#15346 closed defect (duplicate)

Crash in garbage collection

Reported by: chimerax-bug-report@… Owned by: Eric Pettersen
Priority: normal Milestone:
Component: Core Version:
Keywords: Cc: Tom Goddard
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

The following bug report has been submitted:
Platform:        Linux-6.5.0-35-generic-x86_64-with-glibc2.35
ChimeraX Version: 1.7.1 (2024-01-23 01:58:08 UTC)
Description
Last time you used ChimeraX it crashed.
Please describe steps that led to the crash here.
Fatal Python error: Segmentation fault

Thread 0x000070ffd9ffb640 (most recent call first):
  File "/usr/lib/ucsf-chimerax/lib/python3.11/threading.py", line 324 in wait
  File "/usr/lib/ucsf-chimerax/lib/python3.11/threading.py", line 622 in wait
  File "/usr/lib/ucsf-chimerax/lib/python3.11/threading.py", line 1392 in run
  File "/usr/lib/ucsf-chimerax/lib/python3.11/threading.py", line 1038 in _bootstrap_inner
  File "/usr/lib/ucsf-chimerax/lib/python3.11/threading.py", line 995 in _bootstrap

Current thread 0x00007100b824bb80 (most recent call first):
  Garbage-collecting
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/ast.py", line 90 in copy
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 642 in _try
  File "/usr/lib/ucsf-chimerax/lib/python3.11/contextlib.py", line 137 in __enter__
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 679 in _choice
  File "/usr/lib/ucsf-chimerax/lib/python3.11/contextlib.py", line 137 in __enter__
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/_atomspec.py", line 113 in _as_term_
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 497 in _invoke_rule
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 458 in _call
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 59 in wrapper
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/_atomspec.py", line 89 in _atom_specifier_
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 497 in _invoke_rule
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 458 in _call
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 59 in wrapper
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/_atomspec.py", line 93 in _atom_specifier_
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 497 in _invoke_rule
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 458 in _call
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 59 in wrapper
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/grako/contexts.py", line 206 in parse
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/atomspec.py", line 192 in _parse_unquoted
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/atomspec.py", line 121 in parse
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/std_commands/defattr.py", line 180 in defattr
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/add_charge/charge.py", line 81 in add_standard_charges
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/add_charge/charge.py", line 34 in add_charges
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/coulombic/coulombic.py", line 110 in assign_charges
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/coulombic/cmd.py", line 99 in cmd_coulombic
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/cli.py", line 2908 in run
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/commands/run.py", line 49 in run
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 525 in run
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 582 in run_expanded_command
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 72 in func_plus_tip
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 339 in run
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 420 in run_shortcut
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 402 in try_shortcut
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 1376 in run_provider
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/shortcuts/__init__.py", line 66 in run_provider
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/toolshed/__init__.py", line 1302 in run_provider
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/toolshed/info.py", line 397 in run_provider
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/toolbar/tool.py", line 205 in callback
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/ui/gui.py", line 275 in event_loop
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/__main__.py", line 918 in init
  File "/usr/lib/ucsf-chimerax/lib/python3.11/site-packages/chimerax/core/__main__.py", line 1069 in 
  File "", line 88 in _run_code
  File "", line 198 in _run_module_as_main

Extension modules: chimerax.arrays._arrays, numpy.core._multiarray_umath, numpy.core._multiarray_tests, numpy.linalg._umath_linalg, numpy.fft._pocketfft_internal, numpy.random._common, numpy.random.bit_generator, numpy.random._bounded_integers, numpy.random._mt19937, numpy.random.mtrand, numpy.random._philox, numpy.random._pcg64, numpy.random._sfc64, numpy.random._generator, chimerax.geometry._geometry, PyQt6.QtCore, PyQt6.QtGui, PyQt6.QtWidgets, PyQt6.QtWebChannel, PyQt6.QtNetwork, PyQt6.QtWebEngineCore, PyQt6.QtPrintSupport, PyQt6.QtWebEngineWidgets, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.pdb_lib._load_libs, chimerax.map._map, charset_normalizer.md, PIL._imaging, matplotlib._c_internal_utils, matplotlib._path, kiwisolver._cext, matplotlib._image, PyQt6.QtOpenGL, PyQt6.QtOpenGLWidgets, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.surface._surface, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, lz4._version, lz4.frame._frame, msgpack._cmsgpack, chimerax.core._serialize, numpy.linalg.lapack_lite, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.pdb._pdbio, lxml._elementpath, lxml.etree, PIL._imagingmath, chimerax.atom_search.ast, chimerax.chem_group._chem_group, chimerax.mmcif.mmcif_write (total: 62)
===== Log before crash start =====
Startup Messages  
---  
note | available bundle cache has not been initialized yet  
  
UCSF ChimeraX version: 1.7.1 (2024-01-23)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs
> format session

No such file/path:
/home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs  

> open /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs
> format session

No such file/path:
/home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs  

> open /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs
> format session

opened ChimeraX session  

> open /home/trung/Downloads/rebuild_sidechains.py

executed rebuild_sidechains.py  
Drag select of 6763 atoms, 6900 bonds  
Drag select of 6783 atoms, 6921 bonds  

> show (sel-residues & sidechain) target ab

> save selection

Cannot determine format for 'selection'  

> save altered_marked_labeled_aa format pdb displayedOnly true

> close session

> open /home/trung/Documents/eIF3I_project/altered_marked_labeled_aa

'/home/trung/Documents/eIF3I_project/altered_marked_labeled_aa' has no suffix  

> open /home/trung/altered_marked_labeled_aa format pdb

No such file/path: /home/trung/altered_marked_labeled_aa  

> open /home/trung/altered_marked_labeled_aa format pdb

No such file/path: /home/trung/altered_marked_labeled_aa  

> open /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs
> format session

opened ChimeraX session  

> save altered_marked_labeled_aa.cif format pdb displayedOnly true

> close session

> open /home/trung/Documents/eIF3I_project/altered_marked_labeled_aa.cif

mmCIF parsing error: unexpected data value near line 1  

> open /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs
> format session

opened ChimeraX session  

> save altered_marked_labeled_aa.pdb format pdb displayedOnly true

> close session

> open /home/trung/altered_marked_labeled_aa.pdb

Summary of feedback from opening /home/trung/altered_marked_labeled_aa.pdb  
---  
warnings | Start residue of secondary structure not found: HELIX 1 1 LEU 5 6
ALA 5 11 1 6  
Start residue of secondary structure not found: HELIX 2 2 ASP 5 15 GLU 5 30 1
16  
Start residue of secondary structure not found: HELIX 3 3 ASN 5 33 THR 5 48 1
16  
Start residue of secondary structure not found: HELIX 4 4 VAL 5 51 TYR 5 62 1
12  
Start residue of secondary structure not found: HELIX 5 5 PRO 5 67 GLU 5 96 1
30  
692 messages similar to the above omitted  
Cannot find LINK/SSBOND residue C (1218 )  
Cannot find LINK/SSBOND residue G (1862 )  
Cannot find LINK/SSBOND residue G (1490 )  
Cannot find LINK/SSBOND residue A (672 )  
Cannot find LINK/SSBOND residue JMH (1219 )  
122 messages similar to the above omitted  
  
Chain information for altered_marked_labeled_aa.pdb #1  
---  
Chain | Description  
7 | No description available  
F | No description available  
I | No description available  
  

> show atoms

> hide cartoons

> open /home/trung/Downloads/rebuild_sidechains.py

FYI: command is replacing existing command: "rebuildsidechains"  
executed rebuild_sidechains.py  

> rebuildsidechains #1

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 32 N; /F PRO 231
N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I
PRO 709 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 239 N; /F PRO 231 N; /F PRO
138 N; /F PRO 130 N; /F PRO 143 N; /F PRO 32 N; /F PRO 156 N; /I PRO 709 N; /F
PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 231 N; /F PRO
138 N; /F PRO 239 N; /F PRO 143 N; /F PRO 156 N; /F PRO 32 N; /F PRO 287 N; /F
PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 231 N; /F PRO
138 N; /F PRO 239 N; /F PRO 143 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /F
PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 32 N; /F PRO 231
N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I
PRO 709 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 239 N; /F PRO 231 N; /F PRO
138 N; /F PRO 130 N; /F PRO 32 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F
PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 32 N; /F PRO 231
N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F
PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 32 N; /F PRO 231
N; /F PRO 239 N; /F PRO 138 N; /F PRO 287 N; /F PRO 143 N; /F PRO 295 N; /F
PRO 156 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 231 N; /F PRO
138 N; /F PRO 239 N; /F PRO 32 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F
PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F PRO 231 N; /F PRO
138 N; /F PRO 239 N; /F PRO 143 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /F
PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 3 N; /F PRO 143 N; /F PRO 239 N; /F PRO
138 N; /F PRO 130 N; /F PRO 156 N; /F PRO 32 N; /F PRO 287 N; /F PRO 295 N; /F
PRO 231 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 316 N; /F PRO 130 N; /F PRO 143 N; /F PRO
138 N; /F PRO 239 N; /F PRO 156 N; /F PRO 3 N; /F PRO 32 N; /F PRO 287 N; /F
PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 316 N; /F PRO 130 N; /F PRO 143 N; /F PRO
32 N; /F PRO 138 N; /F PRO 239 N; /F PRO 156 N; /F PRO 3 N; /I PRO 709 N; /F
PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 3 N; /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 32
N; /F PRO 138 N; /F PRO 239 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /I
PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 32 N; /F PRO
138 N; /F PRO 239 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N;
/F PRO 3 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 3 N; /F PRO 231 N; /F PRO 239 N; /F PRO 143 N; /F PRO 32
N; /F PRO 138 N; /F PRO 130 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F
PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 316 N; /F PRO 130 N; /F PRO 143 N; /F PRO
32 N; /F PRO 138 N; /F PRO 239 N; /F PRO 156 N; /F PRO 287 N; /F PRO 3 N; /I
PRO 709 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 143 N; /F PRO 32 N; /F PRO
138 N; /F PRO 130 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N;
/F PRO 3 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 130 N; /F PRO 143 N; /F PRO
138 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 3 N; /F
PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 130 N; /F PRO 143 N; /F PRO
138 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N; /F
PRO 3 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 130 N; /F PRO 143 N; /F PRO
138 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N; /F PRO 295 N; /F
PRO 3 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 130 N; /F PRO 143 N; /F PRO
138 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 3 N; /I
PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 130 N; /F PRO 143 N; /F PRO
138 N; /F PRO 32 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N; /I
PRO 709 N; /F PRO 3 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 287 N; /F PRO
32 N; /F PRO 156 N; /F PRO 295 N; /F PRO 3 N; /I PRO 709 N; /F PRO 316 N; /F
PRO 231 N; /F PRO 130 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 3 N; /F PRO 138 N; /F PRO 143 N; /F PRO 287 N; /F PRO 32
N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N; /I PRO 709 N; /F PRO 231 N; /F
PRO 239 N; /F PRO 130 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO
287 N; /F PRO 32 N; /F PRO 156 N; /F PRO 295 N; /F PRO 3 N; /F PRO 316 N; /I
PRO 709 N; /F PRO 130 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 138 N; /F PRO 143 N; /F PRO 287 N; /F PRO
32 N; /F PRO 156 N; /F PRO 295 N; /F PRO 3 N; /I PRO 709 N; /F PRO 231 N; /F
PRO 239 N; /F PRO 130 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 287 N; /F PRO
32 N; /F PRO 156 N; /F PRO 295 N; /I PRO 709 N; /F PRO 316 N; /F PRO 231 N; /F
PRO 3 N; /F PRO 130 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO
287 N; /F PRO 32 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N; /I PRO 709 N; /F
PRO 130 N; /F PRO 3 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N; /F PRO
156 N; /F PRO 32 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N; /I PRO 709 N; /F
PRO 3 N; /F PRO 130 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 295 N; /F PRO 287 N; /F PRO 32 N; /F PRO
156 N; /F PRO 316 N; /F PRO 3 N; /I PRO 709 N; /F PRO 231 N; /F PRO 239 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 32 N; /F PRO 143 N; /F PRO
287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N; /F PRO 3 N; /F PRO 130 N; /F
PRO 138 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 295 N; /F PRO 287 N; /F PRO 32 N; /F PRO
156 N; /F PRO 316 N; /F PRO 3 N; /I PRO 709 N; /F PRO 231 N; /F PRO 239 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 32 N; /F PRO 143 N; /F PRO
287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N; /I PRO 709 N; /F PRO 3 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 32 N; /F PRO 143 N; /F PRO
287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N; /I PRO 709 N; /F PRO 130 N;
/F PRO 138 N; /F PRO 3 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 3 N; /F PRO 143 N; /F PRO 295 N; /F PRO 287 N; /F PRO 32
N; /F PRO 156 N; /F PRO 316 N; /I PRO 709 N; /F PRO 231 N; /F PRO 239 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 32 N; /I PRO 709 N; /F PRO 287 N; /F PRO
295 N; /F PRO 156 N; /F PRO 316 N; /F PRO 231 N; /F PRO 3 N; /F PRO 239 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 32 N; /I PRO 709 N; /F PRO
287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 3 N; /F PRO 316 N; /F PRO 130 N; /F
PRO 138 N; /F PRO 143 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 32 N; /F PRO 287 N; /F PRO 295 N; /F PRO
316 N; /F PRO 156 N; /I PRO 709 N; /F PRO 231 N; /F PRO 239 N; /F PRO 3 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO
295 N; /F PRO 316 N; /F PRO 287 N; /F PRO 3 N; /F PRO 130 N; /F PRO 32 N; /F
PRO 138 N; /F PRO 143 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 295 N; /F PRO
316 N; /F PRO 287 N; /F PRO 130 N; /F PRO 3 N; /F PRO 231 N; /F PRO 138 N; /F
PRO 143 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 295 N; /F PRO
316 N; /F PRO 287 N; /F PRO 231 N; /F PRO 239 N; /F PRO 3 N; /F PRO 130 N; /F
PRO 138 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 295 N; /F PRO
316 N; /F PRO 287 N; /F PRO 130 N; /F PRO 138 N; /F PRO 231 N; /F PRO 143 N;
/F PRO 3 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /F PRO 156 N; /F PRO 3 N; /F PRO 295 N; /F PRO
316 N; /F PRO 287 N; /I PRO 709 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N;
/F PRO 143 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 295 N; /F PRO
316 N; /F PRO 287 N; /F PRO 231 N; /F PRO 239 N; /F PRO 3 N; /F PRO 130 N; /F
PRO 138 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 295 N; /F PRO
316 N; /F PRO 287 N; /F PRO 3 N; /F PRO 231 N; /F PRO 32 N; /F PRO 239 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 231 N; /F PRO
295 N; /F PRO 316 N; /I PRO 709 N; /F PRO 239 N; /F PRO 3 N; /F PRO 32 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 3 N; /F PRO
295 N; /F PRO 316 N; /I PRO 709 N; /F PRO 231 N; /F PRO 32 N; /F PRO 130 N; /F
PRO 239 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 3 N; /F PRO 287 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 239 N; /F PRO 130 N; /F PRO 138 N; /F PRO 143 N;
/F PRO 156 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 3 N; /F PRO 239 N; /F PRO 130 N; /F PRO 138 N; /F
PRO 143 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 3 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 231 N; /F PRO 130 N; /F PRO 239 N; /F PRO 138 N;
/F PRO 143 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /F PRO 287 N; /F PRO 3 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 231 N;
/F PRO 156 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 231 N; /F PRO
295 N; /F PRO 316 N; /I PRO 709 N; /F PRO 239 N; /F PRO 3 N; /F PRO 130 N; /F
PRO 138 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 231 N; /F PRO
295 N; /F PRO 316 N; /I PRO 709 N; /F PRO 239 N; /F PRO 3 N; /F PRO 32 N; /F
PRO 130 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 130 N; /F PRO 239 N; /F PRO 138 N; /F PRO 143 N;
/F PRO 3 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 239 N; /F PRO 130 N; /F PRO 138 N; /F PRO 3 N; /F
PRO 143 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 130 N; /F PRO 295 N; /F PRO
316 N; /I PRO 709 N; /F PRO 231 N; /F PRO 3 N; /F PRO 138 N; /F PRO 239 N; /F
PRO 143 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 3 N; /F PRO
295 N; /F PRO 316 N; /I PRO 709 N; /F PRO 231 N; /F PRO 239 N; /F PRO 130 N;
/F PRO 32 N; /F PRO 138 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 3 N; /F PRO 231 N; /F PRO
295 N; /F PRO 316 N; /F PRO 130 N; /F PRO 239 N; /F PRO 138 N; /F PRO 32 N; /F
PRO 143 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 287 N; /F PRO 239 N; /F PRO 231 N; /F PRO
295 N; /F PRO 316 N; /F PRO 130 N; /F PRO 3 N; /F PRO 138 N; /F PRO 143 N; /I
PRO 709 N; /F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 287 N; /F PRO 239 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /F PRO 130 N; /F PRO 32 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /I
PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 287 N; /F PRO 130 N; /F PRO 138 N; /F PRO 295 N; /F PRO
316 N; /F PRO 143 N; /F PRO 156 N; /F PRO 231 N; /F PRO 239 N; /F PRO 32 N; /I
PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 287 N; /F PRO 239 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /F PRO 130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 287 N; /F PRO 130 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /F PRO 138 N; /F PRO 143 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 287 N; /F PRO 130 N; /F PRO 231 N; /F PRO 295 N; /F PRO
316 N; /F PRO 138 N; /F PRO 143 N; /F PRO 239 N; /F PRO 156 N; /F PRO 32 N; /I
PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 32 N; /F PRO 156 N; /I PRO 709 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 138 N; /F PRO 316 N; /F PRO
231 N; /F PRO 143 N; /F PRO 239 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 287 N; /F PRO 138 N; /F PRO 143 N; /I PRO 709 N; /F PRO 156 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 231 N; /F PRO 316 N; /F PRO
239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 32 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
316 N; /F PRO 239 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 32 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 287 N; /I PRO 709 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 231 N; /F PRO 316 N; /F PRO
239 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 32 N; /I PRO 709 N; /F PRO 156 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
316 N; /F PRO 143 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 32 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 156 N; /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO
316 N; /F PRO 130 N; /F PRO 287 N; /F PRO 138 N; /F PRO 143 N; /F PRO 32 N; /I
PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
287 N; /F PRO 130 N; /F PRO 138 N; /I PRO 709 N; /F PRO 143 N; /F PRO 156 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
316 N; /F PRO 156 N; /F PRO 231 N; /F PRO 239 N; /I PRO 709 N; /F PRO 32 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /I PRO 709 N; /F PRO 32 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
316 N; /F PRO 239 N; /F PRO 143 N; /I PRO 709 N; /F PRO 156 N; /F PRO 32 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N;
/F PRO 32 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 32 N; /F
PRO 287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 239 N; /F PRO 231 N; /F PRO 316 N; /F PRO
130 N; /F PRO 138 N; /F PRO 143 N; /F PRO 287 N; /F PRO 156 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 143 N; /F PRO 138 N; /F PRO 130 N; /F PRO
231 N; /F PRO 156 N; /F PRO 239 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 239 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 239 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 143 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 138 N; /F PRO 143 N; /F PRO 295 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 138 N; /F PRO 143 N; /F PRO 295 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 143 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 138 N; /F PRO 295 N; /F PRO 143 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 143 N; /F PRO 138 N; /F PRO 130 N; /F PRO
231 N; /F PRO 156 N; /F PRO 239 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /F PRO
287 N; /F PRO 138 N; /F PRO 295 N; /F PRO 143 N; /I PRO 709 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 239 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /F PRO
287 N; /F PRO 138 N; /F PRO 295 N; /F PRO 143 N; /I PRO 709 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO
130 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 138 N; /F PRO 287 N; /F PRO 143 N; /F PRO 295 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 239 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 138 N; /F PRO 143 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /F PRO
287 N; /F PRO 138 N; /F PRO 295 N; /F PRO 143 N; /I PRO 709 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 239 N; /I PRO
709 N; /F PRO 138 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO
130 N; /F PRO 239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 287 N; /F PRO 156 N; /I PRO 709 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 239 N; /F PRO 231 N; /F PRO 138 N; /F PRO
130 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /F PRO 130 N; /F PRO 231 N; /F PRO 138 N; /F PRO
239 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 295 N; /F PRO 138 N; /F PRO 143 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /I PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 143 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 143 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /F PRO 156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 239 N; /F PRO 138 N; /F PRO
130 N; /F PRO 156 N; /F PRO 287 N; /I PRO 709 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 143 N; /F PRO 287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /F PRO 287 N; /I PRO 709 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /F PRO 287 N; /I PRO 709 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 143 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /F PRO 287 N; /I PRO 709 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /F PRO 143 N; /F PRO 138 N; /F PRO
239 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 239 N; /F PRO 138 N; /F PRO
130 N; /I PRO 709 N; /F PRO 156 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 130 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 295 N; /F PRO 138 N; /F PRO 143 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO 239 N; /F PRO
287 N; /F PRO 295 N; /F PRO 156 N; /I PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO 239 N; /F PRO
156 N; /I PRO 709 N; /F PRO 287 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 138 N; /F PRO 143 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 138 N; /F PRO 239 N; /I PRO
709 N; /F PRO 287 N; /F PRO 156 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 143 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 143 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 295 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /F PRO 143 N; /F PRO 156 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 143 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 156 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 156 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 156 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 295 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 316 N; /F PRO 156 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 287 N; /F PRO 239 N; /I PRO
709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /I PRO 709 N; /F PRO 239 N; /F PRO
287 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 231 N; /F PRO 295 N; /F PRO 239 N; /F PRO 316 N; /F PRO
287 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /I PRO 709 N; /F PRO 295 N; /F PRO 316 N; /F PRO
287 N; /F PRO 231 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 239 N; /I PRO 709 N; /F PRO 295 N; /F PRO 316 N; /F PRO
287 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 287 N; /F PRO 295 N; /F PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 295 N; /F PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /I PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /I PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /I PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /F PRO 316 N; /I PRO 709 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /I PRO 709 N; /F PRO 316 N  

The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /I PRO 709 N  

> select /F:11

11 atoms, 10 bonds, 1 residue, 1 model selected  

> style sel ball

Changed 11 atom styles  

> style sel stick

Changed 11 atom styles  

> select /F,I,7

7932 atoms, 8138 bonds, 977 residues, 1 model selected  

> style sel ball

Changed 7932 atom styles  

> color sel bychain

> select /I

4746 atoms, 4877 bonds, 575 residues, 1 model selected  

> color sel #26a269ff

> color sel #1c71d8ff

> color sel #62a0eaff

> color sel #b5835aff

> color sel #cdab8fff

> color sel #63452cff

> color sel #865e3cff

> color sel #986a44ff

> color sel #f66151ff

> color sel #dc8addff

> color sel #ffbe6fff

> color sel #f9f06bff

> color sel #8ff0a4ff

> color sel #99c1f1ff

> select /7

616 atoms, 628 bonds, 77 residues, 1 model selected  

> color sel #cdab8fff

> select /F

2570 atoms, 2633 bonds, 325 residues, 1 model selected  

> color sel #9a9996ff

> color sel #c0bfbcff

> select /F:1-39

322 atoms, 329 bonds, 39 residues, 1 model selected  

> color sel cyan

> select /F:43-81

304 atoms, 312 bonds, 39 residues, 1 model selected  

> color sel purple

> color sel #c061cbff

> color sel #9141acff

> color sel #c061cbff

> select /F:135-175

309 atoms, 316 bonds, 41 residues, 1 model selected  

> color sel white

> select /F:221-267

361 atoms, 367 bonds, 47 residues, 1 model selected  

> color sel yellow

> select /F:1-39

322 atoms, 329 bonds, 39 residues, 1 model selected  

> color sel #9141acff

> color sel #c061cbff

> select /F:43-81

304 atoms, 312 bonds, 39 residues, 1 model selected  

> color sel #33d17aff

> color sel #2ec27eff

> color sel #26a269ff

> color sel #8ff0a4ff

> color sel #57e389ff

> color sel #33d17aff

> color sel #2ec27eff

> select /F:135-175

309 atoms, 316 bonds, 41 residues, 1 model selected  

> color sel #3584e4ff

> color sel #62a0eaff

> color sel #3584e4ff

> select /F:221-267

361 atoms, 367 bonds, 47 residues, 1 model selected  
Drag select of 7 atoms, 6 bonds  

> save /home/trung/Desktop/image1.png supersample 3

> ui tool show "Color Actions"

> select ~sel & ##selected

7925 atoms, 8132 bonds, 977 residues, 1 model selected  

> select /F

2570 atoms, 2633 bonds, 325 residues, 1 model selected  

> save /home/trung/Documents/eIF3I_project/marked_altered_WD.cxs

> color sel #dedddaff

> color sel #c0bfbcff

> select /F:11

11 atoms, 10 bonds, 1 residue, 1 model selected  

> color sel red

> color sel crimson

> color sel red

> color sel orange red

> color sel tomato

> color sel fire brick

> color sel crimson

> color sel orange red

> color sel red

> color sel dark red

> color sel maroon

> color sel fire brick

> color sel chocolate

> color sel plum

> color sel pink

> color sel peach puff

> color sel light coral

> color sel red

> color sel salmon

> color sel crimson

> color sel orange red

> label sel text "{0.name} {0.number}{0.insertion_code}"

> color sel orange red target acspfl

> color sel crimson target acspfl

> color sel orange red target acspfl

> color sel black target l

> color sel dark green target l

> color sel blanched almond target l

> color sel light coral target l

> color sel sky blue target l

> set bgColor light coral

> set bgColor black

> color sel light gray target l

> color sel silver target l

> color sel light gray target l

> color sel light slate gray target l

> color sel slate gray target l

> color sel white target l

> select /F:258

7 atoms, 6 bonds, 1 residue, 1 model selected  

> color sel goldenrod

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:233

8 atoms, 7 bonds, 1 residue, 1 model selected  

> color sel blue violet

> color sel medium orchid

> color sel orchid

> color sel dark violet

> color sel dark orchid

> color sel dark magenta

> color sel dark orchid

> color sel medium purple

> label sel text "/{0.chain_id} {0.name} {0.number}{0.insertion_code}"

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:248

4 atoms, 3 bonds, 1 residue, 1 model selected  

> color sel cyan

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:53

4 atoms, 3 bonds, 1 residue, 1 model selected  

> color sel magenta

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:268

11 atoms, 10 bonds, 1 residue, 1 model selected  

> color sel black

> color sel silver

> color sel dark gray

> color sel gray

> color sel dim gray

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:148

9 atoms, 8 bonds, 1 residue, 1 model selected  

> color sel light salmon

> color sel salmon

> color sel coral

> label sel text "{0.name} {0.number}{0.insertion_code}"

> save /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs

> select /F:268

11 atoms, 10 bonds, 1 residue, 1 model selected  

> view sel

> ui mousemode right "clip rotate"

> ui mousemode right clip

> ui mousemode right zone

> zone /F:268

> zone label false

> zone /F:268 residueDistance 3.84 labelDistance 3.07 surfaceDistance 6.14

> zone /F:268 residueDistance 2.95 labelDistance 2.36 surfaceDistance 4.72

> zone /F:268 residueDistance 2.26 labelDistance 1.81 surfaceDistance 3.62

> zone /F:278

> zone label false

> zone clear

> zone /F:266

> zone /F:266 residueDistance 1.74 labelDistance 1.39 surfaceDistance 2.78

> zone label false

> zone clear

> ui mousemode right clip

> ui mousemode right "clip rotate"

> ui mousemode right zoom

> ui mousemode right translate

> ui mousemode right rotate

> undo

> close session

> open /home/trung/Documents/eIF3I_project/marked_altered_aa_labeled.cxs
> format session

opened ChimeraX session  

> select /F:268

11 atoms, 10 bonds, 1 residue, 1 model selected  

> view sel

> color sel navy

> color sel light slate gray

> color sel slate gray

> color sel dark slate gray

> ui mousemode right translate

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:268 lys

Using Dunbrack library  
/F ARG 268: phi -111.5, psi 117.4 trans  
Applying LYS rotamer (chi angles: -62.9 -178.0 -76.1 -68.7) to /F LYS 268  

> select /F:268

9 atoms, 8 bonds, 1 residue, 1 model selected  

> label sel text "{0.name} {0.number}{0.insertion_code}"

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:268 arg

Using Dunbrack library  
/F LYS 268: phi -111.5, psi 117.4 trans  
Applying ARG rotamer (chi angles: -74.0 78.3 178.4 -85.5) to /F ARG 268  

> select /F:11

11 atoms, 10 bonds, 1 residue, 1 model selected  

> view sel

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:11 gln

Using Dunbrack library  
/F ARG 11: phi -150.2, psi -167.2 trans  
Applying GLN rotamer (chi angles: -61.6 -68.6 -66.4) to /F GLN 11  

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:11

9 atoms, 8 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:11 arg

Using Dunbrack library  
/F GLN 11: phi -150.2, psi -167.2 trans  
Applying ARG rotamer (chi angles: -62.9 -70.4 -174.8 -87.3) to /F ARG 11  

> select /F:258

7 atoms, 6 bonds, 1 residue, 1 model selected  

> view sel

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:258 ala

Using Dunbrack library  
Swapping /F THR 258 to ALA  

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:258

5 atoms, 4 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:258 thr

Using Dunbrack library  
/F ALA 258: phi -158.6, psi 165.4 trans  
Applying THR rotamer (chi angles: -169.8) to /F THR 258  

> select /F:233

8 atoms, 7 bonds, 1 residue, 1 model selected  

> view sel

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:233 ser

Using Dunbrack library  
/F ASN 233: phi -76.1, psi -18.3 trans  
Applying SER rotamer (chi angles: 67.5) to /F SER 233  

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:233

6 atoms, 5 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:233 ile

Using Dunbrack library  
/F SER 233: phi -76.1, psi -18.3 trans  
Applying ILE rotamer (chi angles: -162.6 64.7) to /F ILE 233  

> select /F:233

8 atoms, 7 bonds, 1 residue, 1 model selected  

> color sel yellow

> color sel gold

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:233 asn

Using Dunbrack library  
/F ILE 233: phi -76.1, psi -18.3 trans  
Applying ASN rotamer (chi angles: 63.3 27.8) to /F ASN 233  

> select /F:248

4 atoms, 3 bonds, 1 residue, 1 model selected  

> view sel

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:248 asp

Using Dunbrack library  
/F GLY 248: phi 164.6, psi -166.6 trans  
Applying ASP rotamer (chi angles: -169.0 52.4) to /F ASP 248  

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:248

8 atoms, 7 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:248 gly

Using Dunbrack library  
Swapping /F ASP 248 to GLY  

> select /F:53

4 atoms, 3 bonds, 1 residue, 1 model selected  

> view sel

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:248 arg

Using Dunbrack library  
/F GLY 248: phi 164.6, psi -166.6 trans  
Applying ARG rotamer (chi angles: -179.0 66.6 177.7 173.0) to /F ARG 248  

> swapaa /F:248 gly

Using Dunbrack library  
Swapping /F ARG 248 to GLY  

> swapaa /F:53 arg

Using Dunbrack library  
/F GLY 53: phi -160.7, psi 176.8 trans  
Applying ARG rotamer (chi angles: -178.9 69.7 177.6 173.2) to /F ARG 53  

> save /home/trung/Desktop/image1.png supersample 3

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:53

11 atoms, 10 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:53 gly

Using Dunbrack library  
Swapping /F ARG 53 to GLY  

> swapaa /F:53 arg

Using Dunbrack library  
/F GLY 53: phi -160.7, psi 176.8 trans  
Applying ARG rotamer (chi angles: -178.9 69.7 177.6 173.2) to /F ARG 53  

> select /F:268

11 atoms, 10 bonds, 1 residue, 1 model selected  

> swapaa /F:53 gly

Using Dunbrack library  
Swapping /F ARG 53 to GLY  

> view sel

> save /home/trung/Desktop/image1.png supersample 3

> select /F:148

9 atoms, 8 bonds, 1 residue, 1 model selected  

> view sel

> save /home/trung/Desktop/image2.png supersample 3

> swapaa /F:148 thr

Using Dunbrack library  
/F LYS 148: phi -62.2, psi 142.1 trans  
Applying THR rotamer (chi angles: -60.1) to /F THR 148  

> save /home/trung/Desktop/image1.png supersample 3

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /F:148

7 atoms, 6 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> swapaa /F:148 lys

Using Dunbrack library  
/F THR 148: phi -62.2, psi 142.1 trans  
Applying LYS rotamer (chi angles: -67.4 -178.7 -179.6 179.2) to /F LYS 148  

> select /F:148

9 atoms, 8 bonds, 1 residue, 1 model selected  

> save /home/trung/Desktop/image1.png supersample 3

> select /F

2570 atoms, 2633 bonds, 325 residues, 1 model selected  

> view sel

> ui tool show "Side View"

> open /home/trung/Documents/eIF3I_project/8oz0.cif

8oz0.cif title:  
Structure of a human 48S translation initiation complex with eIF4F and eIF4A
[more info...]  
  
Chain information for 8oz0.cif #2  
---  
Chain | Description | UniProt  
1 3 | Eukaryotic initiation factor 4A-I | IF4A1_HUMAN 1-406  
2 | Eukaryotic translation initiation factor 4 gamma 1 | IF4G1_HUMAN 196-1599  
5 | Eukaryotic translation initiation factor 3 subunit E | EIF3E_HUMAN 1-445  
6 | Eukaryotic translation initiation factor 3 subunit F | EIF3F_HUMAN 1-357  
7 | Eukaryotic translation initiation factor 3 subunit G | EIF3G_HUMAN 1-320  
8 | Eukaryotic translation initiation factor 3 subunit H | EIF3H_HUMAN 1-352  
9 | 60S ribosomal protein L41 | RL41_HUMAN 1-25  
A | Eukaryotic translation initiation factor 3 subunit A | EIF3A_HUMAN 1-1382  
B | Eukaryotic translation initiation factor 3 subunit K | EIF3K_HUMAN 1-218  
C | Eukaryotic translation initiation factor 3 subunit M | EIF3M_HUMAN 1-374  
D | Eukaryotic translation initiation factor 2 subunit 1 | IF2A_HUMAN 1-315  
E | Eukaryotic translation initiation factor 2 subunit 3 | IF2G_HUMAN 1-472  
F | Eukaryotic translation initiation factor 3 subunit I | EIF3I_HUMAN 1-325  
G | Eukaryotic translation initiation factor 1A, X-chromosomal | IF1AX_HUMAN
1-144  
H | Eukaryotic translation initiation factor 5 | IF5_HUMAN 1-431  
I | Eukaryotic translation initiation factor 3 subunit B | EIF3B_HUMAN 1-814  
J | Eukaryotic translation initiation factor 3 subunit C | EIF3C_HUMAN 1-913  
K | Eukaryotic translation initiation factor 3 subunit L | EIF3L_HUMAN 1-564  
L | 40S ribosomal protein S7 | RS7_HUMAN 1-194  
M | 40S ribosomal protein S27 | RS27_HUMAN 1-84  
N | 40S ribosomal protein S21 | RS21_HUMAN 1-83  
O | 40S ribosomal protein S2 | RS2_HUMAN 1-293  
P | 40S ribosomal protein S3a | RS3A_HUMAN 1-264  
Q | 40S ribosomal protein SA | RSSA_HUMAN 1-295  
R | 40S ribosomal protein S26 | RS26_HUMAN 1-115  
S | 40S ribosomal protein S6 | RS6_HUMAN 1-249  
T | 40S ribosomal protein S14 | RS14_HUMAN 1-151  
U | Eukaryotic translation initiation factor 2 subunit 2 | IF2B_HUMAN 1-333  
V | 40S ribosomal protein S13 | RS13_HUMAN 1-151  
W | 18S rRNA |  
X | 40S ribosomal protein S11 | RS11_HUMAN 1-158  
Y | 40S ribosomal protein S4, X isoform | RS4X_HUMAN 1-263  
Z | 40S ribosomal protein S9 | RS9_HUMAN 1-194  
a | 40S ribosomal protein S23 | RS23_HUMAN 1-143  
b | 40S ribosomal protein S30 | RS30_HUMAN 75-133  
c | 40S ribosomal protein S15a | RS15A_HUMAN 1-130  
d | 40S ribosomal protein S8 | RS8_HUMAN 1-208  
e | 40S ribosomal protein S24 | RS24_HUMAN 1-133  
f | 40S ribosomal protein S5 | RS5_HUMAN 1-204  
g | 40S ribosomal protein S16 | RS16_HUMAN 1-146  
h | 40S ribosomal protein S3 | RS3_HUMAN 1-243  
i | 40S ribosomal protein S10 | RS10_HUMAN 1-165  
j | 40S ribosomal protein S15 | RS15_HUMAN 1-145  
k | Receptor of activated protein C kinase 1 | RACK1_HUMAN 1-317  
l | 40S ribosomal protein S19 | RS19_HUMAN 1-145  
m | 40S ribosomal protein S25 | RS25_HUMAN 1-125  
n | Small ribosomal subunit protein uS13 | RS18_HUMAN 1-151  
o | 40S ribosomal protein S29 | RS29_HUMAN 1-56  
p | Ubiquitin-40S ribosomal protein S27a | RS27A_HUMAN 1-156  
q | 40S ribosomal protein S12 | RS12_HUMAN 1-132  
s | 40S ribosomal protein S28 | RS28_HUMAN 1-69  
v | 40S ribosomal protein S17 | RS17_HUMAN 1-135  
w | 40S ribosomal protein S20 | RS20_HUMAN 1-119  
x | Eukaryotic translation initiation factor 3 subunit D | EIF3D_HUMAN 1-548  
y | tRNAiMet |  
z | mRNA |  
  
Non-standard residues in 8oz0.cif #2  
---  
5MC — 5-methylcytidine-5'-monophosphate  
5MU — 5-methyluridine 5'-monophosphate  
6MZ — N6-methyladenosine-5'-monophosphate  
A2M — 2'-O-methyladenosine 5'-(dihydrogen phosphate)  
C4J —
(5S)-5-{3-[(3S)-3-amino-3-carboxypropyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl}-2,5-anhydro-1-O-phosphono-
L-arabinitol  
JMH — 3-Methylcytidine- 5'-monophosphate  
MA6 — 6N-dimethyladenosine-5'-monophoshate  
MG — magnesium ion  
OMC — O2'-methylycytidine-5'-monophosphate  
OMG — O2'-methylguanosine-5'-monophosphate  
OMU — O2'-methyluridine 5'-monophosphate  
UR3 — 3-methyluridine-5'-monophoshate  
ZN — zinc ion  
  

> style sel ball

Changed 2570 atom styles  
Drag select of 15633 atoms, 7295 bonds, 1 pseudobonds  

> style sel ball

Changed 15633 atom styles  

> view sel

Drag select of 110730 atoms, 16896 bonds, 1531 pseudobonds  

> style sel ball

Changed 110730 atom styles  

> view sel

Drag select of 129542 atoms, 116338 bonds, 1649 pseudobonds  

> style sel ball

Changed 129542 atom styles  

> select add #2

129542 atoms, 135369 bonds, 1649 pseudobonds, 14772 residues, 5 models
selected  

> select subtract #2

7932 atoms, 8138 bonds, 977 residues, 1 model selected  

> select add #2

129542 atoms, 135369 bonds, 1649 pseudobonds, 14772 residues, 5 models
selected  

> select subtract #2

7932 atoms, 8138 bonds, 977 residues, 1 model selected  

> select add #1

7932 atoms, 8138 bonds, 977 residues, 2 models selected  

> select add #2

129542 atoms, 135369 bonds, 1649 pseudobonds, 14772 residues, 6 models
selected  

> hide #!1 models

> show #!1 models

> hide #!1 models

> show #!1 models

> select #2/F

1598 atoms, 1597 bonds, 325 residues, 1 model selected  

> style sel sphere

Changed 1598 atom styles  

> style sel ball

Changed 1598 atom styles  

> style sel stick

Changed 1598 atom styles  

> select #2

121610 atoms, 127231 bonds, 1649 pseudobonds, 13795 residues, 4 models
selected  

> style sel stick

Changed 121610 atom styles  

> style sel sphere

Changed 121610 atom styles  

> style sel sphere

Changed 121610 atom styles  

> style sel ball

Changed 121610 atom styles  

> select #2

121610 atoms, 127231 bonds, 1649 pseudobonds, 13795 residues, 4 models
selected  

> style sel stick

Changed 121610 atom styles  

> select #2/F

1598 atoms, 1597 bonds, 325 residues, 1 model selected  

> hide sel atoms

> interfaces select & ~solvent

Missing or invalid "atoms" argument: invalid atoms specifier  

> show sel cartoons

> hide sel cartoons

> hide #2.1 models

> show #2.1 models

> hide #2.1 models

> show #2.1 models

> hide #2.2 models

> show #2.2 models

> hide #2.3 models

> show #2.3 models

> hide #2.3 models

> show #2.3 models

> select #2/W:1248

28 atoms, 29 bonds, 1 residue, 1 model selected  

> view sel

> select #1/F,I

7316 atoms, 7510 bonds, 900 residues, 1 model selected  

> view sel

> hbonds sel reveal true

124 atoms were skipped as donors/acceptors due to missing heavy-atom bond
partners  

1880 hydrogen bonds found  

> swapaa #1/F:268 lys

Using Dunbrack library  
altered_marked_labeled_aa.pdb #1/F ARG 268: phi -111.5, psi 117.4 trans  
Applying LYS rotamer (chi angles: -62.9 -178.0 -76.1 -68.7) to
altered_marked_labeled_aa.pdb #1/F LYS 268  

> hbonds sel reveal true

124 atoms were skipped as donors/acceptors due to missing heavy-atom bond
partners  

1881 hydrogen bonds found  

> swapaa #1/F:268 arg

Using Dunbrack library  
altered_marked_labeled_aa.pdb #1/F LYS 268: phi -111.5, psi 117.4 trans  
Applying ARG rotamer (chi angles: -74.0 78.3 178.4 -85.5) to
altered_marked_labeled_aa.pdb #1/F ARG 268  

> hbonds sel reveal true

124 atoms were skipped as donors/acceptors due to missing heavy-atom bond
partners  

1880 hydrogen bonds found  

> close session

> open /home/trung/Documents/eIF3I_project/AF-Q13347-F1-model_v4.cif

Chain information for AF-Q13347-F1-model_v4.cif #1  
---  
Chain | Description | UniProt  
A | Eukaryotic translation initiation factor 3 subunit I | EIF3I_HUMAN 1-325  
  
Color AF-Q13347-F1-model_v4.cif by residue attribute pLDDT_score  

> hide cartoons

> show atoms

> select ~sel & ##selected

Nothing selected  

> select /A:53

4 atoms, 3 bonds, 1 residue, 1 model selected  

> color sel magenta

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /A:148

9 atoms, 8 bonds, 1 residue, 1 model selected  

> color sel coral

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /A:233

8 atoms, 7 bonds, 1 residue, 1 model selected  

> color sel dark magenta

> color sel dark orchid

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /A:248

4 atoms, 3 bonds, 1 residue, 1 model selected  

> color sel cyan

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /A:258

7 atoms, 6 bonds, 1 residue, 1 model selected  

> color sel dark salmon

> color sel chartreuse

> color sel dark salmon

> color sel salmon

> color sel coral

> color sel orange

> color sel dark orange

> color sel goldenrod

> color sel sandy brown

> color sel orange

> color sel orange red

> color sel tomato

> color sel coral

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /A:148

9 atoms, 8 bonds, 1 residue, 1 model selected  

> color sel orange red

> select /A:268

11 atoms, 10 bonds, 1 residue, 1 model selected  

> color sel dim gray

> label sel text "{0.name} {0.number}{0.insertion_code}"

> select /A:11

11 atoms, 10 bonds, 1 residue, 1 model selected  

> color sel crimson

> color sel fire brick

> color sel red

> label sel text "{0.name} {0.number}{0.insertion_code}"

> save
> /home/trung/Documents/eIF3I_project/AF-Q13347-F1-model_v4_altered_aa_labeled.cif
> relModel #1

> close session

> open /home/trung/Downloads/5a5u.cif

Summary of feedback from opening /home/trung/Downloads/5a5u.cif  
---  
warnings | Atom CG1 is not in the residue template for UNK /A:674  
Atom CD is not in the residue template for UNK /A:675  
Atom CD is not in the residue template for UNK /A:676  
Atom CD1 is not in the residue template for UNK /A:677  
Atom CD is not in the residue template for UNK /A:678  
Atom CD is not in the residue template for UNK /A:679  
Atom CD is not in the residue template for UNK /A:680  
Atom CD is not in the residue template for UNK /A:681  
Atom CD is not in the residue template for UNK /A:682  
1 messages similar to the above omitted  
Atom CD1 is not in the residue template for UNK /A:684  
Atom CD is not in the residue template for UNK /A:685  
Atom CD is not in the residue template for UNK /A:686  
Atom CD is not in the residue template for UNK /A:687  
Atom CD1 is not in the residue template for UNK /A:688  
Atom CD is not in the residue template for UNK /A:689  
Atom OD1 is not in the residue template for UNK /A:690  
Atom CD is not in the residue template for UNK /A:691  
Atom CD is not in the residue template for UNK /A:692  
Atom CD is not in the residue template for UNK /A:693  
Atom CD is not in the residue template for UNK /A:694  
Atom CG1 is not in the residue template for UNK /A:695  
Atom OD1 is not in the residue template for UNK /A:696  
Atom CD1 is not in the residue template for UNK /A:697  
Atom CD1 is not in the residue template for UNK /A:698  
Atom CD is not in the residue template for UNK /A:699  
Atom CD is not in the residue template for UNK /A:700  
Atom CD is not in the residue template for UNK /A:702  
Atom CD is not in the residue template for UNK /A:703  
Atom CD1 is not in the residue template for UNK /A:704  
Atom CD is not in the residue template for UNK /A:705  
Atom CG1 is not in the residue template for UNK /A:710  
  
5a5u.cif title:  
Structure of mammalian eIF3 in the context of the 43S preinitiation complex
[more info...]  
  
Chain information for 5a5u.cif #1  
---  
Chain | Description | UniProt  
A | EUKARYOTIC INITIATION FACTOR 3 |  
B | EUKARYOTIC TRANSLATION INITIATION FACTOR 3 SUBUNIT B | G1SZ03_RABIT 42-717  
I | EUKARYOTIC TRANSLATION INITIATION FACTOR 3 SUBUNIT I | EIF3I_YEAST 1-347  
  

> hide cartoons

> show atoms

> color bychain

> select ~sel & ##selected

Nothing selected  

> select /I:11

11 atoms, 10 bonds, 1 residue, 1 model selected  

> view sel

> select /I,B,A

8124 atoms, 8323 bonds, 1009 residues, 1 model selected  

> view sel

> color bfactor sel

8124 atoms, 1009 residues, atom bfactor range 0 to 103  

> color sel byhetero

> color bfactor sel

8124 atoms, 1009 residues, atom bfactor range 0 to 103  

> select /I:11

11 atoms, 10 bonds, 1 residue, 1 model selected  

> coulombic sel


===== Log before crash end =====

Log:
Startup Messages  
---  
note | available bundle cache has not been initialized yet  
  
UCSF ChimeraX version: 1.7.1 (2024-01-23)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open /home/trung/Downloads/5a5u.cif

Summary of feedback from opening /home/trung/Downloads/5a5u.cif  
---  
warnings | Atom CG1 is not in the residue template for UNK /A:674  
Atom CD is not in the residue template for UNK /A:675  
Atom CD is not in the residue template for UNK /A:676  
Atom CD1 is not in the residue template for UNK /A:677  
Atom CD is not in the residue template for UNK /A:678  
Atom CD is not in the residue template for UNK /A:679  
Atom CD is not in the residue template for UNK /A:680  
Atom CD is not in the residue template for UNK /A:681  
Atom CD is not in the residue template for UNK /A:682  
1 messages similar to the above omitted  
Atom CD1 is not in the residue template for UNK /A:684  
Atom CD is not in the residue template for UNK /A:685  
Atom CD is not in the residue template for UNK /A:686  
Atom CD is not in the residue template for UNK /A:687  
Atom CD1 is not in the residue template for UNK /A:688  
Atom CD is not in the residue template for UNK /A:689  
Atom OD1 is not in the residue template for UNK /A:690  
Atom CD is not in the residue template for UNK /A:691  
Atom CD is not in the residue template for UNK /A:692  
Atom CD is not in the residue template for UNK /A:693  
Atom CD is not in the residue template for UNK /A:694  
Atom CG1 is not in the residue template for UNK /A:695  
Atom OD1 is not in the residue template for UNK /A:696  
Atom CD1 is not in the residue template for UNK /A:697  
Atom CD1 is not in the residue template for UNK /A:698  
Atom CD is not in the residue template for UNK /A:699  
Atom CD is not in the residue template for UNK /A:700  
Atom CD is not in the residue template for UNK /A:702  
Atom CD is not in the residue template for UNK /A:703  
Atom CD1 is not in the residue template for UNK /A:704  
Atom CD is not in the residue template for UNK /A:705  
Atom CG1 is not in the residue template for UNK /A:710  
  
5a5u.cif title:  
Structure of mammalian eIF3 in the context of the 43S preinitiation complex
[more info...]  
  
Chain information for 5a5u.cif #1  
---  
Chain | Description | UniProt  
A | EUKARYOTIC INITIATION FACTOR 3 |  
B | EUKARYOTIC TRANSLATION INITIATION FACTOR 3 SUBUNIT B | G1SZ03_RABIT 42-717  
I | EUKARYOTIC TRANSLATION INITIATION FACTOR 3 SUBUNIT I | EIF3I_YEAST 1-347  
  

> show atoms

> hide cartoons

> select /I:11

11 atoms, 10 bonds, 1 residue, 1 model selected  




OpenGL version: 3.3.0 NVIDIA 470.239.06
OpenGL renderer: Quadro K4200/PCIe/SSE2
OpenGL vendor: NVIDIA Corporation

Python: 3.11.2
Locale: en_US.UTF-8
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: xcb

XDG_SESSION_TYPE=x11
DESKTOP_SESSION=ubuntu
XDG_SESSION_DESKTOP=ubuntu
XDG_CURRENT_DESKTOP=ubuntu:GNOME
DISPLAY=:1
Manufacturer: Dell Inc.
Model: Precision Tower 5810
OS: Ubuntu 22.04 Jammy Jellyfish
Architecture: 64bit ELF
Virtual Machine: none
CPU: 12 Intel(R) Xeon(R) CPU E5-1650 v3 @ 3.50GHz
Cache Size: 15360 KB
Memory:
	               total        used        free      shared  buff/cache   available
	Mem:            31Gi       6.5Gi        19Gi       207Mi       5.3Gi        24Gi
	Swap:           15Gi          0B        15Gi

Graphics:
	03:00.0 VGA compatible controller [0300]: NVIDIA Corporation GK104GL [Quadro K4200] [10de:11b4] (rev a1)	
	Subsystem: NVIDIA Corporation GK104GL [Quadro K4200] [10de:1096]	
	Kernel driver in use: nvidia

Installed Packages:
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    asttokens: 2.4.1
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    beautifulsoup4: 4.11.2
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    blosc2: 2.0.0
    build: 0.10.0
    certifi: 2023.11.17
    cftime: 1.6.3
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    ChimeraX-AddCharge: 1.5.13
    ChimeraX-AddH: 2.2.5
    ChimeraX-AlignmentAlgorithms: 2.0.1
    ChimeraX-AlignmentHdrs: 3.4.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.12.2
    ChimeraX-AlphaFold: 1.0
    ChimeraX-AltlocExplorer: 1.1.1
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.1
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    ChimeraX-AxesPlanes: 2.3.2
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
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    ChimeraX-BondRot: 2.0.4
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    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.2.2
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
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    ChimeraX-ChangeChains: 1.1
    ChimeraX-CheckWaters: 1.3.2
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.2.4
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    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.5
    ChimeraX-CommandLine: 1.2.5
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.7.1
    ChimeraX-CoreFormats: 1.2
    ChimeraX-coulombic: 1.4.2
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
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    ChimeraX-Dicom: 1.2
    ChimeraX-DistMonitor: 1.4
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    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ESMFold: 1.0
    ChimeraX-FileHistory: 1.0.1
    ChimeraX-FunctionKey: 1.0.1
    ChimeraX-Geometry: 1.3
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.1.1
    ChimeraX-Hbonds: 2.4
    ChimeraX-Help: 1.2.2
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-Label: 1.1.8
    ChimeraX-LinuxSupport: 1.0.1
    ChimeraX-ListInfo: 1.2.2
    ChimeraX-Log: 1.1.6
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.9.1
    ChimeraX-Map: 1.1.4
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0.1
    ChimeraX-MapFilter: 2.0.1
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.1.1
    ChimeraX-Markers: 1.0.1
    ChimeraX-Mask: 1.0.2
    ChimeraX-MatchMaker: 2.1.2
    ChimeraX-MCopy: 1.0
    ChimeraX-MDcrds: 2.6.1
    ChimeraX-MedicalToolbar: 1.0.2
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
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    ChimeraX-PDB: 2.7.3
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    ChimeraX-PDBMatrices: 1.0
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    ChimeraX-Topography: 1.0
    ChimeraX-ToQuest: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.33.3
    ChimeraX-uniprot: 2.3
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.3.2
    ChimeraX-VIPERdb: 1.0
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    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.3
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    funcparserlib: 2.0.0a0
    glfw: 2.6.4
    grako: 3.16.5
    h5py: 3.10.0
    html2text: 2020.1.16
    idna: 3.6
    ihm: 0.38
    imagecodecs: 2023.9.18
    imagesize: 1.4.1
    ipykernel: 6.23.2
    ipython: 8.14.0
    ipython-genutils: 0.2.0
    ipywidgets: 8.1.1
    jedi: 0.18.2
    Jinja2: 3.1.2
    jupyter-client: 8.2.0
    jupyter-core: 5.7.1
    jupyterlab-widgets: 3.0.9
    kiwisolver: 1.4.5
    line-profiler: 4.0.2
    lxml: 4.9.2
    lz4: 4.3.2
    MarkupSafe: 2.1.4
    matplotlib: 3.7.2
    matplotlib-inline: 0.1.6
    msgpack: 1.0.4
    nest-asyncio: 1.6.0
    netCDF4: 1.6.2
    networkx: 3.1
    nibabel: 5.0.1
    nptyping: 2.5.0
    numexpr: 2.8.8
    numpy: 1.25.1
    openvr: 1.23.701
    packaging: 23.2
    ParmEd: 3.4.3
    parso: 0.8.3
    pep517: 0.13.0
    pexpect: 4.9.0
    pickleshare: 0.7.5
    pillow: 10.2.0
    pip: 23.0
    pkginfo: 1.9.6
    platformdirs: 4.1.0
    prompt-toolkit: 3.0.43
    psutil: 5.9.5
    ptyprocess: 0.7.0
    pure-eval: 0.2.2
    py-cpuinfo: 9.0.0
    pycollada: 0.7.2
    pydicom: 2.3.0
    Pygments: 2.16.1
    pynrrd: 1.0.0
    PyOpenGL: 3.1.7
    PyOpenGL-accelerate: 3.1.7
    pyopenxr: 1.0.2801
    pyparsing: 3.0.9
    pyproject-hooks: 1.0.0
    PyQt6-commercial: 6.3.1
    PyQt6-Qt6: 6.3.2
    PyQt6-sip: 13.4.0
    PyQt6-WebEngine-commercial: 6.3.1
    PyQt6-WebEngine-Qt6: 6.3.2
    python-dateutil: 2.8.2
    pytz: 2023.3.post1
    pyzmq: 25.1.2
    qtconsole: 5.4.3
    QtPy: 2.4.1
    RandomWords: 0.4.0
    requests: 2.31.0
    scipy: 1.11.1
    setuptools: 67.4.0
    sfftk-rw: 0.7.3
    six: 1.16.0
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    soupsieve: 2.5
    sphinx: 6.1.3
    sphinx-autodoc-typehints: 1.22
    sphinxcontrib-applehelp: 1.0.8
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 1.0.6
    sphinxcontrib-htmlhelp: 2.0.5
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.7
    sphinxcontrib-serializinghtml: 1.1.10
    stack-data: 0.6.3
    superqt: 0.5.0
    tables: 3.8.0
    tcia-utils: 1.5.1
    tifffile: 2023.7.18
    tinyarray: 1.2.4
    tomli: 2.0.1
    tornado: 6.4
    traitlets: 5.9.0
    typing-extensions: 4.9.0
    tzdata: 2023.4
    urllib3: 2.1.0
    wcwidth: 0.2.13
    webcolors: 1.12
    wheel: 0.38.4
    wheel-filename: 1.4.1
    widgetsnbextension: 4.0.9

Change History (2)

comment:1 by Eric Pettersen, 17 months ago

Cc: Tom Goddard added
Component: UnassignedCore
Owner: set to Eric Pettersen
Platform: all
Project: ChimeraX
Status: newaccepted
Summary: ChimeraX bug report submissionCrash in garbage collection

comment:2 by Eric Pettersen, 17 months ago

Resolution: duplicate
Status: acceptedclosed
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