH2 TIP3W2227 -37.800 20.571 79.310 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100620  
ATOM 1890b H1 TIP3W2227 -36.947 20.780 79.767 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100621  
ATOM 1890c H2 TIP3W2227 -38.428 20.845 79.977 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100622  
ATOM 1890d OH2 TIP3W2229 -28.086 34.708 85.067 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100623  
ATOM 1890e H1 TIP3W2229 -27.281 34.888 85.658 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18910  
Duplicate atom serial number found: 18911  
Duplicate atom serial number found: 18912  
Duplicate atom serial number found: 18913  
Duplicate atom serial number found: 18914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100635  
ATOM 1891a H1 TIP3W2253 -31.042 35.330 85.672 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100636  
ATOM 1891b H2 TIP3W2253 -29.849 34.410 85.486 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100637  
ATOM 1891c OH2 TIP3W2270 -45.826 27.579 81.793 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100638  
ATOM 1891d H1 TIP3W2270 -45.096 27.492 81.191 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100639  
ATOM 1891e H2 TIP3W2270 -45.796 28.524 81.968 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18920  
Duplicate atom serial number found: 18921  
Duplicate atom serial number found: 18922  
Duplicate atom serial number found: 18923  
Duplicate atom serial number found: 18924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100651  
ATOM 1892a H2 TIP3W2290 -48.322 48.977 80.570 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100652  
ATOM 1892b OH2 TIP3W2293 -47.359 34.684 83.975 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100653  
ATOM 1892c H1 TIP3W2293 -48.245 34.910 83.847 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100654  
ATOM 1892d H2 TIP3W2293 -47.019 35.423 84.504 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100655  
ATOM 1892e OH2 TIP3W2296 -21.692 27.060 88.382 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18930  
Duplicate atom serial number found: 18931  
Duplicate atom serial number found: 18932  
Duplicate atom serial number found: 18933  
Duplicate atom serial number found: 18934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100667  
ATOM 1893a OH2 TIP3W2313 -20.692 24.170 87.040 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100668  
ATOM 1893b H1 TIP3W2313 -20.436 23.245 86.755 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100669  
ATOM 1893c H2 TIP3W2313 -20.875 24.071 87.979 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100670  
ATOM 1893d OH2 TIP3W2314 13.989 27.763 76.897 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100671  
ATOM 1893e H1 TIP3W2314 13.320 28.016 77.519 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18940  
Duplicate atom serial number found: 18941  
Duplicate atom serial number found: 18942  
Duplicate atom serial number found: 18943  
Duplicate atom serial number found: 18944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100683  
ATOM 1894a H1 TIP3W2331 -21.986 29.761 83.918 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100684  
ATOM 1894b H2 TIP3W2331 -21.106 29.293 82.776 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100685  
ATOM 1894c OH2 TIP3W2332 -22.950 35.173 86.285 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100686  
ATOM 1894d H1 TIP3W2332 -23.100 36.092 86.204 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100687  
ATOM 1894e H2 TIP3W2332 -22.545 34.936 85.386 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18950  
Duplicate atom serial number found: 18951  
Duplicate atom serial number found: 18952  
Duplicate atom serial number found: 18953  
Duplicate atom serial number found: 18954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100699  
ATOM 1895a H2 TIP3W2354 -31.289 47.281 83.058 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100700  
ATOM 1895b OH2 TIP3W2355 -29.934 32.888 82.636 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100701  
ATOM 1895c H1 TIP3W2355 -30.700 33.350 83.028 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100702  
ATOM 1895d H2 TIP3W2355 -30.256 32.712 81.722 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100703  
ATOM 1895e OH2 TIP3W2357 -45.883 28.239 85.909 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18960  
Duplicate atom serial number found: 18961  
Duplicate atom serial number found: 18962  
Duplicate atom serial number found: 18963  
Duplicate atom serial number found: 18964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100715  
ATOM 1896a OH2 TIP3W2377 -31.653 23.314 88.549 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100716  
ATOM 1896b H1 TIP3W2377 -31.965 23.700 87.770 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100717  
ATOM 1896c H2 TIP3W2377 -31.312 22.467 88.225 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100718  
ATOM 1896d OH2 TIP3W2378 -21.188 44.764 76.001 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100719  
ATOM 1896e H1 TIP3W2378 -21.486 45.332 76.703 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18970  
Duplicate atom serial number found: 18971  
Duplicate atom serial number found: 18972  
Duplicate atom serial number found: 18973  
Duplicate atom serial number found: 18974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100731  
ATOM 1897a H1 TIP3W2477 -37.878 46.453 76.206 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100732  
ATOM 1897b H2 TIP3W2477 -36.777 47.204 75.500 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100733  
ATOM 1897c OH2 TIP3W2606 -30.673 16.795 87.297 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100734  
ATOM 1897d H1 TIP3W2606 -30.175 16.560 88.133 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100735  
ATOM 1897e H2 TIP3W2606 -30.597 17.786 87.219 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18980  
Duplicate atom serial number found: 18981  
Duplicate atom serial number found: 18982  
Duplicate atom serial number found: 18983  
Duplicate atom serial number found: 18984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100747  
ATOM 1898a H2 TIP3W2624 -26.035 15.893 83.763 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100748  
ATOM 1898b OH2 TIP3W2628 -22.838 25.947 85.895 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100749  
ATOM 1898c H1 TIP3W2628 -23.021 25.052 86.173 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100750  
ATOM 1898d H2 TIP3W2628 -23.706 26.442 86.121 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100751  
ATOM 1898e OH2 TIP3W2634 -40.441 19.934 87.374 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 18990  
Duplicate atom serial number found: 18991  
Duplicate atom serial number found: 18992  
Duplicate atom serial number found: 18993  
Duplicate atom serial number found: 18994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 100763  
ATOM 1899a OH2 TIP3W2652 -13.259 17.240 88.626 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100764  
ATOM 1899b H1 TIP3W2652 -14.195 17.290 88.380 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100765  
ATOM 1899c H2 TIP3W2652 -13.052 16.321 88.832 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 100766  
ATOM 1899d OH2 TIP3W2654 -21.796 26.097 83.415 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 100767  
ATOM 1899e H1 TIP3W2654 -21.357 26.816 83.859 1.00 0.00 WT6 H  
  
1633 messages similar to the above omitted  
Duplicate atom serial number found: 19000  
Duplicate atom serial number found: 19001  
Duplicate atom serial number found: 19002  
Duplicate atom serial number found: 19003  
Duplicate atom serial number found: 19004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102411  
ATOM 1900a H1 TIP3W8046 -45.399 38.369 87.509 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102412  
ATOM 1900b H2 TIP3W8046 -46.139 39.411 86.692 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102413  
ATOM 1900c OH2 TIP3W8047 12.058 18.453 77.719 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102414  
ATOM 1900d H1 TIP3W8047 11.138 18.441 77.423 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102415  
ATOM 1900e H2 TIP3W8047 11.952 18.592 78.669 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19010  
Duplicate atom serial number found: 19011  
Duplicate atom serial number found: 19012  
Duplicate atom serial number found: 19013  
Duplicate atom serial number found: 19014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102427  
ATOM 1901a H2 TIP3W8069 10.710 46.969 84.727 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102428  
ATOM 1901b OH2 TIP3W8070 -15.535 23.921 82.959 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102429  
ATOM 1901c H1 TIP3W8070 -15.660 23.549 82.031 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102430  
ATOM 1901d H2 TIP3W8070 -15.260 23.153 83.515 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102431  
ATOM 1901e OH2 TIP3W8084 7.358 39.113 83.451 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19020  
Duplicate atom serial number found: 19021  
Duplicate atom serial number found: 19022  
Duplicate atom serial number found: 19023  
Duplicate atom serial number found: 19024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102443  
ATOM 1902a OH2 TIP3W8092 1.817 43.495 82.506 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102444  
ATOM 1902b H1 TIP3W8092 2.375 44.111 82.938 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102445  
ATOM 1902c H2 TIP3W8092 1.321 43.139 83.272 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102446  
ATOM 1902d OH2 TIP3W8104 5.559 44.305 81.877 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102447  
ATOM 1902e H1 TIP3W8104 4.783 44.798 82.167 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19030  
Duplicate atom serial number found: 19031  
Duplicate atom serial number found: 19032  
Duplicate atom serial number found: 19033  
Duplicate atom serial number found: 19034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102459  
ATOM 1903a H1 TIP3W8111 11.813 29.559 78.513 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102460  
ATOM 1903b H2 TIP3W8111 12.295 30.973 78.413 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102461  
ATOM 1903c OH2 TIP3W8112 4.050 39.417 86.658 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102462  
ATOM 1903d H1 TIP3W8112 3.855 38.415 86.635 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102463  
ATOM 1903e H2 TIP3W8112 4.487 39.638 87.491 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19040  
Duplicate atom serial number found: 19041  
Duplicate atom serial number found: 19042  
Duplicate atom serial number found: 19043  
Duplicate atom serial number found: 19044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102475  
ATOM 1904a H2 TIP3W8131 3.441 48.771 89.201 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102476  
ATOM 1904b OH2 TIP3W8136 -47.586 47.850 88.141 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102477  
ATOM 1904c H1 TIP3W8136 -46.925 47.384 87.590 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102478  
ATOM 1904d H2 TIP3W8136 -47.258 48.773 88.180 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102479  
ATOM 1904e OH2 TIP3W8150 10.146 43.527 84.387 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19050  
Duplicate atom serial number found: 19051  
Duplicate atom serial number found: 19052  
Duplicate atom serial number found: 19053  
Duplicate atom serial number found: 19054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102491  
ATOM 1905a OH2 TIP3W8319 15.533 17.369 79.605 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102492  
ATOM 1905b H1 TIP3W8319 14.990 18.045 80.099 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102493  
ATOM 1905c H2 TIP3W8319 16.418 17.501 80.052 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102494  
ATOM 1905d OH2 TIP3W8345 -7.361 36.754 82.342 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102495  
ATOM 1905e H1 TIP3W8345 -7.561 37.352 81.546 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19060  
Duplicate atom serial number found: 19061  
Duplicate atom serial number found: 19062  
Duplicate atom serial number found: 19063  
Duplicate atom serial number found: 19064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102507  
ATOM 1906a H1 TIP3W8382 3.913 24.950 86.117 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102508  
ATOM 1906b H2 TIP3W8382 4.776 24.807 87.292 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102509  
ATOM 1906c OH2 TIP3W8403 -44.249 35.429 78.653 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102510  
ATOM 1906d H1 TIP3W8403 -44.246 35.397 79.599 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102511  
ATOM 1906e H2 TIP3W8403 -43.700 34.726 78.451 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19070  
Duplicate atom serial number found: 19071  
Duplicate atom serial number found: 19072  
Duplicate atom serial number found: 19073  
Duplicate atom serial number found: 19074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102523  
ATOM 1907a H2 TIP3W8428 6.652 42.828 84.983 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102524  
ATOM 1907b OH2 TIP3W8441 -42.754 37.635 89.403 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102525  
ATOM 1907c H1 TIP3W8441 -41.873 37.952 89.633 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102526  
ATOM 1907d H2 TIP3W8441 -43.198 38.494 89.294 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102527  
ATOM 1907e OH2 TIP3W8442 14.485 33.835 77.560 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19080  
Duplicate atom serial number found: 19081  
Duplicate atom serial number found: 19082  
Duplicate atom serial number found: 19083  
Duplicate atom serial number found: 19084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102539  
ATOM 1908a OH2 TIP3W8449 4.146 36.349 76.011 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102540  
ATOM 1908b H1 TIP3W8449 5.063 36.535 75.586 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102541  
ATOM 1908c H2 TIP3W8449 4.206 36.906 76.785 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102542  
ATOM 1908d OH2 TIP3W8462 -10.936 36.764 86.496 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102543  
ATOM 1908e H1 TIP3W8462 -10.789 35.902 86.931 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19090  
Duplicate atom serial number found: 19091  
Duplicate atom serial number found: 19092  
Duplicate atom serial number found: 19093  
Duplicate atom serial number found: 19094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102555  
ATOM 1909a H1 TIP3W8468 -47.406 29.769 88.802 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102556  
ATOM 1909b H2 TIP3W8468 -48.095 30.863 89.473 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102557  
ATOM 1909c OH2 TIP3W8486 -2.530 37.509 77.242 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102558  
ATOM 1909d H1 TIP3W8486 -2.977 37.624 78.119 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102559  
ATOM 1909e H2 TIP3W8486 -3.188 37.296 76.590 1.00 0.00 WT6 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19100  
Duplicate atom serial number found: 19101  
Duplicate atom serial number found: 19102  
Duplicate atom serial number found: 19103  
Duplicate atom serial number found: 19104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102667  
ATOM 1910a H2 TIP3W8849 2.387 17.420 88.519 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102668  
ATOM 1910b OH2 TIP3W8863 9.239 18.214 77.783 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102669  
ATOM 1910c H1 TIP3W8863 8.385 18.087 78.323 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102670  
ATOM 1910d H2 TIP3W8863 9.610 17.373 77.847 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102671  
ATOM 1910e OH2 TIP3W8865 -37.485 38.761 80.666 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19110  
Duplicate atom serial number found: 19111  
Duplicate atom serial number found: 19112  
Duplicate atom serial number found: 19113  
Duplicate atom serial number found: 19114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102683  
ATOM 1911a OH2 TIP3W8884 15.154 26.517 83.903 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102684  
ATOM 1911b H1 TIP3W8884 15.095 27.365 83.501 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102685  
ATOM 1911c H2 TIP3W8884 15.997 26.186 83.612 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102686  
ATOM 1911d OH2 TIP3W8885 2.065 33.089 77.579 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102687  
ATOM 1911e H1 TIP3W8885 1.306 33.097 78.240 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19120  
Duplicate atom serial number found: 19121  
Duplicate atom serial number found: 19122  
Duplicate atom serial number found: 19123  
Duplicate atom serial number found: 19124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102699  
ATOM 1912a H1 TIP3W8911 7.216 33.794 88.010 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102700  
ATOM 1912b H2 TIP3W8911 7.977 33.747 86.787 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102701  
ATOM 1912c OH2 TIP3W8925 16.063 22.091 76.338 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102702  
ATOM 1912d H1 TIP3W8925 16.254 21.976 75.437 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102703  
ATOM 1912e H2 TIP3W8925 15.987 21.139 76.618 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19130  
Duplicate atom serial number found: 19131  
Duplicate atom serial number found: 19132  
Duplicate atom serial number found: 19133  
Duplicate atom serial number found: 19134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102715  
ATOM 1913a H2 TIP3W8944 14.155 30.414 79.570 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102716  
ATOM 1913b OH2 TIP3W8949 -40.218 33.606 78.201 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102717  
ATOM 1913c H1 TIP3W8949 -40.996 33.205 78.636 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102718  
ATOM 1913d H2 TIP3W8949 -39.860 32.841 77.809 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102719  
ATOM 1913e OH2 TIP3W8951 13.670 40.070 87.547 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19140  
Duplicate atom serial number found: 19141  
Duplicate atom serial number found: 19142  
Duplicate atom serial number found: 19143  
Duplicate atom serial number found: 19144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102731  
ATOM 1914a OH2 TIP3W8973 -45.339 41.733 81.509 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102732  
ATOM 1914b H1 TIP3W8973 -44.828 41.291 80.835 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102733  
ATOM 1914c H2 TIP3W8973 -44.952 41.472 82.308 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102734  
ATOM 1914d OH2 TIP3W8976 -40.068 43.806 83.848 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102735  
ATOM 1914e H1 TIP3W8976 -40.791 43.438 84.450 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19150  
Duplicate atom serial number found: 19151  
Duplicate atom serial number found: 19152  
Duplicate atom serial number found: 19153  
Duplicate atom serial number found: 19154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102747  
ATOM 1915a H1 TIP3W9008 16.485 40.583 76.121 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102748  
ATOM 1915b H2 TIP3W9008 15.522 39.477 76.574 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102749  
ATOM 1915c OH2 TIP3W9009 16.279 35.771 76.242 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102750  
ATOM 1915d H1 TIP3W9009 17.142 35.383 75.991 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102751  
ATOM 1915e H2 TIP3W9009 15.816 34.991 76.650 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19160  
Duplicate atom serial number found: 19161  
Duplicate atom serial number found: 19162  
Duplicate atom serial number found: 19163  
Duplicate atom serial number found: 19164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102763  
ATOM 1916a H2 TIP3W9039 -6.806 26.755 89.068 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102764  
ATOM 1916b OH2 TIP3W9047 -44.284 44.809 76.797 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102765  
ATOM 1916c H1 TIP3W9047 -45.001 45.158 77.329 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102766  
ATOM 1916d H2 TIP3W9047 -44.433 43.830 76.848 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102767  
ATOM 1916e OH2 TIP3W9054 -41.244 46.547 89.691 1.00 0.00 WT6 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19170  
Duplicate atom serial number found: 19171  
Duplicate atom serial number found: 19172  
Duplicate atom serial number found: 19173  
Duplicate atom serial number found: 19174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102779  
ATOM 1917a OH2 TIP3W9094 15.117 44.097 88.930 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102780  
ATOM 1917b H1 TIP3W9094 15.704 43.422 88.576 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102781  
ATOM 1917c H2 TIP3W9094 14.319 43.808 88.512 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102782  
ATOM 1917d OH2 TIP3W9096 -46.085 30.616 79.232 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102783  
ATOM 1917e H1 TIP3W9096 -46.845 30.834 79.755 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19180  
Duplicate atom serial number found: 19181  
Duplicate atom serial number found: 19182  
Duplicate atom serial number found: 19183  
Duplicate atom serial number found: 19184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102795  
ATOM 1918a H1 TIP3W9243 13.071 26.810 79.850 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102796  
ATOM 1918b H2 TIP3W9243 12.808 25.619 78.964 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102797  
ATOM 1918c OH2 TIP3W9246 5.576 22.343 88.328 1.00 0.00 WT6 O  
  
Ignored bad PDB record found on line 102798  
ATOM 1918d H1 TIP3W9246 5.889 22.149 87.434 1.00 0.00 WT6 H  
  
Ignored bad PDB record found on line 102799  
ATOM 1918e H2 TIP3W9246 4.805 21.690 88.456 1.00 0.00 WT6 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19190  
Duplicate atom serial number found: 19191  
Duplicate atom serial number found: 19192  
Duplicate atom serial number found: 19193  
Duplicate atom serial number found: 19194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102811  
ATOM 1919a H2 TIP3W 7 23.011 -44.912 -34.039 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102812  
ATOM 1919b OH2 TIP3W 8 20.989 -45.040 -25.113 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102813  
ATOM 1919c H1 TIP3W 8 20.378 -45.840 -25.020 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102814  
ATOM 1919d H2 TIP3W 8 20.414 -44.345 -25.578 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102815  
ATOM 1919e OH2 TIP3W 21 21.606 -32.304 -42.928 1.00 0.00 WT7 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19200  
Duplicate atom serial number found: 19201  
Duplicate atom serial number found: 19202  
Duplicate atom serial number found: 19203  
Duplicate atom serial number found: 19204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102923  
ATOM 1920a OH2 TIP3W 175 16.469 -46.019 -34.380 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102924  
ATOM 1920b H1 TIP3W 175 15.740 -46.470 -34.869 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102925  
ATOM 1920c H2 TIP3W 175 16.820 -45.464 -35.088 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102926  
ATOM 1920d OH2 TIP3W 178 21.238 -12.142 -37.213 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102927  
ATOM 1920e H1 TIP3W 178 20.566 -12.780 -37.533 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19210  
Duplicate atom serial number found: 19211  
Duplicate atom serial number found: 19212  
Duplicate atom serial number found: 19213  
Duplicate atom serial number found: 19214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102939  
ATOM 1921a H1 TIP3W 195 20.192 -16.613 -45.984 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102940  
ATOM 1921b H2 TIP3W 195 18.644 -16.421 -45.972 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102941  
ATOM 1921c OH2 TIP3W 196 19.280 -8.022 -43.045 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102942  
ATOM 1921d H1 TIP3W 196 18.788 -7.687 -42.248 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102943  
ATOM 1921e H2 TIP3W 196 18.821 -7.626 -43.799 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19220  
Duplicate atom serial number found: 19221  
Duplicate atom serial number found: 19222  
Duplicate atom serial number found: 19223  
Duplicate atom serial number found: 19224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102955  
ATOM 1922a H2 TIP3W 218 35.764 -16.810 -32.338 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102956  
ATOM 1922b OH2 TIP3W 224 40.588 2.552 -26.255 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102957  
ATOM 1922c H1 TIP3W 224 41.258 1.978 -25.807 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102958  
ATOM 1922d H2 TIP3W 224 39.910 1.891 -26.398 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102959  
ATOM 1922e OH2 TIP3W 237 16.984 -19.748 -53.417 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19230  
Duplicate atom serial number found: 19231  
Duplicate atom serial number found: 19232  
Duplicate atom serial number found: 19233  
Duplicate atom serial number found: 19234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102971  
ATOM 1923a OH2 TIP3W 255 23.654 -3.372 -52.805 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102972  
ATOM 1923b H1 TIP3W 255 24.237 -3.745 -53.472 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102973  
ATOM 1923c H2 TIP3W 255 24.231 -2.698 -52.443 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102974  
ATOM 1923d OH2 TIP3W 257 22.305 -13.788 -47.437 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102975  
ATOM 1923e H1 TIP3W 257 21.928 -13.151 -48.109 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19240  
Duplicate atom serial number found: 19241  
Duplicate atom serial number found: 19242  
Duplicate atom serial number found: 19243  
Duplicate atom serial number found: 19244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 102987  
ATOM 1924a H1 TIP3W 295 23.563 -16.045 -39.219 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102988  
ATOM 1924b H2 TIP3W 295 24.697 -16.766 -38.503 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102989  
ATOM 1924c OH2 TIP3W 302 26.325 -4.132 -35.737 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 102990  
ATOM 1924d H1 TIP3W 302 26.108 -4.474 -36.616 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 102991  
ATOM 1924e H2 TIP3W 302 27.298 -4.256 -35.709 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19250  
Duplicate atom serial number found: 19251  
Duplicate atom serial number found: 19252  
Duplicate atom serial number found: 19253  
Duplicate atom serial number found: 19254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103003  
ATOM 1925a H2 TIP3W 317 23.718 3.651 -36.229 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103004  
ATOM 1925b OH2 TIP3W 322 28.701 -4.316 -41.371 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103005  
ATOM 1925c H1 TIP3W 322 28.066 -4.263 -40.654 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103006  
ATOM 1925d H2 TIP3W 322 29.587 -4.529 -40.990 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103007  
ATOM 1925e OH2 TIP3W 323 16.649 -6.561 -33.117 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19260  
Duplicate atom serial number found: 19261  
Duplicate atom serial number found: 19262  
Duplicate atom serial number found: 19263  
Duplicate atom serial number found: 19264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103019  
ATOM 1926a OH2 TIP3W 344 18.025 -1.666 -49.660 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103020  
ATOM 1926b H1 TIP3W 344 18.491 -2.520 -49.823 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103021  
ATOM 1926c H2 TIP3W 344 18.737 -1.028 -49.687 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103022  
ATOM 1926d OH2 TIP3W 362 28.494 12.260 -40.838 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103023  
ATOM 1926e H1 TIP3W 362 27.982 11.501 -40.661 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19270  
Duplicate atom serial number found: 19271  
Duplicate atom serial number found: 19272  
Duplicate atom serial number found: 19273  
Duplicate atom serial number found: 19274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103035  
ATOM 1927a H1 TIP3W 392 30.189 14.894 -34.090 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103036  
ATOM 1927b H2 TIP3W 392 31.296 15.894 -34.294 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103037  
ATOM 1927c OH2 TIP3W 401 17.939 4.320 -43.121 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103038  
ATOM 1927d H1 TIP3W 401 17.313 4.595 -43.876 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103039  
ATOM 1927e H2 TIP3W 401 17.393 4.473 -42.314 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19280  
Duplicate atom serial number found: 19281  
Duplicate atom serial number found: 19282  
Duplicate atom serial number found: 19283  
Duplicate atom serial number found: 19284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103051  
ATOM 1928a H2 TIP3W 425 17.864 4.138 -49.631 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103052  
ATOM 1928b OH2 TIP3W 427 21.321 7.219 -43.574 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103053  
ATOM 1928c H1 TIP3W 427 21.170 8.082 -44.009 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103054  
ATOM 1928d H2 TIP3W 427 22.155 7.339 -43.142 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103055  
ATOM 1928e OH2 TIP3W 443 26.355 -36.124 -44.809 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19290  
Duplicate atom serial number found: 19291  
Duplicate atom serial number found: 19292  
Duplicate atom serial number found: 19293  
Duplicate atom serial number found: 19294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103067  
ATOM 1929a OH2 TIP3W 465 30.310 -47.081 -52.008 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103068  
ATOM 1929b H1 TIP3W 465 30.617 -46.319 -51.578 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103069  
ATOM 1929c H2 TIP3W 465 29.631 -47.423 -51.422 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103070  
ATOM 1929d OH2 TIP3W 466 25.242 -38.419 -46.173 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103071  
ATOM 1929e H1 TIP3W 466 24.602 -38.247 -46.852 1.00 0.00 WT7 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19300  
Duplicate atom serial number found: 19301  
Duplicate atom serial number found: 19302  
Duplicate atom serial number found: 19303  
Duplicate atom serial number found: 19304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103179  
ATOM 1930a H1 TIP3W 573 20.183 -20.201 -33.489 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103180  
ATOM 1930b H2 TIP3W 573 21.014 -19.956 -34.792 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103181  
ATOM 1930c OH2 TIP3W 575 18.764 -38.429 -52.376 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103182  
ATOM 1930d H1 TIP3W 575 18.542 -38.247 -51.447 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103183  
ATOM 1930e H2 TIP3W 575 19.366 -39.209 -52.383 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19310  
Duplicate atom serial number found: 19311  
Duplicate atom serial number found: 19312  
Duplicate atom serial number found: 19313  
Duplicate atom serial number found: 19314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103195  
ATOM 1931a H2 TIP3W 588 32.062 -9.282 -53.585 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103196  
ATOM 1931b OH2 TIP3W 591 18.503 -20.668 -47.674 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103197  
ATOM 1931c H1 TIP3W 591 17.977 -20.486 -46.885 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103198  
ATOM 1931d H2 TIP3W 591 17.915 -21.263 -48.189 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103199  
ATOM 1931e OH2 TIP3W 592 29.640 -24.506 -41.908 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19320  
Duplicate atom serial number found: 19321  
Duplicate atom serial number found: 19322  
Duplicate atom serial number found: 19323  
Duplicate atom serial number found: 19324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103211  
ATOM 1932a OH2 TIP3W 611 25.759 -10.587 -36.977 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103212  
ATOM 1932b H1 TIP3W 611 25.711 -11.275 -36.291 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103213  
ATOM 1932c H2 TIP3W 611 26.524 -10.886 -37.489 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103214  
ATOM 1932d OH2 TIP3W 612 32.612 -26.597 -51.218 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103215  
ATOM 1932e H1 TIP3W 612 32.783 -26.119 -50.378 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19330  
Duplicate atom serial number found: 19331  
Duplicate atom serial number found: 19332  
Duplicate atom serial number found: 19333  
Duplicate atom serial number found: 19334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103227  
ATOM 1933a H1 TIP3W 632 25.427 -25.063 -47.297 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103228  
ATOM 1933b H2 TIP3W 632 23.936 -24.883 -47.688 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103229  
ATOM 1933c OH2 TIP3W 634 27.349 -34.250 -49.282 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103230  
ATOM 1933d H1 TIP3W 634 26.469 -34.459 -49.592 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103231  
ATOM 1933e H2 TIP3W 634 27.821 -35.121 -49.283 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19340  
Duplicate atom serial number found: 19341  
Duplicate atom serial number found: 19342  
Duplicate atom serial number found: 19343  
Duplicate atom serial number found: 19344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103243  
ATOM 1934a H2 TIP3W 639 17.905 -23.773 -27.874 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103244  
ATOM 1934b OH2 TIP3W 640 39.750 -27.381 -36.931 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103245  
ATOM 1934c H1 TIP3W 640 39.556 -26.484 -36.544 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103246  
ATOM 1934d H2 TIP3W 640 39.083 -28.015 -36.550 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103247  
ATOM 1934e OH2 TIP3W 653 21.976 -7.916 -44.034 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19350  
Duplicate atom serial number found: 19351  
Duplicate atom serial number found: 19352  
Duplicate atom serial number found: 19353  
Duplicate atom serial number found: 19354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103259  
ATOM 1935a OH2 TIP3W 675 23.411 -8.331 -49.851 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103260  
ATOM 1935b H1 TIP3W 675 23.327 -8.114 -48.919 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103261  
ATOM 1935c H2 TIP3W 675 22.662 -7.840 -50.276 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103262  
ATOM 1935d OH2 TIP3W 676 38.375 -16.855 -42.880 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103263  
ATOM 1935e H1 TIP3W 676 38.448 -16.243 -42.174 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19360  
Duplicate atom serial number found: 19361  
Duplicate atom serial number found: 19362  
Duplicate atom serial number found: 19363  
Duplicate atom serial number found: 19364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103275  
ATOM 1936a H1 TIP3W 699 27.311 -15.371 -35.834 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103276  
ATOM 1936b H2 TIP3W 699 27.295 -15.279 -34.241 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103277  
ATOM 1936c OH2 TIP3W 701 23.219 -11.884 -32.348 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103278  
ATOM 1936d H1 TIP3W 701 23.323 -12.862 -32.173 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103279  
ATOM 1936e H2 TIP3W 701 22.649 -11.831 -33.092 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19370  
Duplicate atom serial number found: 19371  
Duplicate atom serial number found: 19372  
Duplicate atom serial number found: 19373  
Duplicate atom serial number found: 19374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103291  
ATOM 1937a H2 TIP3W 736 23.933 -4.581 -51.541 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103292  
ATOM 1937b OH2 TIP3W 738 20.482 -15.240 -49.358 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103293  
ATOM 1937c H1 TIP3W 738 20.103 -14.692 -48.637 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103294  
ATOM 1937d H2 TIP3W 738 19.713 -15.747 -49.618 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103295  
ATOM 1937e OH2 TIP3W 740 24.889 1.366 -45.869 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19380  
Duplicate atom serial number found: 19381  
Duplicate atom serial number found: 19382  
Duplicate atom serial number found: 19383  
Duplicate atom serial number found: 19384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103307  
ATOM 1938a OH2 TIP3W 757 33.710 5.467 -38.940 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103308  
ATOM 1938b H1 TIP3W 757 33.676 4.610 -39.352 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103309  
ATOM 1938c H2 TIP3W 757 34.021 5.303 -38.000 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103310  
ATOM 1938d OH2 TIP3W 759 23.023 -11.932 -41.343 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103311  
ATOM 1938e H1 TIP3W 759 23.267 -12.330 -40.550 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19390  
Duplicate atom serial number found: 19391  
Duplicate atom serial number found: 19392  
Duplicate atom serial number found: 19393  
Duplicate atom serial number found: 19394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103323  
ATOM 1939a H1 TIP3W 778 17.181 -9.401 -47.280 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103324  
ATOM 1939b H2 TIP3W 778 18.356 -10.036 -46.458 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103325  
ATOM 1939c OH2 TIP3W 779 16.899 -12.706 -36.100 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103326  
ATOM 1939d H1 TIP3W 779 16.161 -12.094 -36.273 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103327  
ATOM 1939e H2 TIP3W 779 17.266 -12.870 -37.005 1.00 0.00 WT7 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19400  
Duplicate atom serial number found: 19401  
Duplicate atom serial number found: 19402  
Duplicate atom serial number found: 19403  
Duplicate atom serial number found: 19404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103435  
ATOM 1940a H2 TIP3W 912 37.906 -46.172 -34.439 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103436  
ATOM 1940b OH2 TIP3W 913 27.760 11.732 -35.133 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103437  
ATOM 1940c H1 TIP3W 913 27.099 12.289 -35.542 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103438  
ATOM 1940d H2 TIP3W 913 27.295 11.115 -34.569 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103439  
ATOM 1940e OH2 TIP3W 915 33.051 3.340 -32.844 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19410  
Duplicate atom serial number found: 19411  
Duplicate atom serial number found: 19412  
Duplicate atom serial number found: 19413  
Duplicate atom serial number found: 19414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103451  
ATOM 1941a OH2 TIP3W 927 27.597 -39.390 -47.072 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103452  
ATOM 1941b H1 TIP3W 927 26.863 -38.828 -46.947 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103453  
ATOM 1941c H2 TIP3W 927 27.286 -40.212 -46.702 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103454  
ATOM 1941d OH2 TIP3W 928 18.258 -45.794 -39.602 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103455  
ATOM 1941e H1 TIP3W 928 18.621 -44.919 -39.455 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19420  
Duplicate atom serial number found: 19421  
Duplicate atom serial number found: 19422  
Duplicate atom serial number found: 19423  
Duplicate atom serial number found: 19424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103467  
ATOM 1942a H1 TIP3W 933 20.817 -38.984 -32.346 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103468  
ATOM 1942b H2 TIP3W 933 19.867 -38.811 -33.505 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103469  
ATOM 1942c OH2 TIP3W 936 19.344 -44.857 -28.041 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103470  
ATOM 1942d H1 TIP3W 936 19.977 -44.454 -28.624 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103471  
ATOM 1942e H2 TIP3W 936 19.085 -44.170 -27.408 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19430  
Duplicate atom serial number found: 19431  
Duplicate atom serial number found: 19432  
Duplicate atom serial number found: 19433  
Duplicate atom serial number found: 19434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103483  
ATOM 1943a H2 TIP3W 949 21.577 -43.832 -30.856 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103484  
ATOM 1943b OH2 TIP3W 950 32.741 -29.505 -39.130 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103485  
ATOM 1943c H1 TIP3W 950 33.380 -29.841 -39.808 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103486  
ATOM 1943d H2 TIP3W 950 33.273 -28.868 -38.612 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103487  
ATOM 1943e OH2 TIP3W 951 26.714 -34.934 -40.680 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19440  
Duplicate atom serial number found: 19441  
Duplicate atom serial number found: 19442  
Duplicate atom serial number found: 19443  
Duplicate atom serial number found: 19444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103499  
ATOM 1944a OH2 TIP3W 968 25.844 16.089 -44.098 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103500  
ATOM 1944b H1 TIP3W 968 25.809 15.267 -43.565 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103501  
ATOM 1944c H2 TIP3W 968 26.489 16.583 -43.619 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103502  
ATOM 1944d OH2 TIP3W 970 30.083 -22.568 -48.471 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103503  
ATOM 1944e H1 TIP3W 970 30.270 -22.739 -47.518 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19450  
Duplicate atom serial number found: 19451  
Duplicate atom serial number found: 19452  
Duplicate atom serial number found: 19453  
Duplicate atom serial number found: 19454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103515  
ATOM 1945a H1 TIP3W 985 47.410 -19.578 -52.981 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103516  
ATOM 1945b H2 TIP3W 985 47.935 -20.957 -52.516 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103517  
ATOM 1945c OH2 TIP3W 988 30.331 -22.538 -52.714 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103518  
ATOM 1945d H1 TIP3W 988 30.087 -21.612 -52.461 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103519  
ATOM 1945e H2 TIP3W 988 29.907 -23.084 -52.000 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19460  
Duplicate atom serial number found: 19461  
Duplicate atom serial number found: 19462  
Duplicate atom serial number found: 19463  
Duplicate atom serial number found: 19464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103531  
ATOM 1946a H2 TIP3W 992 38.188 -45.408 -40.251 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103532  
ATOM 1946b OH2 TIP3W 995 23.219 -32.341 -37.816 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103533  
ATOM 1946c H1 TIP3W 995 23.563 -32.351 -38.673 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103534  
ATOM 1946d H2 TIP3W 995 23.529 -31.498 -37.432 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103535  
ATOM 1946e OH2 TIP3W 996 22.199 -31.484 -30.976 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19470  
Duplicate atom serial number found: 19471  
Duplicate atom serial number found: 19472  
Duplicate atom serial number found: 19473  
Duplicate atom serial number found: 19474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103547  
ATOM 1947a OH2 TIP3W1013 18.035 -31.645 -40.645 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103548  
ATOM 1947b H1 TIP3W1013 17.644 -32.520 -40.580 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103549  
ATOM 1947c H2 TIP3W1013 17.279 -31.016 -40.949 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103550  
ATOM 1947d OH2 TIP3W1014 27.506 -33.213 -34.850 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103551  
ATOM 1947e H1 TIP3W1014 27.641 -34.123 -35.302 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19480  
Duplicate atom serial number found: 19481  
Duplicate atom serial number found: 19482  
Duplicate atom serial number found: 19483  
Duplicate atom serial number found: 19484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103563  
ATOM 1948a H1 TIP3W1020 28.699 -36.730 -22.851 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103564  
ATOM 1948b H2 TIP3W1020 27.805 -37.646 -23.514 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103565  
ATOM 1948c OH2 TIP3W1027 31.578 -33.782 -53.547 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103566  
ATOM 1948d H1 TIP3W1027 31.705 -32.877 -53.840 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103567  
ATOM 1948e H2 TIP3W1027 30.594 -33.781 -53.413 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19490  
Duplicate atom serial number found: 19491  
Duplicate atom serial number found: 19492  
Duplicate atom serial number found: 19493  
Duplicate atom serial number found: 19494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103579  
ATOM 1949a H2 TIP3W1053 27.236 -25.734 -34.905 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103580  
ATOM 1949b OH2 TIP3W1054 37.452 -21.040 -37.407 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103581  
ATOM 1949c H1 TIP3W1054 37.452 -20.044 -37.379 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103582  
ATOM 1949d H2 TIP3W1054 38.344 -21.223 -37.825 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103583  
ATOM 1949e OH2 TIP3W1055 24.877 -17.989 -54.140 1.00 0.00 WT7 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19500  
Duplicate atom serial number found: 19501  
Duplicate atom serial number found: 19502  
Duplicate atom serial number found: 19503  
Duplicate atom serial number found: 19504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103691  
ATOM 1950a OH2 TIP3W1197 28.312 -15.494 -44.559 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103692  
ATOM 1950b H1 TIP3W1197 27.518 -15.373 -44.090 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103693  
ATOM 1950c H2 TIP3W1197 28.772 -14.631 -44.549 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103694  
ATOM 1950d OH2 TIP3W1200 23.056 -10.492 -45.693 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103695  
ATOM 1950e H1 TIP3W1200 22.385 -10.817 -46.177 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19510  
Duplicate atom serial number found: 19511  
Duplicate atom serial number found: 19512  
Duplicate atom serial number found: 19513  
Duplicate atom serial number found: 19514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103707  
ATOM 1951a H1 TIP3W1208 37.358 -4.170 -36.726 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103708  
ATOM 1951b H2 TIP3W1208 37.606 -3.571 -35.318 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103709  
ATOM 1951c OH2 TIP3W1219 25.435 7.785 -44.154 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103710  
ATOM 1951d H1 TIP3W1219 24.713 7.799 -43.479 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103711  
ATOM 1951e H2 TIP3W1219 26.059 8.455 -43.840 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19520  
Duplicate atom serial number found: 19521  
Duplicate atom serial number found: 19522  
Duplicate atom serial number found: 19523  
Duplicate atom serial number found: 19524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103723  
ATOM 1952a H2 TIP3W1224 33.444 -3.086 -42.362 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103724  
ATOM 1952b OH2 TIP3W1225 24.907 11.274 -36.232 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103725  
ATOM 1952c H1 TIP3W1225 24.705 10.654 -36.894 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103726  
ATOM 1952d H2 TIP3W1225 24.676 10.819 -35.339 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103727  
ATOM 1952e OH2 TIP3W1226 26.983 9.782 -41.075 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19530  
Duplicate atom serial number found: 19531  
Duplicate atom serial number found: 19532  
Duplicate atom serial number found: 19533  
Duplicate atom serial number found: 19534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103739  
ATOM 1953a OH2 TIP3W1247 22.661 14.181 -36.046 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103740  
ATOM 1953b H1 TIP3W1247 23.322 14.894 -36.221 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103741  
ATOM 1953c H2 TIP3W1247 21.741 14.626 -36.087 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103742  
ATOM 1953d OH2 TIP3W1248 22.353 -1.638 -32.101 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103743  
ATOM 1953e H1 TIP3W1248 21.691 -1.282 -31.618 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19540  
Duplicate atom serial number found: 19541  
Duplicate atom serial number found: 19542  
Duplicate atom serial number found: 19543  
Duplicate atom serial number found: 19544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103755  
ATOM 1954a H1 TIP3W1266 23.253 8.271 -36.559 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103756  
ATOM 1954b H2 TIP3W1266 23.861 8.778 -37.832 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103757  
ATOM 1954c OH2 TIP3W1267 27.848 -2.133 -50.270 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103758  
ATOM 1954d H1 TIP3W1267 28.309 -2.317 -49.437 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103759  
ATOM 1954e H2 TIP3W1267 28.483 -2.362 -50.942 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19550  
Duplicate atom serial number found: 19551  
Duplicate atom serial number found: 19552  
Duplicate atom serial number found: 19553  
Duplicate atom serial number found: 19554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103771  
ATOM 1955a H2 TIP3W1284 28.333 6.697 -53.310 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103772  
ATOM 1955b OH2 TIP3W1285 20.944 7.702 -49.981 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103773  
ATOM 1955c H1 TIP3W1285 20.920 7.666 -50.971 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103774  
ATOM 1955d H2 TIP3W1285 21.008 8.678 -49.842 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103775  
ATOM 1955e OH2 TIP3W1289 37.574 7.724 -26.677 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19560  
Duplicate atom serial number found: 19561  
Duplicate atom serial number found: 19562  
Duplicate atom serial number found: 19563  
Duplicate atom serial number found: 19564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103787  
ATOM 1956a OH2 TIP3W1307 32.516 -40.595 -44.372 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103788  
ATOM 1956b H1 TIP3W1307 32.505 -39.610 -44.285 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103789  
ATOM 1956c H2 TIP3W1307 32.496 -40.652 -45.379 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103790  
ATOM 1956d OH2 TIP3W1308 24.797 -26.164 -40.926 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103791  
ATOM 1956e H1 TIP3W1308 25.546 -25.915 -41.522 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19570  
Duplicate atom serial number found: 19571  
Duplicate atom serial number found: 19572  
Duplicate atom serial number found: 19573  
Duplicate atom serial number found: 19574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103803  
ATOM 1957a H1 TIP3W1328 21.879 -46.298 -46.877 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103804  
ATOM 1957b H2 TIP3W1328 20.853 -47.384 -46.637 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103805  
ATOM 1957c OH2 TIP3W1329 36.448 -41.920 -45.978 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103806  
ATOM 1957d H1 TIP3W1329 37.094 -41.285 -45.918 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103807  
ATOM 1957e H2 TIP3W1329 35.805 -41.427 -46.473 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19580  
Duplicate atom serial number found: 19581  
Duplicate atom serial number found: 19582  
Duplicate atom serial number found: 19583  
Duplicate atom serial number found: 19584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103819  
ATOM 1958a H2 TIP3W1344 25.777 -26.992 -49.923 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103820  
ATOM 1958b OH2 TIP3W1345 21.337 15.800 -52.840 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103821  
ATOM 1958c H1 TIP3W1345 21.698 14.882 -52.705 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103822  
ATOM 1958d H2 TIP3W1345 20.625 15.604 -53.446 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103823  
ATOM 1958e OH2 TIP3W1346 35.819 -36.636 -53.020 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19590  
Duplicate atom serial number found: 19591  
Duplicate atom serial number found: 19592  
Duplicate atom serial number found: 19593  
Duplicate atom serial number found: 19594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103835  
ATOM 1959a OH2 TIP3W1353 39.482 13.008 -36.967 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103836  
ATOM 1959b H1 TIP3W1353 39.021 13.481 -36.297 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103837  
ATOM 1959c H2 TIP3W1353 38.980 13.096 -37.795 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103838  
ATOM 1959d OH2 TIP3W1354 16.601 -25.597 -33.639 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103839  
ATOM 1959e H1 TIP3W1354 16.720 -25.415 -32.654 1.00 0.00 WT7 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19600  
Duplicate atom serial number found: 19601  
Duplicate atom serial number found: 19602  
Duplicate atom serial number found: 19603  
Duplicate atom serial number found: 19604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103947  
ATOM 1960a H1 TIP3W1451 19.081 -26.666 -50.752 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103948  
ATOM 1960b H2 TIP3W1451 20.525 -26.590 -51.219 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103949  
ATOM 1960c OH2 TIP3W1453 34.325 -20.857 -48.552 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103950  
ATOM 1960d H1 TIP3W1453 33.593 -20.494 -49.038 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103951  
ATOM 1960e H2 TIP3W1453 33.894 -21.528 -48.020 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19610  
Duplicate atom serial number found: 19611  
Duplicate atom serial number found: 19612  
Duplicate atom serial number found: 19613  
Duplicate atom serial number found: 19614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103963  
ATOM 1961a H2 TIP3W1459 21.431 -18.086 -32.821 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103964  
ATOM 1961b OH2 TIP3W1466 20.302 -15.883 -53.731 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103965  
ATOM 1961c H1 TIP3W1466 20.717 -15.080 -53.369 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103966  
ATOM 1961d H2 TIP3W1466 21.050 -16.524 -53.741 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103967  
ATOM 1961e OH2 TIP3W1471 38.312 -39.510 -52.046 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19620  
Duplicate atom serial number found: 19621  
Duplicate atom serial number found: 19622  
Duplicate atom serial number found: 19623  
Duplicate atom serial number found: 19624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103979  
ATOM 1962a OH2 TIP3W1478 32.497 -20.781 -38.537 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103980  
ATOM 1962b H1 TIP3W1478 31.690 -20.394 -38.810 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103981  
ATOM 1962c H2 TIP3W1478 32.907 -20.893 -39.419 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103982  
ATOM 1962d OH2 TIP3W1480 18.260 -20.444 -35.519 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103983  
ATOM 1962e H1 TIP3W1480 19.005 -20.848 -35.929 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19630  
Duplicate atom serial number found: 19631  
Duplicate atom serial number found: 19632  
Duplicate atom serial number found: 19633  
Duplicate atom serial number found: 19634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 103995  
ATOM 1963a H1 TIP3W1497 22.526 -37.250 -48.200 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103996  
ATOM 1963b H2 TIP3W1497 22.899 -38.613 -48.647 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103997  
ATOM 1963c OH2 TIP3W1512 26.728 -27.500 -43.519 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 103998  
ATOM 1963d H1 TIP3W1512 27.434 -28.072 -43.815 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 103999  
ATOM 1963e H2 TIP3W1512 26.015 -28.039 -43.817 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19640  
Duplicate atom serial number found: 19641  
Duplicate atom serial number found: 19642  
Duplicate atom serial number found: 19643  
Duplicate atom serial number found: 19644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104011  
ATOM 1964a H2 TIP3W1531 29.378 -12.433 -45.595 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104012  
ATOM 1964b OH2 TIP3W1532 29.655 -26.057 -39.367 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104013  
ATOM 1964c H1 TIP3W1532 29.032 -26.475 -38.806 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104014  
ATOM 1964d H2 TIP3W1532 30.447 -26.019 -38.820 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104015  
ATOM 1964e OH2 TIP3W1534 35.656 -16.181 -45.109 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19650  
Duplicate atom serial number found: 19651  
Duplicate atom serial number found: 19652  
Duplicate atom serial number found: 19653  
Duplicate atom serial number found: 19654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104027  
ATOM 1965a OH2 TIP3W1540 34.152 -14.615 -37.122 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104028  
ATOM 1965b H1 TIP3W1540 34.268 -13.631 -36.849 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104029  
ATOM 1965c H2 TIP3W1540 33.983 -15.070 -36.255 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104030  
ATOM 1965d OH2 TIP3W1552 22.420 -16.695 -47.945 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104031  
ATOM 1965e H1 TIP3W1552 21.843 -16.004 -48.267 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19660  
Duplicate atom serial number found: 19661  
Duplicate atom serial number found: 19662  
Duplicate atom serial number found: 19663  
Duplicate atom serial number found: 19664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104043  
ATOM 1966a H1 TIP3W1563 38.176 -0.435 -31.758 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104044  
ATOM 1966b H2 TIP3W1563 37.431 -0.541 -33.150 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104045  
ATOM 1966c OH2 TIP3W1573 16.531 -18.973 -50.846 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104046  
ATOM 1966d H1 TIP3W1573 16.183 -19.216 -51.753 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104047  
ATOM 1966e H2 TIP3W1573 17.181 -18.284 -51.098 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19670  
Duplicate atom serial number found: 19671  
Duplicate atom serial number found: 19672  
Duplicate atom serial number found: 19673  
Duplicate atom serial number found: 19674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104059  
ATOM 1967a H2 TIP3W1579 47.869 3.609 -42.114 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104060  
ATOM 1967b OH2 TIP3W1581 27.995 -7.072 -30.957 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104061  
ATOM 1967c H1 TIP3W1581 28.905 -6.844 -30.813 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104062  
ATOM 1967d H2 TIP3W1581 27.678 -6.269 -31.445 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104063  
ATOM 1967e OH2 TIP3W1582 33.471 -13.221 -39.414 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19680  
Duplicate atom serial number found: 19681  
Duplicate atom serial number found: 19682  
Duplicate atom serial number found: 19683  
Duplicate atom serial number found: 19684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104075  
ATOM 1968a OH2 TIP3W1599 20.476 -4.535 -42.504 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104076  
ATOM 1968b H1 TIP3W1599 20.836 -4.084 -41.774 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104077  
ATOM 1968c H2 TIP3W1599 21.316 -4.647 -43.057 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104078  
ATOM 1968d OH2 TIP3W1600 19.509 -7.906 -32.420 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104079  
ATOM 1968e H1 TIP3W1600 19.676 -7.047 -32.880 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19690  
Duplicate atom serial number found: 19691  
Duplicate atom serial number found: 19692  
Duplicate atom serial number found: 19693  
Duplicate atom serial number found: 19694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104091  
ATOM 1969a H1 TIP3W1605 24.240 1.697 -49.348 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104092  
ATOM 1969b H2 TIP3W1605 25.499 0.899 -49.666 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104093  
ATOM 1969c OH2 TIP3W1616 27.672 -6.527 -51.420 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104094  
ATOM 1969d H1 TIP3W1616 26.925 -7.103 -51.694 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104095  
ATOM 1969e H2 TIP3W1616 27.609 -5.746 -51.951 1.00 0.00 WT7 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19700  
Duplicate atom serial number found: 19701  
Duplicate atom serial number found: 19702  
Duplicate atom serial number found: 19703  
Duplicate atom serial number found: 19704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104203  
ATOM 1970a H2 TIP3W1707 28.233 -47.104 -49.777 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104204  
ATOM 1970b OH2 TIP3W1708 50.060 2.057 -41.894 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104205  
ATOM 1970c H1 TIP3W1708 49.773 1.858 -42.820 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104206  
ATOM 1970d H2 TIP3W1708 50.859 2.622 -41.972 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104207  
ATOM 1970e OH2 TIP3W1723 25.616 -44.625 -39.036 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19710  
Duplicate atom serial number found: 19711  
Duplicate atom serial number found: 19712  
Duplicate atom serial number found: 19713  
Duplicate atom serial number found: 19714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104219  
ATOM 1971a OH2 TIP3W1730 27.937 -46.859 -40.165 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104220  
ATOM 1971b H1 TIP3W1730 27.775 -46.231 -40.899 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104221  
ATOM 1971c H2 TIP3W1730 28.765 -47.273 -40.417 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104222  
ATOM 1971d OH2 TIP3W1731 34.120 12.276 -35.145 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104223  
ATOM 1971e H1 TIP3W1731 33.468 11.692 -34.789 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19720  
Duplicate atom serial number found: 19721  
Duplicate atom serial number found: 19722  
Duplicate atom serial number found: 19723  
Duplicate atom serial number found: 19724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104235  
ATOM 1972a H1 TIP3W1746 26.765 -38.523 -37.093 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104236  
ATOM 1972b H2 TIP3W1746 28.083 -38.449 -36.362 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104237  
ATOM 1972c OH2 TIP3W1749 34.290 6.953 -35.488 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104238  
ATOM 1972d H1 TIP3W1749 34.579 6.054 -35.779 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104239  
ATOM 1972e H2 TIP3W1749 33.347 6.861 -35.702 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19730  
Duplicate atom serial number found: 19731  
Duplicate atom serial number found: 19732  
Duplicate atom serial number found: 19733  
Duplicate atom serial number found: 19734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104251  
ATOM 1973a H2 TIP3W1757 24.819 -38.189 -27.713 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104252  
ATOM 1973b OH2 TIP3W1764 21.560 -47.389 -54.501 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104253  
ATOM 1973c H1 TIP3W1764 21.116 -47.890 -53.766 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104254  
ATOM 1973d H2 TIP3W1764 22.450 -47.698 -54.414 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104255  
ATOM 1973e OH2 TIP3W1766 34.351 -34.628 -43.406 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19740  
Duplicate atom serial number found: 19741  
Duplicate atom serial number found: 19742  
Duplicate atom serial number found: 19743  
Duplicate atom serial number found: 19744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104267  
ATOM 1974a OH2 TIP3W1771 18.928 -45.495 -42.090 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104268  
ATOM 1974b H1 TIP3W1771 18.533 -44.862 -42.685 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104269  
ATOM 1974c H2 TIP3W1771 19.135 -46.288 -42.617 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104270  
ATOM 1974d OH2 TIP3W1773 30.774 -47.648 -40.996 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104271  
ATOM 1974e H1 TIP3W1773 31.114 -48.377 -40.435 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19750  
Duplicate atom serial number found: 19751  
Duplicate atom serial number found: 19752  
Duplicate atom serial number found: 19753  
Duplicate atom serial number found: 19754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104283  
ATOM 1975a H1 TIP3W1789 22.831 -42.373 -52.982 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104284  
ATOM 1975b H2 TIP3W1789 21.628 -43.044 -53.566 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104285  
ATOM 1975c OH2 TIP3W1790 34.482 -34.563 -38.088 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104286  
ATOM 1975d H1 TIP3W1790 35.159 -35.112 -37.627 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104287  
ATOM 1975e H2 TIP3W1790 33.604 -35.023 -38.042 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19760  
Duplicate atom serial number found: 19761  
Duplicate atom serial number found: 19762  
Duplicate atom serial number found: 19763  
Duplicate atom serial number found: 19764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104299  
ATOM 1976a H2 TIP3W1796 37.927 -44.790 -36.373 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104300  
ATOM 1976b OH2 TIP3W1810 47.087 -27.523 -53.568 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104301  
ATOM 1976c H1 TIP3W1810 47.020 -26.917 -52.781 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104302  
ATOM 1976d H2 TIP3W1810 46.147 -27.757 -53.726 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104303  
ATOM 1976e OH2 TIP3W1811 47.087 -43.998 -47.111 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19770  
Duplicate atom serial number found: 19771  
Duplicate atom serial number found: 19772  
Duplicate atom serial number found: 19773  
Duplicate atom serial number found: 19774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104315  
ATOM 1977a OH2 TIP3W1826 46.215 16.046 -53.696 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104316  
ATOM 1977b H1 TIP3W1826 46.090 16.692 -54.407 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104317  
ATOM 1977c H2 TIP3W1826 45.585 16.432 -53.033 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104318  
ATOM 1977d OH2 TIP3W1829 28.199 -35.491 -54.017 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104319  
ATOM 1977e H1 TIP3W1829 28.731 -35.578 -53.206 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19780  
Duplicate atom serial number found: 19781  
Duplicate atom serial number found: 19782  
Duplicate atom serial number found: 19783  
Duplicate atom serial number found: 19784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104331  
ATOM 1978a H1 TIP3W1835 28.115 -22.216 -37.445 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104332  
ATOM 1978b H2 TIP3W1835 28.266 -21.150 -36.482 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104333  
ATOM 1978c OH2 TIP3W1836 32.351 -38.860 -32.521 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104334  
ATOM 1978d H1 TIP3W1836 33.224 -39.049 -32.813 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104335  
ATOM 1978e H2 TIP3W1836 31.872 -38.573 -33.355 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19790  
Duplicate atom serial number found: 19791  
Duplicate atom serial number found: 19792  
Duplicate atom serial number found: 19793  
Duplicate atom serial number found: 19794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104347  
ATOM 1979a H2 TIP3W1849 17.519 -30.860 -50.933 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104348  
ATOM 1979b OH2 TIP3W1850 27.121 -24.178 -47.461 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104349  
ATOM 1979c H1 TIP3W1850 28.045 -24.492 -47.384 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104350  
ATOM 1979d H2 TIP3W1850 26.796 -24.282 -46.524 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104351  
ATOM 1979e OH2 TIP3W1851 37.266 -28.638 -50.259 1.00 0.00 WT7 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19800  
Duplicate atom serial number found: 19801  
Duplicate atom serial number found: 19802  
Duplicate atom serial number found: 19803  
Duplicate atom serial number found: 19804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104459  
ATOM 1980a OH2 TIP3W1950 32.152 -20.160 -50.046 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104460  
ATOM 1980b H1 TIP3W1950 31.212 -19.977 -50.188 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104461  
ATOM 1980c H2 TIP3W1950 32.325 -20.789 -50.757 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104462  
ATOM 1980d OH2 TIP3W1952 32.409 -29.249 -50.138 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104463  
ATOM 1980e H1 TIP3W1952 32.371 -28.368 -50.540 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19810  
Duplicate atom serial number found: 19811  
Duplicate atom serial number found: 19812  
Duplicate atom serial number found: 19813  
Duplicate atom serial number found: 19814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104475  
ATOM 1981a H1 TIP3W1957 30.477 -26.011 9.988 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104476  
ATOM 1981b H2 TIP3W1957 29.635 -26.237 11.192 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104477  
ATOM 1981c OH2 TIP3W1962 33.272 -19.079 -30.604 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104478  
ATOM 1981d H1 TIP3W1962 32.660 -18.701 -31.254 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104479  
ATOM 1981e H2 TIP3W1962 33.505 -18.410 -29.940 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19820  
Duplicate atom serial number found: 19821  
Duplicate atom serial number found: 19822  
Duplicate atom serial number found: 19823  
Duplicate atom serial number found: 19824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104491  
ATOM 1982a H2 TIP3W1979 36.955 -9.393 -40.161 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104492  
ATOM 1982b OH2 TIP3W1987 30.829 -29.672 -29.305 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104493  
ATOM 1982c H1 TIP3W1987 30.672 -29.940 -28.374 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104494  
ATOM 1982d H2 TIP3W1987 30.212 -30.191 -29.817 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104495  
ATOM 1982e OH2 TIP3W1993 39.111 -19.927 -48.850 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19830  
Duplicate atom serial number found: 19831  
Duplicate atom serial number found: 19832  
Duplicate atom serial number found: 19833  
Duplicate atom serial number found: 19834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104507  
ATOM 1983a OH2 TIP3W2001 49.603 -1.498 -37.715 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104508  
ATOM 1983b H1 TIP3W2001 49.547 -1.039 -38.505 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104509  
ATOM 1983c H2 TIP3W2001 48.674 -1.684 -37.534 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104510  
ATOM 1983d OH2 TIP3W2002 31.767 -18.830 -42.971 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104511  
ATOM 1983e H1 TIP3W2002 32.155 -19.352 -43.701 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19840  
Duplicate atom serial number found: 19841  
Duplicate atom serial number found: 19842  
Duplicate atom serial number found: 19843  
Duplicate atom serial number found: 19844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104523  
ATOM 1984a H1 TIP3W2018 30.682 -9.672 -45.337 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104524  
ATOM 1984b H2 TIP3W2018 29.777 -9.085 -44.274 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104525  
ATOM 1984c OH2 TIP3W2019 37.740 -6.711 -34.169 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104526  
ATOM 1984d H1 TIP3W2019 38.482 -6.167 -33.948 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104527  
ATOM 1984e H2 TIP3W2019 38.013 -6.876 -35.103 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19850  
Duplicate atom serial number found: 19851  
Duplicate atom serial number found: 19852  
Duplicate atom serial number found: 19853  
Duplicate atom serial number found: 19854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104539  
ATOM 1985a H2 TIP3W2025 19.787 -15.304 -30.797 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104540  
ATOM 1985b OH2 TIP3W2037 28.949 -11.325 -47.217 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104541  
ATOM 1985c H1 TIP3W2037 29.662 -10.637 -47.110 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104542  
ATOM 1985d H2 TIP3W2037 28.095 -10.720 -47.242 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104543  
ATOM 1985e OH2 TIP3W2039 38.921 -10.194 -54.404 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19860  
Duplicate atom serial number found: 19861  
Duplicate atom serial number found: 19862  
Duplicate atom serial number found: 19863  
Duplicate atom serial number found: 19864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104555  
ATOM 1986a OH2 TIP3W2046 34.497 4.395 -36.085 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104556  
ATOM 1986b H1 TIP3W2046 33.943 3.711 -36.492 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104557  
ATOM 1986c H2 TIP3W2046 35.221 3.904 -35.706 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104558  
ATOM 1986d OH2 TIP3W2059 48.194 16.300 -47.509 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104559  
ATOM 1986e H1 TIP3W2059 48.254 15.414 -47.310 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19870  
Duplicate atom serial number found: 19871  
Duplicate atom serial number found: 19872  
Duplicate atom serial number found: 19873  
Duplicate atom serial number found: 19874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104571  
ATOM 1987a H1 TIP3W2063 22.349 -1.309 -45.865 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104572  
ATOM 1987b H2 TIP3W2063 21.220 -2.392 -45.789 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104573  
ATOM 1987c OH2 TIP3W2064 25.705 12.769 -42.178 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104574  
ATOM 1987d H1 TIP3W2064 26.450 12.714 -41.582 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104575  
ATOM 1987e H2 TIP3W2064 25.052 12.620 -41.468 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19880  
Duplicate atom serial number found: 19881  
Duplicate atom serial number found: 19882  
Duplicate atom serial number found: 19883  
Duplicate atom serial number found: 19884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104587  
ATOM 1988a H2 TIP3W2082 38.078 -9.913 -51.835 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104588  
ATOM 1988b OH2 TIP3W2083 17.941 -11.429 -39.668 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104589  
ATOM 1988c H1 TIP3W2083 18.662 -11.514 -40.349 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104590  
ATOM 1988d H2 TIP3W2083 18.359 -10.819 -38.995 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104591  
ATOM 1988e OH2 TIP3W2084 25.781 -8.044 -52.768 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19890  
Duplicate atom serial number found: 19891  
Duplicate atom serial number found: 19892  
Duplicate atom serial number found: 19893  
Duplicate atom serial number found: 19894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104603  
ATOM 1989a OH2 TIP3W2102 33.514 2.177 -37.329 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104604  
ATOM 1989b H1 TIP3W2102 34.269 1.890 -37.876 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104605  
ATOM 1989c H2 TIP3W2102 33.619 1.663 -36.471 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104606  
ATOM 1989d OH2 TIP3W2103 23.380 -9.435 -40.381 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104607  
ATOM 1989e H1 TIP3W2103 22.575 -9.185 -40.060 1.00 0.00 WT7 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 19900  
Duplicate atom serial number found: 19901  
Duplicate atom serial number found: 19902  
Duplicate atom serial number found: 19903  
Duplicate atom serial number found: 19904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104715  
ATOM 1990a H1 TIP3W2207 29.397 11.911 -49.196 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104716  
ATOM 1990b H2 TIP3W2207 29.638 12.657 -47.900 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104717  
ATOM 1990c OH2 TIP3W2208 48.695 -32.562 -44.308 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104718  
ATOM 1990d H1 TIP3W2208 49.365 -33.242 -44.368 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104719  
ATOM 1990e H2 TIP3W2208 48.623 -32.287 -45.258 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19910  
Duplicate atom serial number found: 19911  
Duplicate atom serial number found: 19912  
Duplicate atom serial number found: 19913  
Duplicate atom serial number found: 19914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104731  
ATOM 1991a H2 TIP3W2228 41.026 6.699 -45.876 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104732  
ATOM 1991b OH2 TIP3W2229 37.333 -30.712 -45.772 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104733  
ATOM 1991c H1 TIP3W2229 38.139 -30.532 -45.181 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104734  
ATOM 1991d H2 TIP3W2229 37.479 -30.125 -46.484 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104735  
ATOM 1991e OH2 TIP3W2230 48.870 15.904 -38.001 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19920  
Duplicate atom serial number found: 19921  
Duplicate atom serial number found: 19922  
Duplicate atom serial number found: 19923  
Duplicate atom serial number found: 19924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104747  
ATOM 1992a OH2 TIP3W2244 30.287 -44.376 -51.046 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104748  
ATOM 1992b H1 TIP3W2244 30.487 -44.359 -50.096 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104749  
ATOM 1992c H2 TIP3W2244 30.542 -43.506 -51.352 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104750  
ATOM 1992d OH2 TIP3W2250 33.841 -45.600 -50.798 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104751  
ATOM 1992e H1 TIP3W2250 34.615 -45.566 -51.402 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19930  
Duplicate atom serial number found: 19931  
Duplicate atom serial number found: 19932  
Duplicate atom serial number found: 19933  
Duplicate atom serial number found: 19934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104763  
ATOM 1993a H1 TIP3W2254 32.879 -40.477 -39.957 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104764  
ATOM 1993b H2 TIP3W2254 34.056 -41.231 -40.612 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104765  
ATOM 1993c OH2 TIP3W2255 38.449 15.612 -43.146 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104766  
ATOM 1993d H1 TIP3W2255 38.347 16.163 -43.899 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104767  
ATOM 1993e H2 TIP3W2255 37.701 15.921 -42.581 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19940  
Duplicate atom serial number found: 19941  
Duplicate atom serial number found: 19942  
Duplicate atom serial number found: 19943  
Duplicate atom serial number found: 19944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104779  
ATOM 1994a H2 TIP3W2271 39.903 -37.658 -44.848 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104780  
ATOM 1994b OH2 TIP3W2272 29.342 -46.089 -37.588 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104781  
ATOM 1994c H1 TIP3W2272 28.840 -46.569 -36.911 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104782  
ATOM 1994d H2 TIP3W2272 28.659 -46.004 -38.299 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104783  
ATOM 1994e OH2 TIP3W2273 45.992 -24.091 -36.184 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19950  
Duplicate atom serial number found: 19951  
Duplicate atom serial number found: 19952  
Duplicate atom serial number found: 19953  
Duplicate atom serial number found: 19954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104795  
ATOM 1995a OH2 TIP3W2280 23.031 -45.604 -37.958 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104796  
ATOM 1995b H1 TIP3W2280 22.558 -46.013 -37.170 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104797  
ATOM 1995c H2 TIP3W2280 22.668 -46.117 -38.694 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104798  
ATOM 1995d OH2 TIP3W2288 20.047 -33.547 -45.316 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104799  
ATOM 1995e H1 TIP3W2288 20.024 -32.632 -45.635 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19960  
Duplicate atom serial number found: 19961  
Duplicate atom serial number found: 19962  
Duplicate atom serial number found: 19963  
Duplicate atom serial number found: 19964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104811  
ATOM 1996a H1 TIP3W2294 45.559 -26.746 -38.841 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104812  
ATOM 1996b H2 TIP3W2294 46.857 -26.088 -39.208 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104813  
ATOM 1996c OH2 TIP3W2295 25.135 -48.181 -33.429 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104814  
ATOM 1996d H1 TIP3W2295 24.779 -48.601 -32.540 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104815  
ATOM 1996e H2 TIP3W2295 26.042 -47.954 -33.310 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19970  
Duplicate atom serial number found: 19971  
Duplicate atom serial number found: 19972  
Duplicate atom serial number found: 19973  
Duplicate atom serial number found: 19974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104827  
ATOM 1997a H2 TIP3W2313 44.545 -41.349 -42.860 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104828  
ATOM 1997b OH2 TIP3W2315 35.671 -24.969 -39.981 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104829  
ATOM 1997c H1 TIP3W2315 35.836 -24.782 -39.033 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104830  
ATOM 1997d H2 TIP3W2315 36.540 -25.060 -40.437 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104831  
ATOM 1997e OH2 TIP3W2316 28.692 -43.576 -44.596 1.00 0.00 WT7 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19980  
Duplicate atom serial number found: 19981  
Duplicate atom serial number found: 19982  
Duplicate atom serial number found: 19983  
Duplicate atom serial number found: 19984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104843  
ATOM 1998a OH2 TIP3W2320 34.559 -23.452 -32.342 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104844  
ATOM 1998b H1 TIP3W2320 33.953 -22.767 -32.471 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104845  
ATOM 1998c H2 TIP3W2320 34.511 -23.851 -33.221 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104846  
ATOM 1998d OH2 TIP3W2329 41.994 -32.241 -53.058 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104847  
ATOM 1998e H1 TIP3W2329 41.864 -32.693 -52.180 1.00 0.00 WT7 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 19990  
Duplicate atom serial number found: 19991  
Duplicate atom serial number found: 19992  
Duplicate atom serial number found: 19993  
Duplicate atom serial number found: 19994  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 104859  
ATOM 1999a H1 TIP3W2335 24.052 -33.681 -40.258 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104860  
ATOM 1999b H2 TIP3W2335 24.122 -34.697 -39.067 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104861  
ATOM 1999c OH2 TIP3W2336 40.007 -15.508 -49.424 1.00 0.00 WT7 O  
  
Ignored bad PDB record found on line 104862  
ATOM 1999d H1 TIP3W2336 39.369 -15.774 -50.085 1.00 0.00 WT7 H  
  
Ignored bad PDB record found on line 104863  
ATOM 1999e H2 TIP3W2336 39.880 -14.519 -49.329 1.00 0.00 WT7 H  
  
26209 messages similar to the above omitted  
Duplicate atom serial number found: 20000  
Duplicate atom serial number found: 20001  
Duplicate atom serial number found: 20002  
Duplicate atom serial number found: 20003  
Duplicate atom serial number found: 20004  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131083  
ATOM 2000a H2 TIP3W5985 49.495 46.986 59.951 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131084  
ATOM 2000b OH2 TIP3W6138 49.192 18.678 23.057 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131085  
ATOM 2000c H1 TIP3W6138 49.213 17.886 23.628 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131086  
ATOM 2000d H2 TIP3W6138 48.524 18.433 22.411 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131087  
ATOM 2000e OH2 TIP3W6158 40.285 18.247 15.084 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20010  
Duplicate atom serial number found: 20011  
Duplicate atom serial number found: 20012  
Duplicate atom serial number found: 20013  
Duplicate atom serial number found: 20014  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131099  
ATOM 2001a OH2 TIP3W6220 49.047 36.451 21.376 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131100  
ATOM 2001b H1 TIP3W6220 48.352 36.403 20.654 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131101  
ATOM 2001c H2 TIP3W6220 48.936 35.599 21.883 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131102  
ATOM 2001d OH2 TIP3W6228 48.347 23.323 51.689 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131103  
ATOM 2001e H1 TIP3W6228 49.032 23.233 52.391 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20020  
Duplicate atom serial number found: 20021  
Duplicate atom serial number found: 20022  
Duplicate atom serial number found: 20023  
Duplicate atom serial number found: 20024  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131115  
ATOM 2002a H1 TIP3W6266 50.885 27.098 34.670 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131116  
ATOM 2002b H2 TIP3W6266 50.607 26.059 33.564 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131117  
ATOM 2002c OH2 TIP3W6279 51.000 43.518 71.145 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131118  
ATOM 2002d H1 TIP3W6279 50.364 44.128 71.480 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131119  
ATOM 2002e H2 TIP3W6279 50.491 42.989 70.464 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20030  
Duplicate atom serial number found: 20031  
Duplicate atom serial number found: 20032  
Duplicate atom serial number found: 20033  
Duplicate atom serial number found: 20034  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131131  
ATOM 2003a H2 TIP3W6315 50.712 23.148 49.396 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131132  
ATOM 2003b OH2 TIP3W6325 43.915 37.153 26.478 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131133  
ATOM 2003c H1 TIP3W6325 44.037 37.503 27.353 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131134  
ATOM 2003d H2 TIP3W6325 42.965 37.186 26.391 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131135  
ATOM 2003e OH2 TIP3W6346 50.160 35.128 75.116 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20040  
Duplicate atom serial number found: 20041  
Duplicate atom serial number found: 20042  
Duplicate atom serial number found: 20043  
Duplicate atom serial number found: 20044  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131147  
ATOM 2004a OH2 TIP3W6468 50.464 48.437 74.422 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131148  
ATOM 2004b H1 TIP3W6468 49.536 48.736 74.354 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131149  
ATOM 2004c H2 TIP3W6468 50.643 48.655 75.316 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131150  
ATOM 2004d OH2 TIP3W6492 46.620 44.815 24.671 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131151  
ATOM 2004e H1 TIP3W6492 46.210 45.625 25.061 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20050  
Duplicate atom serial number found: 20051  
Duplicate atom serial number found: 20052  
Duplicate atom serial number found: 20053  
Duplicate atom serial number found: 20054  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131163  
ATOM 2005a H1 TIP3W6650 21.473 21.613 55.058 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131164  
ATOM 2005b H2 TIP3W6650 20.583 21.055 53.952 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131165  
ATOM 2005c OH2 TIP3W6671 17.316 29.233 31.360 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131166  
ATOM 2005d H1 TIP3W6671 17.654 29.997 31.908 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131167  
ATOM 2005e H2 TIP3W6671 17.530 28.503 31.862 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20060  
Duplicate atom serial number found: 20061  
Duplicate atom serial number found: 20062  
Duplicate atom serial number found: 20063  
Duplicate atom serial number found: 20064  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131179  
ATOM 2006a H2 TIP3W6751 18.519 42.849 42.758 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131180  
ATOM 2006b OH2 TIP3W6755 44.008 32.350 57.751 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131181  
ATOM 2006c H1 TIP3W6755 43.185 32.521 58.312 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131182  
ATOM 2006d H2 TIP3W6755 43.985 31.442 57.427 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131183  
ATOM 2006e OH2 TIP3W6757 50.122 37.142 60.318 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20070  
Duplicate atom serial number found: 20071  
Duplicate atom serial number found: 20072  
Duplicate atom serial number found: 20073  
Duplicate atom serial number found: 20074  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131195  
ATOM 2007a OH2 TIP3W6813 49.744 30.550 28.268 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131196  
ATOM 2007b H1 TIP3W6813 49.969 29.906 27.569 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131197  
ATOM 2007c H2 TIP3W6813 49.257 31.306 27.854 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131198  
ATOM 2007d OH2 TIP3W6845 45.797 42.167 75.526 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131199  
ATOM 2007e H1 TIP3W6845 46.326 41.647 76.133 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20080  
Duplicate atom serial number found: 20081  
Duplicate atom serial number found: 20082  
Duplicate atom serial number found: 20083  
Duplicate atom serial number found: 20084  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131211  
ATOM 2008a H1 TIP3W7027 17.967 17.281 46.109 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131212  
ATOM 2008b H2 TIP3W7027 16.967 18.044 46.904 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131213  
ATOM 2008c OH2 TIP3W7058 44.116 35.054 24.763 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131214  
ATOM 2008d H1 TIP3W7058 43.361 35.436 25.211 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131215  
ATOM 2008e H2 TIP3W7058 44.843 35.434 25.344 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20090  
Duplicate atom serial number found: 20091  
Duplicate atom serial number found: 20092  
Duplicate atom serial number found: 20093  
Duplicate atom serial number found: 20094  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131227  
ATOM 2009a H2 TIP3W7114 17.031 25.528 69.520 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131228  
ATOM 2009b OH2 TIP3W7118 47.816 35.565 59.658 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131229  
ATOM 2009c H1 TIP3W7118 47.410 35.111 58.915 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131230  
ATOM 2009d H2 TIP3W7118 47.284 36.360 59.743 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131231  
ATOM 2009e OH2 TIP3W7133 19.995 33.996 45.840 1.00 0.00 WT11 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20100  
Duplicate atom serial number found: 20101  
Duplicate atom serial number found: 20102  
Duplicate atom serial number found: 20103  
Duplicate atom serial number found: 20104  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131339  
ATOM 2010a OH2 TIP3W7690 50.196 40.871 16.023 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131340  
ATOM 2010b H1 TIP3W7690 50.540 41.076 15.105 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131341  
ATOM 2010c H2 TIP3W7690 50.162 41.727 16.475 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131342  
ATOM 2010d OH2 TIP3W7702 50.254 39.691 53.562 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131343  
ATOM 2010e H1 TIP3W7702 50.258 38.761 53.224 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20110  
Duplicate atom serial number found: 20111  
Duplicate atom serial number found: 20112  
Duplicate atom serial number found: 20113  
Duplicate atom serial number found: 20114  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131355  
ATOM 2011a H1 TIP3W7945 25.878 22.555 34.519 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131356  
ATOM 2011b H2 TIP3W7945 24.905 22.551 33.392 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131357  
ATOM 2011c OH2 TIP3W7951 19.865 20.287 49.368 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131358  
ATOM 2011d H1 TIP3W7951 20.220 19.738 48.629 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131359  
ATOM 2011e H2 TIP3W7951 19.606 19.637 50.046 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20120  
Duplicate atom serial number found: 20121  
Duplicate atom serial number found: 20122  
Duplicate atom serial number found: 20123  
Duplicate atom serial number found: 20124  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131371  
ATOM 2012a H2 TIP3W8009 19.705 17.158 47.969 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131372  
ATOM 2012b OH2 TIP3W8014 19.924 38.210 44.429 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131373  
ATOM 2012c H1 TIP3W8014 20.447 37.990 43.657 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131374  
ATOM 2012d H2 TIP3W8014 19.264 38.791 44.054 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131375  
ATOM 2012e OH2 TIP3W8017 23.086 35.306 68.230 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20130  
Duplicate atom serial number found: 20131  
Duplicate atom serial number found: 20132  
Duplicate atom serial number found: 20133  
Duplicate atom serial number found: 20134  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131387  
ATOM 2013a OH2 TIP3W8031 16.831 28.005 51.031 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131388  
ATOM 2013b H1 TIP3W8031 16.969 28.588 51.728 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131389  
ATOM 2013c H2 TIP3W8031 16.099 27.486 51.301 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131390  
ATOM 2013d OH2 TIP3W8034 17.920 21.844 54.961 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131391  
ATOM 2013e H1 TIP3W8034 18.867 21.606 55.109 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20140  
Duplicate atom serial number found: 20141  
Duplicate atom serial number found: 20142  
Duplicate atom serial number found: 20143  
Duplicate atom serial number found: 20144  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131403  
ATOM 2014a H1 TIP3W8067 17.943 46.837 24.577 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131404  
ATOM 2014b H2 TIP3W8067 18.850 45.823 25.439 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131405  
ATOM 2014c OH2 TIP3W8070 49.884 23.921 17.540 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131406  
ATOM 2014d H1 TIP3W8070 49.759 23.549 16.612 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131407  
ATOM 2014e H2 TIP3W8070 50.160 23.153 18.096 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20150  
Duplicate atom serial number found: 20151  
Duplicate atom serial number found: 20152  
Duplicate atom serial number found: 20153  
Duplicate atom serial number found: 20154  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131419  
ATOM 2015a H2 TIP3W8083 30.528 29.097 62.382 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131420  
ATOM 2015b OH2 TIP3W8094 25.155 41.042 49.348 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131421  
ATOM 2015c H1 TIP3W8094 25.889 40.441 49.134 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131422  
ATOM 2015d H2 TIP3W8094 24.691 41.035 48.523 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131423  
ATOM 2015e OH2 TIP3W8097 28.240 38.323 53.854 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20160  
Duplicate atom serial number found: 20161  
Duplicate atom serial number found: 20162  
Duplicate atom serial number found: 20163  
Duplicate atom serial number found: 20164  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131435  
ATOM 2016a OH2 TIP3W8140 20.294 48.471 50.686 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131436  
ATOM 2016b H1 TIP3W8140 20.100 47.513 50.641 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131437  
ATOM 2016c H2 TIP3W8140 19.539 48.839 50.114 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131438  
ATOM 2016d OH2 TIP3W8142 26.469 38.697 63.857 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131439  
ATOM 2016e H1 TIP3W8142 27.294 38.569 63.332 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20170  
Duplicate atom serial number found: 20171  
Duplicate atom serial number found: 20172  
Duplicate atom serial number found: 20173  
Duplicate atom serial number found: 20174  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131451  
ATOM 2017a H1 TIP3W8202 29.031 47.655 54.996 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131452  
ATOM 2017b H2 TIP3W8202 27.684 46.893 55.214 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131453  
ATOM 2017c OH2 TIP3W8206 27.333 42.753 49.782 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131454  
ATOM 2017d H1 TIP3W8206 26.642 42.125 49.590 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131455  
ATOM 2017e H2 TIP3W8206 27.923 42.130 50.292 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20180  
Duplicate atom serial number found: 20181  
Duplicate atom serial number found: 20182  
Duplicate atom serial number found: 20183  
Duplicate atom serial number found: 20184  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131467  
ATOM 2018a H2 TIP3W8364 24.728 26.427 27.543 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131468  
ATOM 2018b OH2 TIP3W8370 32.432 20.488 34.660 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131469  
ATOM 2018c H1 TIP3W8370 33.041 20.205 33.940 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131470  
ATOM 2018d H2 TIP3W8370 32.975 20.427 35.433 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131471  
ATOM 2018e OH2 TIP3W8375 18.744 26.733 63.107 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20190  
Duplicate atom serial number found: 20191  
Duplicate atom serial number found: 20192  
Duplicate atom serial number found: 20193  
Duplicate atom serial number found: 20194  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131483  
ATOM 2019a OH2 TIP3W8395 16.537 34.018 71.379 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131484  
ATOM 2019b H1 TIP3W8395 15.622 34.202 71.057 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131485  
ATOM 2019c H2 TIP3W8395 16.844 34.871 71.835 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131486  
ATOM 2019d OH2 TIP3W8403 21.170 35.429 13.234 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131487  
ATOM 2019e H1 TIP3W8403 21.174 35.397 14.180 1.00 0.00 WT11 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20200  
Duplicate atom serial number found: 20201  
Duplicate atom serial number found: 20202  
Duplicate atom serial number found: 20203  
Duplicate atom serial number found: 20204  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131595  
ATOM 2020a H1 TIP3W8566 17.588 39.597 47.586 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131596  
ATOM 2020b H2 TIP3W8566 17.142 40.916 48.182 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131597  
ATOM 2020c OH2 TIP3W8567 19.833 41.135 69.378 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131598  
ATOM 2020d H1 TIP3W8567 19.529 41.502 68.548 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131599  
ATOM 2020e H2 TIP3W8567 20.827 41.225 69.236 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20210  
Duplicate atom serial number found: 20211  
Duplicate atom serial number found: 20212  
Duplicate atom serial number found: 20213  
Duplicate atom serial number found: 20214  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131611  
ATOM 2021a H2 TIP3W8600 21.803 44.134 41.457 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131612  
ATOM 2021b OH2 TIP3W8626 16.649 43.518 64.617 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131613  
ATOM 2021c H1 TIP3W8626 17.243 43.719 65.370 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131614  
ATOM 2021d H2 TIP3W8626 15.851 43.943 64.809 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131615  
ATOM 2021e OH2 TIP3W8635 33.352 43.478 69.238 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20220  
Duplicate atom serial number found: 20221  
Duplicate atom serial number found: 20222  
Duplicate atom serial number found: 20223  
Duplicate atom serial number found: 20224  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131627  
ATOM 2022a OH2 TIP3W8801 25.435 32.109 19.905 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131628  
ATOM 2022b H1 TIP3W8801 25.578 31.189 20.120 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131629  
ATOM 2022c H2 TIP3W8801 24.956 31.974 19.072 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131630  
ATOM 2022d OH2 TIP3W8813 21.014 28.562 47.409 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131631  
ATOM 2022e H1 TIP3W8813 20.628 28.518 48.348 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20230  
Duplicate atom serial number found: 20231  
Duplicate atom serial number found: 20232  
Duplicate atom serial number found: 20233  
Duplicate atom serial number found: 20234  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131643  
ATOM 2023a H1 TIP3W8836 21.944 21.240 52.098 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131644  
ATOM 2023b H2 TIP3W8836 20.781 21.265 50.990 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131645  
ATOM 2023c OH2 TIP3W8838 17.247 16.836 63.508 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131646  
ATOM 2023d H1 TIP3W8838 17.914 16.153 63.210 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131647  
ATOM 2023e H2 TIP3W8838 17.089 16.524 64.443 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20240  
Duplicate atom serial number found: 20241  
Duplicate atom serial number found: 20242  
Duplicate atom serial number found: 20243  
Duplicate atom serial number found: 20244  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131659  
ATOM 2024a H2 TIP3W8857 31.120 21.944 68.219 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131660  
ATOM 2024b OH2 TIP3W8864 19.218 21.629 73.879 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131661  
ATOM 2024c H1 TIP3W8864 19.156 20.799 74.297 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131662  
ATOM 2024d H2 TIP3W8864 18.294 21.847 73.600 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131663  
ATOM 2024e OH2 TIP3W8865 27.934 38.761 15.247 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20250  
Duplicate atom serial number found: 20251  
Duplicate atom serial number found: 20252  
Duplicate atom serial number found: 20253  
Duplicate atom serial number found: 20254  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131675  
ATOM 2025a OH2 TIP3W8887 25.309 37.461 26.490 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131676  
ATOM 2025b H1 TIP3W8887 25.117 37.992 25.719 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131677  
ATOM 2025c H2 TIP3W8887 26.219 37.759 26.663 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131678  
ATOM 2025d OH2 TIP3W8892 16.952 46.389 43.448 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131679  
ATOM 2025e H1 TIP3W8892 17.095 47.270 43.844 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20260  
Duplicate atom serial number found: 20261  
Duplicate atom serial number found: 20262  
Duplicate atom serial number found: 20263  
Duplicate atom serial number found: 20264  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131691  
ATOM 2026a H1 TIP3W8896 26.186 29.135 52.348 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131692  
ATOM 2026b H2 TIP3W8896 25.310 28.375 53.312 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131693  
ATOM 2026c OH2 TIP3W8898 25.788 30.326 48.276 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131694  
ATOM 2026d H1 TIP3W8898 26.467 29.932 48.798 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131695  
ATOM 2026e H2 TIP3W8898 25.033 30.463 48.928 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20270  
Duplicate atom serial number found: 20271  
Duplicate atom serial number found: 20272  
Duplicate atom serial number found: 20273  
Duplicate atom serial number found: 20274  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131707  
ATOM 2027a H2 TIP3W8904 17.462 24.415 58.532 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131708  
ATOM 2027b OH2 TIP3W8905 24.253 30.828 17.947 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131709  
ATOM 2027c H1 TIP3W8905 23.524 31.136 17.413 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131710  
ATOM 2027d H2 TIP3W8905 24.614 30.134 17.346 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131711  
ATOM 2027e OH2 TIP3W8918 24.676 35.540 44.240 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20280  
Duplicate atom serial number found: 20281  
Duplicate atom serial number found: 20282  
Duplicate atom serial number found: 20283  
Duplicate atom serial number found: 20284  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131723  
ATOM 2028a OH2 TIP3W8927 21.069 44.233 18.741 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131724  
ATOM 2028b H1 TIP3W8927 21.689 44.954 18.426 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131725  
ATOM 2028c H2 TIP3W8927 20.191 44.475 18.379 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131726  
ATOM 2028d OH2 TIP3W8928 22.061 29.861 37.649 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131727  
ATOM 2028e H1 TIP3W8928 22.248 30.805 37.805 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20290  
Duplicate atom serial number found: 20291  
Duplicate atom serial number found: 20292  
Duplicate atom serial number found: 20293  
Duplicate atom serial number found: 20294  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131739  
ATOM 2029a H1 TIP3W8936 23.213 37.162 55.716 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131740  
ATOM 2029b H2 TIP3W8936 23.995 37.950 56.771 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131741  
ATOM 2029c OH2 TIP3W8937 17.553 44.006 50.526 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131742  
ATOM 2029d H1 TIP3W8937 17.982 43.324 51.125 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131743  
ATOM 2029e H2 TIP3W8937 16.677 43.643 50.257 1.00 0.00 WT11 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20300  
Duplicate atom serial number found: 20301  
Duplicate atom serial number found: 20302  
Duplicate atom serial number found: 20303  
Duplicate atom serial number found: 20304  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131851  
ATOM 2030a H2 TIP3W9084 24.417 45.011 45.216 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131852  
ATOM 2030b OH2 TIP3W9096 19.335 30.616 13.812 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131853  
ATOM 2030c H1 TIP3W9096 18.574 30.834 14.336 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131854  
ATOM 2030d H2 TIP3W9096 19.139 29.753 13.431 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131855  
ATOM 2030e OH2 TIP3W9109 23.431 43.772 60.102 1.00 0.00 WT11 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20310  
Duplicate atom serial number found: 20311  
Duplicate atom serial number found: 20312  
Duplicate atom serial number found: 20313  
Duplicate atom serial number found: 20314  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131867  
ATOM 2031a OH2 TIP3W9178 20.893 42.309 71.689 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131868  
ATOM 2031b H1 TIP3W9178 20.556 41.847 70.921 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131869  
ATOM 2031c H2 TIP3W9178 20.253 42.050 72.366 1.00 0.00 WT11 H  
  
Ignored bad PDB record found on line 131870  
ATOM 2031d OH2 TIP3W9212 21.275 18.102 47.919 1.00 0.00 WT11 O  
  
Ignored bad PDB record found on line 131871  
ATOM 2031e H1 TIP3W9212 21.931 18.191 47.257 1.00 0.00 WT11 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20320  
Duplicate atom serial number found: 20321  
Duplicate atom serial number found: 20322  
Duplicate atom serial number found: 20323  
Duplicate atom serial number found: 20324  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131883  
ATOM 2032a H1 TIP3W 21 22.503 33.398 87.655 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131884  
ATOM 2032b H2 TIP3W 21 21.756 32.252 88.329 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131885  
ATOM 2032c OH2 TIP3W 44 20.205 32.738 77.149 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131886  
ATOM 2032d H1 TIP3W 44 20.200 31.808 77.035 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131887  
ATOM 2032e H2 TIP3W 44 20.948 33.000 76.620 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20330  
Duplicate atom serial number found: 20331  
Duplicate atom serial number found: 20332  
Duplicate atom serial number found: 20333  
Duplicate atom serial number found: 20334  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131899  
ATOM 2033a H2 TIP3W 86 30.184 45.757 85.051 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131900  
ATOM 2033b OH2 TIP3W 87 18.080 23.101 77.782 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131901  
ATOM 2033c H1 TIP3W 87 18.363 22.158 77.820 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131902  
ATOM 2033d H2 TIP3W 87 17.198 23.018 77.322 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131903  
ATOM 2033e OH2 TIP3W 88 21.240 37.022 87.078 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20340  
Duplicate atom serial number found: 20341  
Duplicate atom serial number found: 20342  
Duplicate atom serial number found: 20343  
Duplicate atom serial number found: 20344  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131915  
ATOM 2034a OH2 TIP3W 112 24.989 42.104 88.050 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131916  
ATOM 2034b H1 TIP3W 112 25.543 41.962 88.854 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131917  
ATOM 2034c H2 TIP3W 112 25.225 43.014 87.766 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131918  
ATOM 2034d OH2 TIP3W 125 38.992 22.662 79.317 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131919  
ATOM 2034e H1 TIP3W 125 38.125 22.265 79.669 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20350  
Duplicate atom serial number found: 20351  
Duplicate atom serial number found: 20352  
Duplicate atom serial number found: 20353  
Duplicate atom serial number found: 20354  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131931  
ATOM 2035a H1 TIP3W 150 19.723 34.222 83.161 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131932  
ATOM 2035b H2 TIP3W 150 20.953 35.174 82.763 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131933  
ATOM 2035c OH2 TIP3W 152 25.311 29.397 81.160 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131934  
ATOM 2035d H1 TIP3W 152 24.538 28.898 81.282 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131935  
ATOM 2035e H2 TIP3W 152 25.761 28.976 80.375 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20360  
Duplicate atom serial number found: 20361  
Duplicate atom serial number found: 20362  
Duplicate atom serial number found: 20363  
Duplicate atom serial number found: 20364  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131947  
ATOM 2036a H2 TIP3W 424 31.227 23.120 77.510 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131948  
ATOM 2036b OH2 TIP3W 443 26.355 29.295 86.030 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131949  
ATOM 2036c H1 TIP3W 443 26.128 28.517 85.473 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131950  
ATOM 2036d H2 TIP3W 443 25.892 29.185 86.857 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131951  
ATOM 2036e OH2 TIP3W 465 30.310 18.338 78.831 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20370  
Duplicate atom serial number found: 20371  
Duplicate atom serial number found: 20372  
Duplicate atom serial number found: 20373  
Duplicate atom serial number found: 20374  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131963  
ATOM 2037a OH2 TIP3W 485 21.038 24.545 83.616 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131964  
ATOM 2037b H1 TIP3W 485 21.824 24.338 84.153 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131965  
ATOM 2037c H2 TIP3W 485 20.421 24.878 84.261 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131966  
ATOM 2037d OH2 TIP3W 486 19.823 21.107 85.654 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131967  
ATOM 2037e H1 TIP3W 486 19.529 21.691 84.936 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20380  
Duplicate atom serial number found: 20381  
Duplicate atom serial number found: 20382  
Duplicate atom serial number found: 20383  
Duplicate atom serial number found: 20384  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131979  
ATOM 2038a H1 TIP3W 512 37.159 30.378 86.057 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131980  
ATOM 2038b H2 TIP3W 512 36.038 30.236 87.089 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131981  
ATOM 2038c OH2 TIP3W 529 25.295 44.856 81.418 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131982  
ATOM 2038d H1 TIP3W 529 25.647 43.996 81.197 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131983  
ATOM 2038e H2 TIP3W 529 25.210 44.818 82.372 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20390  
Duplicate atom serial number found: 20391  
Duplicate atom serial number found: 20392  
Duplicate atom serial number found: 20393  
Duplicate atom serial number found: 20394  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 131995  
ATOM 2039a H2 TIP3W 562 17.918 39.229 77.332 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131996  
ATOM 2039b OH2 TIP3W 568 26.050 37.966 78.839 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 131997  
ATOM 2039c H1 TIP3W 568 26.020 38.891 78.482 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131998  
ATOM 2039d H2 TIP3W 568 25.706 37.374 78.151 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 131999  
ATOM 2039e OH2 TIP3W 575 18.764 26.990 78.463 1.00 0.00 WT12 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20400  
Duplicate atom serial number found: 20401  
Duplicate atom serial number found: 20402  
Duplicate atom serial number found: 20403  
Duplicate atom serial number found: 20404  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132107  
ATOM 2040a OH2 TIP3W1055 24.877 47.431 76.699 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132108  
ATOM 2040b H1 TIP3W1055 24.663 48.083 77.353 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132109  
ATOM 2040c H2 TIP3W1055 24.228 46.725 76.906 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132110  
ATOM 2040d OH2 TIP3W1058 22.669 44.155 89.507 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132111  
ATOM 2040e H1 TIP3W1058 22.883 44.778 88.837 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20410  
Duplicate atom serial number found: 20411  
Duplicate atom serial number found: 20412  
Duplicate atom serial number found: 20413  
Duplicate atom serial number found: 20414  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132123  
ATOM 2041a H1 TIP3W1098 19.796 46.733 85.562 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132124  
ATOM 2041b H2 TIP3W1098 18.918 45.644 85.982 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132125  
ATOM 2041c OH2 TIP3W1112 23.122 43.013 80.687 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132126  
ATOM 2041d H1 TIP3W1112 23.827 43.627 80.600 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132127  
ATOM 2041e H2 TIP3W1112 23.135 42.488 79.852 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20420  
Duplicate atom serial number found: 20421  
Duplicate atom serial number found: 20422  
Duplicate atom serial number found: 20423  
Duplicate atom serial number found: 20424  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132139  
ATOM 2042a H2 TIP3W1301 20.637 18.156 79.372 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132140  
ATOM 2042b OH2 TIP3W1307 32.516 24.824 86.467 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132141  
ATOM 2042c H1 TIP3W1307 32.505 25.809 86.554 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132142  
ATOM 2042d H2 TIP3W1307 32.496 24.767 85.460 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132143  
ATOM 2042e OH2 TIP3W1308 24.797 39.256 89.913 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20430  
Duplicate atom serial number found: 20431  
Duplicate atom serial number found: 20432  
Duplicate atom serial number found: 20433  
Duplicate atom serial number found: 20434  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132155  
ATOM 2043a OH2 TIP3W1329 36.448 23.500 84.861 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132156  
ATOM 2043b H1 TIP3W1329 37.094 24.135 84.921 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132157  
ATOM 2043c H2 TIP3W1329 35.805 23.992 84.366 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132158  
ATOM 2043d OH2 TIP3W1331 30.823 16.691 87.312 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132159  
ATOM 2043e H1 TIP3W1331 30.407 15.856 87.485 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20440  
Duplicate atom serial number found: 20441  
Duplicate atom serial number found: 20442  
Duplicate atom serial number found: 20443  
Duplicate atom serial number found: 20444  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132171  
ATOM 2044a H1 TIP3W1349 29.206 29.968 87.062 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132172  
ATOM 2044b H2 TIP3W1349 28.414 30.213 88.238 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132173  
ATOM 2044c OH2 TIP3W1352 23.087 23.967 85.485 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132174  
ATOM 2044d H1 TIP3W1352 22.523 23.394 86.135 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132175  
ATOM 2044e H2 TIP3W1352 23.977 23.712 85.885 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20450  
Duplicate atom serial number found: 20451  
Duplicate atom serial number found: 20452  
Duplicate atom serial number found: 20453  
Duplicate atom serial number found: 20454  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132187  
ATOM 2045a H2 TIP3W1371 27.988 30.795 85.609 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132188  
ATOM 2045b OH2 TIP3W1374 21.907 30.675 89.051 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132189  
ATOM 2045c H1 TIP3W1374 22.698 30.545 89.548 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132190  
ATOM 2045d H2 TIP3W1374 21.283 30.411 89.717 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132191  
ATOM 2045e OH2 TIP3W1387 20.106 24.773 79.240 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20460  
Duplicate atom serial number found: 20461  
Duplicate atom serial number found: 20462  
Duplicate atom serial number found: 20463  
Duplicate atom serial number found: 20464  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132203  
ATOM 2046a OH2 TIP3W1411 26.449 27.861 79.273 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132204  
ATOM 2046b H1 TIP3W1411 25.694 27.247 79.261 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132205  
ATOM 2046c H2 TIP3W1411 26.953 27.781 78.500 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132206  
ATOM 2046d OH2 TIP3W1412 26.969 25.963 87.154 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132207  
ATOM 2046e H1 TIP3W1412 26.475 26.763 87.235 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20470  
Duplicate atom serial number found: 20471  
Duplicate atom serial number found: 20472  
Duplicate atom serial number found: 20473  
Duplicate atom serial number found: 20474  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132219  
ATOM 2047a H1 TIP3W1428 29.223 18.892 85.134 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132220  
ATOM 2047b H2 TIP3W1428 30.430 19.268 85.951 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132221  
ATOM 2047c OH2 TIP3W1429 21.870 25.487 81.176 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132222  
ATOM 2047d H1 TIP3W1429 21.142 25.260 80.550 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132223  
ATOM 2047e H2 TIP3W1429 21.358 25.190 81.956 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20480  
Duplicate atom serial number found: 20481  
Duplicate atom serial number found: 20482  
Duplicate atom serial number found: 20483  
Duplicate atom serial number found: 20484  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132235  
ATOM 2048a H2 TIP3W1452 23.005 30.964 75.801 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132236  
ATOM 2048b OH2 TIP3W1453 34.325 44.562 82.287 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132237  
ATOM 2048c H1 TIP3W1453 33.593 44.925 81.801 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132238  
ATOM 2048d H2 TIP3W1453 33.894 43.892 82.819 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132239  
ATOM 2048e OH2 TIP3W1454 25.363 36.027 85.232 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20490  
Duplicate atom serial number found: 20491  
Duplicate atom serial number found: 20492  
Duplicate atom serial number found: 20493  
Duplicate atom serial number found: 20494  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132251  
ATOM 2049a OH2 TIP3W1512 26.728 37.920 87.320 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132252  
ATOM 2049b H1 TIP3W1512 27.434 37.347 87.024 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132253  
ATOM 2049c H2 TIP3W1512 26.015 37.381 87.022 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132254  
ATOM 2049d OH2 TIP3W1515 33.108 42.648 84.128 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132255  
ATOM 2049e H1 TIP3W1515 33.611 42.211 84.839 1.00 0.00 WT12 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20500  
Duplicate atom serial number found: 20501  
Duplicate atom serial number found: 20502  
Duplicate atom serial number found: 20503  
Duplicate atom serial number found: 20504  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132363  
ATOM 2050a H1 TIP3W1915 29.798 33.829 82.527 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132364  
ATOM 2050b H2 TIP3W1915 28.383 34.413 82.793 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132365  
ATOM 2050c OH2 TIP3W1935 34.415 41.621 86.262 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132366  
ATOM 2050d H1 TIP3W1935 35.272 41.967 86.100 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132367  
ATOM 2050e H2 TIP3W1935 34.577 40.861 86.913 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20510  
Duplicate atom serial number found: 20511  
Duplicate atom serial number found: 20512  
Duplicate atom serial number found: 20513  
Duplicate atom serial number found: 20514  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132379  
ATOM 2051a H2 TIP3W1955 22.144 42.757 83.569 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132380  
ATOM 2051b OH2 TIP3W1977 40.107 39.621 79.942 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132381  
ATOM 2051c H1 TIP3W1977 39.823 38.813 79.390 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132382  
ATOM 2051d H2 TIP3W1977 40.213 40.286 79.218 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132383  
ATOM 2051e OH2 TIP3W1993 39.111 45.493 81.989 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20520  
Duplicate atom serial number found: 20521  
Duplicate atom serial number found: 20522  
Duplicate atom serial number found: 20523  
Duplicate atom serial number found: 20524  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132395  
ATOM 2052a OH2 TIP3W2167 23.948 20.927 77.235 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132396  
ATOM 2052b H1 TIP3W2167 24.733 21.002 76.696 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132397  
ATOM 2052c H2 TIP3W2167 23.203 20.931 76.607 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132398  
ATOM 2052d OH2 TIP3W2187 40.632 18.134 87.972 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132399  
ATOM 2052e H1 TIP3W2187 40.002 17.781 88.638 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20530  
Duplicate atom serial number found: 20531  
Duplicate atom serial number found: 20532  
Duplicate atom serial number found: 20533  
Duplicate atom serial number found: 20534  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132411  
ATOM 2053a H1 TIP3W2244 30.487 21.060 80.743 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132412  
ATOM 2053b H2 TIP3W2244 30.542 21.913 79.487 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132413  
ATOM 2053c OH2 TIP3W2250 33.841 19.820 80.041 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132414  
ATOM 2053d H1 TIP3W2250 34.615 19.853 79.437 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132415  
ATOM 2053e H2 TIP3W2250 33.816 18.844 80.246 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20540  
Duplicate atom serial number found: 20541  
Duplicate atom serial number found: 20542  
Duplicate atom serial number found: 20543  
Duplicate atom serial number found: 20544  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132427  
ATOM 2054a H2 TIP3W2271 39.903 27.761 85.991 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132428  
ATOM 2054b OH2 TIP3W2275 37.263 31.422 84.431 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132429  
ATOM 2054c H1 TIP3W2275 38.035 32.075 84.363 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132430  
ATOM 2054d H2 TIP3W2275 36.467 31.939 84.394 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132431  
ATOM 2054e OH2 TIP3W2288 20.047 31.872 85.523 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20550  
Duplicate atom serial number found: 20551  
Duplicate atom serial number found: 20552  
Duplicate atom serial number found: 20553  
Duplicate atom serial number found: 20554  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132443  
ATOM 2055a OH2 TIP3W2309 30.689 26.420 80.208 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132444  
ATOM 2055b H1 TIP3W2309 31.392 26.948 80.591 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132445  
ATOM 2055c H2 TIP3W2309 30.109 26.279 80.931 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132446  
ATOM 2055d OH2 TIP3W2311 31.111 30.237 84.889 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132447  
ATOM 2055e H1 TIP3W2311 31.581 30.792 84.224 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20560  
Duplicate atom serial number found: 20561  
Duplicate atom serial number found: 20562  
Duplicate atom serial number found: 20563  
Duplicate atom serial number found: 20564  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132459  
ATOM 2056a H1 TIP3W2318 26.767 41.361 77.857 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132460  
ATOM 2056b H2 TIP3W2318 27.608 40.284 78.394 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132461  
ATOM 2056c OH2 TIP3W2329 41.994 33.179 77.781 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132462  
ATOM 2056d H1 TIP3W2329 41.864 32.727 78.659 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132463  
ATOM 2056e H2 TIP3W2329 42.184 32.382 77.194 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20570  
Duplicate atom serial number found: 20571  
Duplicate atom serial number found: 20572  
Duplicate atom serial number found: 20573  
Duplicate atom serial number found: 20574  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132475  
ATOM 2057a H2 TIP3W2351 33.667 35.665 79.185 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132476  
ATOM 2057b OH2 TIP3W2352 35.186 40.207 79.823 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132477  
ATOM 2057c H1 TIP3W2352 35.405 39.426 79.296 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132478  
ATOM 2057d H2 TIP3W2352 34.855 39.822 80.621 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132479  
ATOM 2057e OH2 TIP3W2354 33.283 47.729 83.182 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20580  
Duplicate atom serial number found: 20581  
Duplicate atom serial number found: 20582  
Duplicate atom serial number found: 20583  
Duplicate atom serial number found: 20584  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132491  
ATOM 2058a OH2 TIP3W2359 37.824 39.792 89.262 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132492  
ATOM 2058b H1 TIP3W2359 38.576 40.252 88.930 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132493  
ATOM 2058c H2 TIP3W2359 38.121 39.017 89.775 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132494  
ATOM 2058d OH2 TIP3W2376 33.355 42.458 79.790 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132495  
ATOM 2058e H1 TIP3W2376 32.972 41.935 80.455 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20590  
Duplicate atom serial number found: 20591  
Duplicate atom serial number found: 20592  
Duplicate atom serial number found: 20593  
Duplicate atom serial number found: 20594  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132507  
ATOM 2059a H1 TIP3W2397 23.962 47.481 80.753 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132508  
ATOM 2059b H2 TIP3W2397 24.539 46.233 80.254 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132509  
ATOM 2059c OH2 TIP3W2436 32.839 47.799 80.266 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132510  
ATOM 2059d H1 TIP3W2436 32.923 48.181 81.123 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132511  
ATOM 2059e H2 TIP3W2436 32.757 46.843 80.413 1.00 0.00 WT12 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20600  
Duplicate atom serial number found: 20601  
Duplicate atom serial number found: 20602  
Duplicate atom serial number found: 20603  
Duplicate atom serial number found: 20604  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132619  
ATOM 2060a H2 TIP3W2857 32.088 43.778 88.055 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132620  
ATOM 2060b OH2 TIP3W2859 29.944 47.930 80.589 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132621  
ATOM 2060c H1 TIP3W2859 30.722 48.433 80.269 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132622  
ATOM 2060d H2 TIP3W2859 29.210 48.229 80.101 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132623  
ATOM 2060e OH2 TIP3W2877 41.277 45.050 77.578 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20610  
Duplicate atom serial number found: 20611  
Duplicate atom serial number found: 20612  
Duplicate atom serial number found: 20613  
Duplicate atom serial number found: 20614  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132635  
ATOM 2061a OH2 TIP3W2944 42.235 47.403 85.096 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132636  
ATOM 2061b H1 TIP3W2944 43.048 47.451 84.568 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132637  
ATOM 2061c H2 TIP3W2944 41.639 47.354 84.312 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132638  
ATOM 2061d OH2 TIP3W3010 25.435 20.505 84.653 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132639  
ATOM 2061e H1 TIP3W3010 25.796 21.420 84.652 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20620  
Duplicate atom serial number found: 20621  
Duplicate atom serial number found: 20622  
Duplicate atom serial number found: 20623  
Duplicate atom serial number found: 20624  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132651  
ATOM 2062a H1 TIP3W3073 35.745 21.741 84.407 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132652  
ATOM 2062b H2 TIP3W3073 34.783 21.163 83.332 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132653  
ATOM 2062c OH2 TIP3W3085 40.568 20.889 77.353 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132654  
ATOM 2062d H1 TIP3W3085 39.739 20.361 77.279 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132655  
ATOM 2062e H2 TIP3W3085 41.159 20.274 77.820 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20630  
Duplicate atom serial number found: 20631  
Duplicate atom serial number found: 20632  
Duplicate atom serial number found: 20633  
Duplicate atom serial number found: 20634  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132667  
ATOM 2063a H2 TIP3W3109 38.388 37.319 79.392 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132668  
ATOM 2063b OH2 TIP3W3111 41.441 31.441 82.190 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132669  
ATOM 2063c H1 TIP3W3111 42.230 31.128 82.796 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132670  
ATOM 2063d H2 TIP3W3111 40.837 30.691 82.243 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132671  
ATOM 2063e OH2 TIP3W3112 43.453 29.990 88.410 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20640  
Duplicate atom serial number found: 20641  
Duplicate atom serial number found: 20642  
Duplicate atom serial number found: 20643  
Duplicate atom serial number found: 20644  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132683  
ATOM 2064a OH2 TIP3W3150 34.211 28.680 80.584 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132684  
ATOM 2064b H1 TIP3W3150 33.749 29.515 80.452 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132685  
ATOM 2064c H2 TIP3W3150 34.424 28.722 81.467 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132686  
ATOM 2064d OH2 TIP3W3151 50.504 31.567 75.928 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132687  
ATOM 2064e H1 TIP3W3151 50.760 32.109 75.169 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20650  
Duplicate atom serial number found: 20651  
Duplicate atom serial number found: 20652  
Duplicate atom serial number found: 20653  
Duplicate atom serial number found: 20654  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132699  
ATOM 2065a H1 TIP3W3192 40.179 33.895 84.510 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132700  
ATOM 2065b H2 TIP3W3192 40.431 32.750 83.791 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132701  
ATOM 2065c OH2 TIP3W3214 41.066 28.580 82.314 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132702  
ATOM 2065d H1 TIP3W3214 41.173 28.180 81.478 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132703  
ATOM 2065e H2 TIP3W3214 41.937 28.913 82.502 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20660  
Duplicate atom serial number found: 20661  
Duplicate atom serial number found: 20662  
Duplicate atom serial number found: 20663  
Duplicate atom serial number found: 20664  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132715  
ATOM 2066a H2 TIP3W3244 35.743 38.245 85.206 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132716  
ATOM 2066b OH2 TIP3W3257 42.592 42.579 77.886 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132717  
ATOM 2066c H1 TIP3W3257 42.233 43.450 77.451 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132718  
ATOM 2066d H2 TIP3W3257 43.600 42.732 77.838 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132719  
ATOM 2066e OH2 TIP3W3258 40.569 35.308 82.372 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20670  
Duplicate atom serial number found: 20671  
Duplicate atom serial number found: 20672  
Duplicate atom serial number found: 20673  
Duplicate atom serial number found: 20674  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132731  
ATOM 2067a OH2 TIP3W3280 41.509 38.730 86.630 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132732  
ATOM 2067b H1 TIP3W3280 42.378 39.014 86.174 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132733  
ATOM 2067c H2 TIP3W3280 41.856 38.371 87.507 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132734  
ATOM 2067d OH2 TIP3W3282 45.854 44.608 87.326 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132735  
ATOM 2067e H1 TIP3W3282 45.566 45.506 87.275 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20680  
Duplicate atom serial number found: 20681  
Duplicate atom serial number found: 20682  
Duplicate atom serial number found: 20683  
Duplicate atom serial number found: 20684  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132747  
ATOM 2068a H1 TIP3W3317 49.863 43.018 77.635 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132748  
ATOM 2068b H2 TIP3W3317 48.578 42.287 78.008 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132749  
ATOM 2068c OH2 TIP3W3382 32.457 47.060 77.267 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132750  
ATOM 2068d H1 TIP3W3382 32.676 46.161 77.363 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132751  
ATOM 2068e H2 TIP3W3382 32.311 47.282 78.226 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20690  
Duplicate atom serial number found: 20691  
Duplicate atom serial number found: 20692  
Duplicate atom serial number found: 20693  
Duplicate atom serial number found: 20694  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132763  
ATOM 2069a H2 TIP3W3442 32.701 30.516 77.501 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132764  
ATOM 2069b OH2 TIP3W3447 27.736 18.692 83.795 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132765  
ATOM 2069c H1 TIP3W3447 27.810 17.778 83.990 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132766  
ATOM 2069d H2 TIP3W3447 26.843 18.899 84.020 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132767  
ATOM 2069e OH2 TIP3W3484 43.349 19.362 87.390 1.00 0.00 WT12 O  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20700  
Duplicate atom serial number found: 20701  
Duplicate atom serial number found: 20702  
Duplicate atom serial number found: 20703  
Duplicate atom serial number found: 20704  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132875  
ATOM 2070a OH2 TIP3W3933 36.939 22.122 87.264 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132876  
ATOM 2070b H1 TIP3W3933 36.170 21.579 87.559 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132877  
ATOM 2070c H2 TIP3W3933 36.597 22.628 86.437 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132878  
ATOM 2070d OH2 TIP3W3951 37.389 17.545 85.664 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132879  
ATOM 2070e H1 TIP3W3951 37.934 18.260 86.081 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20710  
Duplicate atom serial number found: 20711  
Duplicate atom serial number found: 20712  
Duplicate atom serial number found: 20713  
Duplicate atom serial number found: 20714  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132891  
ATOM 2071a H1 TIP3W3986 44.944 19.588 76.726 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132892  
ATOM 2071b H2 TIP3W3986 43.613 19.419 77.338 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132893  
ATOM 2071c OH2 TIP3W3992 45.233 23.325 83.213 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132894  
ATOM 2071d H1 TIP3W3992 45.005 24.256 83.398 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132895  
ATOM 2071e H2 TIP3W3992 44.347 22.995 83.026 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20720  
Duplicate atom serial number found: 20721  
Duplicate atom serial number found: 20722  
Duplicate atom serial number found: 20723  
Duplicate atom serial number found: 20724  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132907  
ATOM 2072a H2 TIP3W4012 25.585 29.986 77.938 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132908  
ATOM 2072b OH2 TIP3W4014 47.294 17.486 86.744 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132909  
ATOM 2072c H1 TIP3W4014 46.814 16.636 86.885 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132910  
ATOM 2072d H2 TIP3W4014 46.710 17.964 86.175 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132911  
ATOM 2072e OH2 TIP3W4015 41.784 17.684 82.973 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20730  
Duplicate atom serial number found: 20731  
Duplicate atom serial number found: 20732  
Duplicate atom serial number found: 20733  
Duplicate atom serial number found: 20734  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132923  
ATOM 2073a OH2 TIP3W4037 36.363 24.961 76.930 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132924  
ATOM 2073b H1 TIP3W4037 36.128 24.010 77.108 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132925  
ATOM 2073c H2 TIP3W4037 35.556 25.453 77.044 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132926  
ATOM 2073d OH2 TIP3W4055 44.185 37.401 76.693 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132927  
ATOM 2073e H1 TIP3W4055 43.611 37.379 75.878 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20740  
Duplicate atom serial number found: 20741  
Duplicate atom serial number found: 20742  
Duplicate atom serial number found: 20743  
Duplicate atom serial number found: 20744  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132939  
ATOM 2074a H1 TIP3W4093 48.424 46.578 80.096 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132940  
ATOM 2074b H2 TIP3W4093 48.333 47.795 81.022 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132941  
ATOM 2074c OH2 TIP3W4097 38.395 46.556 79.205 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132942  
ATOM 2074d H1 TIP3W4097 38.159 46.290 80.081 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132943  
ATOM 2074e H2 TIP3W4097 38.187 47.554 79.116 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20750  
Duplicate atom serial number found: 20751  
Duplicate atom serial number found: 20752  
Duplicate atom serial number found: 20753  
Duplicate atom serial number found: 20754  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132955  
ATOM 2075a H2 TIP3W4138 43.578 34.597 78.654 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132956  
ATOM 2075b OH2 TIP3W4139 42.901 43.972 84.868 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132957  
ATOM 2075c H1 TIP3W4139 42.424 43.800 85.743 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132958  
ATOM 2075d H2 TIP3W4139 42.349 43.497 84.221 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132959  
ATOM 2075e OH2 TIP3W4141 38.139 37.408 83.892 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20760  
Duplicate atom serial number found: 20761  
Duplicate atom serial number found: 20762  
Duplicate atom serial number found: 20763  
Duplicate atom serial number found: 20764  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132971  
ATOM 2076a OH2 TIP3W4179 43.264 39.917 77.817 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132972  
ATOM 2076b H1 TIP3W4179 43.062 40.839 77.976 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132973  
ATOM 2076c H2 TIP3W4179 42.957 39.438 78.626 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132974  
ATOM 2076d OH2 TIP3W4181 41.960 47.417 79.171 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132975  
ATOM 2076e H1 TIP3W4181 42.091 48.369 79.362 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20770  
Duplicate atom serial number found: 20771  
Duplicate atom serial number found: 20772  
Duplicate atom serial number found: 20773  
Duplicate atom serial number found: 20774  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 132987  
ATOM 2077a H1 TIP3W4394 40.597 24.246 86.128 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132988  
ATOM 2077b H2 TIP3W4394 39.427 24.641 87.057 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132989  
ATOM 2077c OH2 TIP3W4414 46.752 21.112 79.887 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 132990  
ATOM 2077d H1 TIP3W4414 47.312 20.359 80.235 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 132991  
ATOM 2077e H2 TIP3W4414 45.972 21.244 80.470 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20780  
Duplicate atom serial number found: 20781  
Duplicate atom serial number found: 20782  
Duplicate atom serial number found: 20783  
Duplicate atom serial number found: 20784  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133003  
ATOM 2078a H2 TIP3W4496 49.814 39.392 87.718 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133004  
ATOM 2078b OH2 TIP3W4516 42.368 41.602 83.234 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133005  
ATOM 2078c H1 TIP3W4516 42.417 41.290 82.325 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133006  
ATOM 2078d H2 TIP3W4516 41.653 41.054 83.709 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133007  
ATOM 2078e OH2 TIP3W4519 35.491 33.698 77.220 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20790  
Duplicate atom serial number found: 20791  
Duplicate atom serial number found: 20792  
Duplicate atom serial number found: 20793  
Duplicate atom serial number found: 20794  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133019  
ATOM 2079a OH2 TIP3W4553 39.156 41.840 81.657 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133020  
ATOM 2079b H1 TIP3W4553 39.250 41.142 80.921 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133021  
ATOM 2079c H2 TIP3W4553 38.236 42.104 81.691 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133022  
ATOM 2079d OH2 TIP3W4559 32.739 40.578 81.914 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133023  
ATOM 2079e H1 TIP3W4559 32.653 39.854 82.614 1.00 0.00 WT12 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20800  
Duplicate atom serial number found: 20801  
Duplicate atom serial number found: 20802  
Duplicate atom serial number found: 20803  
Duplicate atom serial number found: 20804  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133131  
ATOM 2080a H1 TIP3W5463 41.689 42.506 88.006 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133132  
ATOM 2080b H2 TIP3W5463 40.466 42.700 87.061 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133133  
ATOM 2080c OH2 TIP3W5466 49.145 33.368 83.822 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133134  
ATOM 2080d H1 TIP3W5466 49.864 32.722 83.793 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133135  
ATOM 2080e H2 TIP3W5466 49.632 34.228 83.705 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20810  
Duplicate atom serial number found: 20811  
Duplicate atom serial number found: 20812  
Duplicate atom serial number found: 20813  
Duplicate atom serial number found: 20814  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133147  
ATOM 2081a H2 TIP3W5899 37.769 42.986 85.952 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133148  
ATOM 2081b OH2 TIP3W5901 38.120 32.624 87.652 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133149  
ATOM 2081c H1 TIP3W5901 37.660 31.698 87.517 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133150  
ATOM 2081d H2 TIP3W5901 38.565 32.412 88.441 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133151  
ATOM 2081e OH2 TIP3W6138 49.192 18.678 88.476 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20820  
Duplicate atom serial number found: 20821  
Duplicate atom serial number found: 20822  
Duplicate atom serial number found: 20823  
Duplicate atom serial number found: 20824  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133163  
ATOM 2082a OH2 TIP3W6195 47.092 27.420 79.340 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133164  
ATOM 2082b H1 TIP3W6195 46.865 26.524 79.746 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133165  
ATOM 2082c H2 TIP3W6195 46.369 27.593 78.666 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133166  
ATOM 2082d OH2 TIP3W6220 49.047 36.451 86.795 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133167  
ATOM 2082e H1 TIP3W6220 48.352 36.403 86.073 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20830  
Duplicate atom serial number found: 20831  
Duplicate atom serial number found: 20832  
Duplicate atom serial number found: 20833  
Duplicate atom serial number found: 20834  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133179  
ATOM 2083a H1 TIP3W6350 16.426 44.830 80.809 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133180  
ATOM 2083b H2 TIP3W6350 15.490 43.896 81.514 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133181  
ATOM 2083c OH2 TIP3W6684 44.332 27.392 79.911 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133182  
ATOM 2083d H1 TIP3W6684 43.389 27.109 79.914 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133183  
ATOM 2083e H2 TIP3W6684 44.205 28.361 79.774 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20840  
Duplicate atom serial number found: 20841  
Duplicate atom serial number found: 20842  
Duplicate atom serial number found: 20843  
Duplicate atom serial number found: 20844  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133195  
ATOM 2084a H2 TIP3W7510 22.033 27.824 88.617 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133196  
ATOM 2084b OH2 TIP3W7583 17.184 32.169 80.385 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133197  
ATOM 2084c H1 TIP3W7583 16.353 31.770 80.447 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133198  
ATOM 2084d H2 TIP3W7583 17.401 32.424 81.271 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133199  
ATOM 2084e OH2 TIP3W7605 23.107 41.272 86.187 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20850  
Duplicate atom serial number found: 20851  
Duplicate atom serial number found: 20852  
Duplicate atom serial number found: 20853  
Duplicate atom serial number found: 20854  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133211  
ATOM 2085a OH2 TIP3W7650 20.517 43.936 80.280 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133212  
ATOM 2085b H1 TIP3W7650 20.288 43.246 80.904 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133213  
ATOM 2085c H2 TIP3W7650 21.503 43.993 80.432 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133214  
ATOM 2085d OH2 TIP3W7690 50.196 40.871 81.442 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133215  
ATOM 2085e H1 TIP3W7690 50.540 41.076 80.524 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20860  
Duplicate atom serial number found: 20861  
Duplicate atom serial number found: 20862  
Duplicate atom serial number found: 20863  
Duplicate atom serial number found: 20864  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133227  
ATOM 2086a H1 TIP3W8024 21.422 42.064 86.189 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133228  
ATOM 2086b H2 TIP3W8024 20.737 43.188 85.422 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133229  
ATOM 2086c OH2 TIP3W8046 19.649 39.301 87.575 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133230  
ATOM 2086d H1 TIP3W8046 20.021 38.369 87.509 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133231  
ATOM 2086e H2 TIP3W8046 19.281 39.411 86.692 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20870  
Duplicate atom serial number found: 20871  
Duplicate atom serial number found: 20872  
Duplicate atom serial number found: 20873  
Duplicate atom serial number found: 20874  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133243  
ATOM 2087a H2 TIP3W8136 18.162 48.773 88.180 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133244  
ATOM 2087b OH2 TIP3W8174 19.183 43.315 88.143 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133245  
ATOM 2087c H1 TIP3W8174 19.821 42.784 87.584 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133246  
ATOM 2087d H2 TIP3W8174 19.170 44.145 87.698 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133247  
ATOM 2087e OH2 TIP3W8403 21.170 35.429 78.653 1.00 0.00 WT12 O  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20880  
Duplicate atom serial number found: 20881  
Duplicate atom serial number found: 20882  
Duplicate atom serial number found: 20883  
Duplicate atom serial number found: 20884  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133259  
ATOM 2088a OH2 TIP3W8468 17.732 29.997 89.668 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133260  
ATOM 2088b H1 TIP3W8468 18.014 29.769 88.802 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133261  
ATOM 2088c H2 TIP3W8468 17.324 30.863 89.473 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133262  
ATOM 2088d OH2 TIP3W8528 22.433 32.505 79.165 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133263  
ATOM 2088e H1 TIP3W8528 22.435 32.454 80.131 1.00 0.00 WT12 H  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20890  
Duplicate atom serial number found: 20891  
Duplicate atom serial number found: 20892  
Duplicate atom serial number found: 20893  
Duplicate atom serial number found: 20894  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133275  
ATOM 2089a H1 TIP3W8760 29.963 36.132 82.798 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133276  
ATOM 2089b H2 TIP3W8760 29.619 36.590 81.440 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133277  
ATOM 2089c OH2 TIP3W8780 19.858 24.518 76.155 1.00 0.00 WT12 O  
  
Ignored bad PDB record found on line 133278  
ATOM 2089d H1 TIP3W8780 18.967 24.267 76.416 1.00 0.00 WT12 H  
  
Ignored bad PDB record found on line 133279  
ATOM 2089e H2 TIP3W8780 20.309 24.195 76.932 1.00 0.00 WT12 H  
  
97 messages similar to the above omitted  
Duplicate atom serial number found: 20900  
Duplicate atom serial number found: 20901  
Duplicate atom serial number found: 20902  
Duplicate atom serial number found: 20903  
Duplicate atom serial number found: 20904  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133387  
ATOM 2090a SOD SOD I 21 40.337 0.068 24.351 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133388  
ATOM 2090b SOD SOD I 22 -22.408 17.476 57.690 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133389  
ATOM 2090c SOD SOD I 23 12.160 -42.791 77.150 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133390  
ATOM 2090d SOD SOD I 24 -12.302 26.255 72.387 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133391  
ATOM 2090e SOD SOD I 25 -16.116 44.483 41.069 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20910  
Duplicate atom serial number found: 20911  
Duplicate atom serial number found: 20912  
Duplicate atom serial number found: 20913  
Duplicate atom serial number found: 20914  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133403  
ATOM 2091a SOD SOD I 37 3.039 39.235 64.945 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133404  
ATOM 2091b SOD SOD I 38 -35.460 38.639 -52.252 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133405  
ATOM 2091c SOD SOD I 39 -6.255 -44.293 72.474 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133406  
ATOM 2091d SOD SOD I 40 20.996 10.897 -47.051 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133407  
ATOM 2091e SOD SOD I 41 23.858 17.480 45.179 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20920  
Duplicate atom serial number found: 20921  
Duplicate atom serial number found: 20922  
Duplicate atom serial number found: 20923  
Duplicate atom serial number found: 20924  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133419  
ATOM 2092a SOD SOD I 53 -34.899 -47.098 32.736 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133420  
ATOM 2092b SOD SOD I 54 18.940 47.090 -48.743 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133421  
ATOM 2092c SOD SOD I 55 -30.990 -5.039 70.701 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133422  
ATOM 2092d SOD SOD I 56 -37.556 45.878 -39.532 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133423  
ATOM 2092e SOD SOD I 57 2.162 36.724 39.212 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20930  
Duplicate atom serial number found: 20931  
Duplicate atom serial number found: 20932  
Duplicate atom serial number found: 20933  
Duplicate atom serial number found: 20934  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133435  
ATOM 2093a SOD SOD I 69 14.363 45.149 85.808 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133436  
ATOM 2093b SOD SOD I 70 -14.913 -45.808 -39.614 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133437  
ATOM 2093c SOD SOD I 71 41.383 30.295 78.708 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133438  
ATOM 2093d SOD SOD I 72 38.184 40.444 74.587 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133439  
ATOM 2093e SOD SOD I 73 -14.966 -38.533 40.944 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20940  
Duplicate atom serial number found: 20941  
Duplicate atom serial number found: 20942  
Duplicate atom serial number found: 20943  
Duplicate atom serial number found: 20944  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133451  
ATOM 2094a CLA CLA I 85 -21.171 -0.372 89.099 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133452  
ATOM 2094b CLA CLA I 86 -26.903 8.310 51.105 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133453  
ATOM 2094c CLA CLA I 87 27.121 41.242 -47.461 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133454  
ATOM 2094d CLA CLA I 88 -31.377 -44.037 39.438 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133455  
ATOM 2094e CLA CLA I 89 40.181 21.389 65.892 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20950  
Duplicate atom serial number found: 20951  
Duplicate atom serial number found: 20952  
Duplicate atom serial number found: 20953  
Duplicate atom serial number found: 20954  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133467  
ATOM 2095a CLA CLA I 101 -2.815 -36.823 86.782 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133468  
ATOM 2095b CLA CLA I 102 47.415 27.920 34.122 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133469  
ATOM 2095c CLA CLA I 103 26.845 35.962 37.483 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133470  
ATOM 2095d CLA CLA I 104 -5.591 28.587 78.325 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133471  
ATOM 2095e CLA CLA I 105 -48.076 -44.751 60.650 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20960  
Duplicate atom serial number found: 20961  
Duplicate atom serial number found: 20962  
Duplicate atom serial number found: 20963  
Duplicate atom serial number found: 20964  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133483  
ATOM 2096a CLA CLA I 117 21.760 -19.042 88.022 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133484  
ATOM 2096b CLA CLA I 118 -13.449 -3.941 84.912 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133485  
ATOM 2096c CLA CLA I 119 -19.845 -21.719 58.043 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133486  
ATOM 2096d CLA CLA I 120 45.121 -37.677 64.099 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133487  
ATOM 2096e CLA CLA I 121 30.774 17.772 -40.996 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20970  
Duplicate atom serial number found: 20971  
Duplicate atom serial number found: 20972  
Duplicate atom serial number found: 20973  
Duplicate atom serial number found: 20974  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133499  
ATOM 2097a CLA CLA I 133 20.941 45.638 53.587 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133500  
ATOM 2097b CLA CLA I 134 45.710 -44.575 88.231 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133501  
ATOM 2097c CLA CLA I 135 -44.815 -33.421 68.509 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133502  
ATOM 2097d CLA CLA I 136 -18.668 21.112 79.887 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133503  
ATOM 2097e CLA CLA I 137 47.208 -24.843 22.669 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20980  
Duplicate atom serial number found: 20981  
Duplicate atom serial number found: 20982  
Duplicate atom serial number found: 20983  
Duplicate atom serial number found: 20984  
5 messages similar to the above omitted  
Ignored bad PDB record found on line 133515  
ATOM 2098a CLA CLA I 149 -14.404 33.944 26.977 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133516  
ATOM 2098b CLA CLA I 150 -18.137 8.023 -53.386 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133517  
ATOM 2098c CLA CLA I 151 -19.639 42.535 -49.689 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133518  
ATOM 2098d CLA CLA I 152 -18.682 -40.473 62.415 1.00 0.00 ION  
  
Ignored bad PDB record found on line 133519  
ATOM 2098e CLA CLA I 153 -35.780 40.913 23.512 1.00 0.00 ION  
  
1 messages similar to the above omitted  
Duplicate atom serial number found: 20990  
Duplicate atom serial number found: 20991  
Duplicate atom serial number found: 20992  
Duplicate atom serial number found: 20993  
Duplicate atom serial number found: 20994  
3 messages similar to the above omitted  
  
Chain information for p450_diltiazem_ionized.pdb #1  
---  
Chain | Description  
P | No description available  
  

vr on

device vr true ↵

Traceback (most recent call last):  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/cmd_line/tool.py", line 205, in execute  
    cmd.run(cmd_text)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/core/commands/cli.py", line 2582, in run  
    _used_aliases=used_aliases, log=log))  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/core/commands/cli.py", line 3066, in __call__  
    return self.cmd.run(text, _used_aliases=_used_aliases, log=log)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/core/commands/cli.py", line 2561, in run  
    result = ci.function(session, **kw_args)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/vive/vr.py", line 68, in vr  
    start_vr(session, multishadow_allowed, simplify_graphics)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/vive/vr.py", line 148, in start_vr  
    mv.camera = SteamVRCamera(session)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/chimerax/vive/vr.py", line 228, in __init__  
    self.vr_system = vrs = openvr.init(openvr.VRApplication_Scene)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/openvr/__init__.py", line 5286, in init  
    initInternal2(applicationType, pStartupInfo)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/openvr/__init__.py", line 5390, in initInternal2  
    _checkInitError(error.value)  
  File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/openvr/__init__.py", line 5272, in _checkInitError  
    raise OpenVRError("%s (error number %d)" %(getVRInitErrorAsSymbol(error),
error))  
openvr.OpenVRError: b'VRInitError_Init_VRClientDLLNotFound' (error number 102)  
  

openvr.OpenVRError: b'VRInitError_Init_VRClientDLLNotFound' (error number 102)  
  
File "/usr/lib/ucsf-chimerax-daily/lib/python3.6/site-
packages/openvr/__init__.py", line 5272, in _checkInitError  
raise OpenVRError("%s (error number %d)" %(getVRInitErrorAsSymbol(error),
error))  
  
See log for complete Python traceback.  
  




OpenGL version: 3.3.0 NVIDIA 396.44
OpenGL renderer: GeForce GTX 1080 Ti/PCIe/SSE2
OpenGL vendor: NVIDIA Corporation

Change History (2)

comment:1 by Eric Pettersen, 7 years ago

Component: Unassigned → VR
Owner: set to Tom Goddard
Platform: → all
Project: → ChimeraX
Status: new → assigned
Summary: ChimeraX bug report submission → vr: VRInitError_Init_VRClientDLLNotFound

Reported by Eddie Ackad

comment:2 by Tom Goddard, 7 years ago

Resolution: → nonchimerax
Status: assigned → closed

I never tried VR on Linux.

It turns out the Python openvr library pyopenvr which ChimeraX uses does not work with linux unless you install some packages and make a sym link. Here is a description of the monkey business to make it work on Linux.

​https://github.com/cmbruns/pyopenvr/issues/30#issuecomment-302961948

If you actually want to use VR you should use Windows. 99% percent of PC VR is done on Windows so be prepared for tons of problems if you try Linux or Mac.

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