﻿id	summary	reporter	owner	description	type	status	priority	milestone	component	version	resolution	keywords	cc	blockedby	blocking	notify_on_close	platform	project
14506	Crash in garbage collection	pett@…	Eric Pettersen	"{{{
The following bug report has been submitted:
Platform:        macOS-14.2.1-arm64-arm-64bit
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: Bus error

Thread 0x000000030363f000 (most recent call first):
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 324 in wait
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 622 in wait
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1392 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x0000000302633000 (most recent call first):
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 324 in wait
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 622 in wait
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1392 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Current thread 0x00000001d80dd000 (most recent call first):
  Garbage-collecting
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/molarray.py"", line 161 in 
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/molarray.py"", line 161 in __iter__
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/hbonds/hbond.py"", line 774 in _find_acceptors
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/hbonds/hbond.py"", line 498 in find_hbonds
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/hbonds/cmd.py"", line 94 in cmd_hbonds
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py"", line 2908 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py"", line 3468 in __call__
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py"", line 2929 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/run.py"", line 49 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/scripting.py"", line 184 in _run_commands
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/runscript.py"", line 61 in run_command_script
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/runscript.py"", line 51 in runscript
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py"", line 2908 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/cmd_line/tool.py"", line 319 in execute
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/cmd_line/tool.py"", line 146 in keyPressEvent
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py"", line 275 in event_loop
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 918 in init
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/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.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, chimerax.pdb_lib._load_libs, PIL._imagingmath, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, chimerax.pdb._pdbio, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.atom_search.ast, chimerax.chem_group._chem_group, chimerax.coulombic._esp, chimerax.mlp._mlp (total: 57)


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===== Log before crash start =====
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  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults W173

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W173/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
4 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W173/W173_contacts_hbonds.jpg""
> supersample 2

Cannot save '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W173/W173_contacts_hbonds.jpg':
[Errno 70] Stale NFS file handle: '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W173/W173_contacts_hbonds.jpg'  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults W181

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
4 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg""
> supersample 2

Cannot save '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg':
[Errno 70] Stale NFS file handle: '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg'  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults W181

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
4 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg""
> supersample 2

Cannot save '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg':
[Errno 70] Stale NFS file handle: '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg'  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults W181

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
4 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg""
> supersample 2

Cannot save '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg':
[Errno 70] Stale NFS file handle: '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg'  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults W181

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
4 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg""
> supersample 2

Cannot save '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg':
[Errno 70] Stale NFS file handle: '/Users/neyrinck/Google Drive/My
Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults/W181/W181_contacts_hbonds.jpg'  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> AF122

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF122/best_model.pdb""

Cannot open files: [Errno 60] Operation timed out  

> runscript /Users/neyrinck/Dropbox/notebook/proteins/makepictures.cxc

> alias picmovie view orient ; save ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3.jpg"" supersample 2 ; movie record ; turn y 2 180 ; wait
> 180 ; movie encode ""/Users/neyrinck/Google Drive/My
> Drive/$1/$2/$2_$3_rot.mp4""

> alias makepicture close ; set bgColor white ; windowsize 480 480 ;open
> ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model.pdb"" ; alphafold pae
> #1 file ""/Users/neyrinck/Google Drive/My Drive/$1/$2/best_model_pae.json"" ;
> view orient ; sequence chain #1/A ; sequence chain #1/B ;color bychain ;
> color /A indianred ; color /B royalblue ; alphafold contacts /A to /B
> palette paegreen ; hbonds /A reveal true restrict /B color fuchsia radius
> 0.8 dashes 2 ; picmovie $1 $2 contacts_hbonds ; style sphere ; show atoms ;
> picmovie $1 $2 sphere ; style nucleic stick ; hide atoms ; coulombic key
> true ; picmovie $1 $2 coulombic ; style nucleic stick ; hide atoms ; mlp key
> true ; picmovie $1 $2 hydrophobic

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> AF122

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF122/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
5 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF122/AF122_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF122/AF122_contacts_hbonds_rot.mp4  
  
Changed 8618 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF122/AF122_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF122/AF122_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -24.67, mean
-4.45, maximum 15.72  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -14.64, mean
-0.38, maximum 11.56  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF122/AF122_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF122/AF122_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -27.89, mean
-5.06, maximum 23.83  
Map values for surface ""best_model.pdb_B SES surface"": minimum -28.22, mean
-4.673, maximum 23.95  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF122/AF122_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF122/AF122_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> AF182

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF182/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
10 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF182/AF182_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF182/AF182_contacts_hbonds_rot.mp4  
  
Changed 7870 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF182/AF182_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF182/AF182_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -25.41, mean
-4.28, maximum 18.51  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -21.53, mean
-2.50, maximum 8.95  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF182/AF182_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF182/AF182_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -30.69, mean
-5.172, maximum 25.37  
Map values for surface ""best_model.pdb_B SES surface"": minimum -28.23, mean
-5.938, maximum 21.78  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AF182/AF182_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AF182/AF182_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> AG123

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG123/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
1 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG123/AG123_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG123/AG123_contacts_hbonds_rot.mp4  
  
Changed 8313 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG123/AG123_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG123/AG123_sphere_rot.mp4  
  
Changed 0 atom styles  
Exception ignored in tp_clear of:   
Traceback (most recent call last):  
File
""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/atomic/molarray.py"", line 161, in   
self._object_list = [c.c_ptr_to_py_inst(p) for p in self._pointers]  
^^^^^^^^^^^^^^^^^^^^^  
TypeError: NoneType takes no arguments  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -18.51, mean
-0.84, maximum 14.74  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -17.17, mean
-0.75, maximum 13.58  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG123/AG123_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG123/AG123_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -30.62, mean
-6.387, maximum 26.65  
Map values for surface ""best_model.pdb_B SES surface"": minimum -27.46, mean
-1.412, maximum 24.61  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG123/AG123_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG123/AG123_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> AG172

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG172/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
1 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG172/AG172_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG172/AG172_contacts_hbonds_rot.mp4  
  
Changed 7440 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG172/AG172_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG172/AG172_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -17.63, mean
-0.66, maximum 13.56  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -11.30, mean
-0.42, maximum 13.19  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG172/AG172_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG172/AG172_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -30.18, mean
-6.405, maximum 25.47  
Map values for surface ""best_model.pdb_B SES surface"": minimum -27.92, mean
-1.069, maximum 22.69  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG172/AG172_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG172/AG172_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> AG185

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG185/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
21 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG185/AG185_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG185/AG185_contacts_hbonds_rot.mp4  
  
Changed 8884 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG185/AG185_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG185/AG185_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -21.18, mean
-1.04, maximum 24.85  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -13.87, mean
0.51, maximum 20.70  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG185/AG185_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG185/AG185_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -31.84, mean
-6.422, maximum 27.62  
Map values for surface ""best_model.pdb_B SES surface"": minimum -28.14, mean
-5.46, maximum 22.87  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/AG185/AG185_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../AG185/AG185_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> T123

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T123/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
2 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T123/T123_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T123/T123_contacts_hbonds_rot.mp4  
  
Changed 3522 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T123/T123_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T123/T123_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -20.06, mean
-2.88, maximum 11.81  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -14.95, mean
-0.67, maximum 14.16  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T123/T123_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T123/T123_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -25.56, mean
-5.424, maximum 22.49  
Map values for surface ""best_model.pdb_B SES surface"": minimum -30.2, mean
-1.372, maximum 24.34  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T123/T123_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T123/T123_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> T128

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T128/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
Exception ignored in tp_clear of:   
Traceback (most recent call last):  
File
""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/atomic/molarray.py"", line 161, in   
self._object_list = [c.c_ptr_to_py_inst(p) for p in self._pointers]  
^^^^^^^^^^^^^^^^^^^^^  
TypeError: NoneType takes no arguments  
0 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T128/T128_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T128/T128_contacts_hbonds_rot.mp4  
  
Changed 4102 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T128/T128_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T128/T128_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -18.14, mean
-3.19, maximum 12.44  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -13.21, mean
1.95, maximum 21.27  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T128/T128_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T128/T128_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -25.49, mean
-5.152, maximum 22.32  
Map values for surface ""best_model.pdb_B SES surface"": minimum -26.95, mean
-1.046, maximum 24.12  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/T128/T128_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../T128/T128_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> U110

> key lipophilicity :-20 :0 :20 white: white: white: white: white: white:
> white: white: white: white:

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U110/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
0 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U110/U110_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U110/U110_contacts_hbonds_rot.mp4  
  
Changed 671 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U110/U110_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U110/U110_sphere_rot.mp4  
  
Changed 0 atom styles  
Exception ignored in tp_clear of:   
Traceback (most recent call last):  
File
""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/grako/ast.py"", line 59, in update  
def upairs(d):  
TypeError: NoneType takes no arguments  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -16.21, mean
-5.66, maximum 8.34  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -11.94, mean
-1.25, maximum 8.75  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U110/U110_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U110/U110_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -24.43, mean
-4.109, maximum 24.15  
Map values for surface ""best_model.pdb_B SES surface"": minimum -22.87, mean
-3.776, maximum 25.35  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U110/U110_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U110/U110_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> U126

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U126/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
3 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U126/U126_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U126/U126_contacts_hbonds_rot.mp4  
  
Changed 3648 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U126/U126_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U126/U126_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -17.88, mean
-5.58, maximum 10.28  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -16.59, mean
0.10, maximum 12.63  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U126/U126_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U126/U126_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -25.53, mean
-4.704, maximum 23.87  
Map values for surface ""best_model.pdb_B SES surface"": minimum -29.31, mean
-4.227, maximum 23.19  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U126/U126_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U126/U126_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> U127

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U127/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
11 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U127/U127_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U127/U127_contacts_hbonds_rot.mp4  
  
Changed 3769 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U127/U127_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U127/U127_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -25.55, mean
-7.54, maximum 9.34  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -15.49, mean
-1.52, maximum 18.02  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U127/U127_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U127/U127_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -29.54, mean
-4.686, maximum 21.33  
Map values for surface ""best_model.pdb_B SES surface"": minimum -29.63, mean
-5.687, maximum 23.3  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U127/U127_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U127/U127_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> U168

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U168/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
Exception ignored in tp_clear of:   
Traceback (most recent call last):  
File
""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/geometry/matrix.py"", line 33, in apply_matrix  
r = matrix_multiply(points, transpose(tf[:, :3]))  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
TypeError: NoneType takes no arguments  
8 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U168/U168_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U168/U168_contacts_hbonds_rot.mp4  
  
Changed 7517 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U168/U168_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U168/U168_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -26.29, mean
-6.88, maximum 11.42  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -27.34, mean
-3.20, maximum 11.62  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U168/U168_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U168/U168_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -29.78, mean
-4.178, maximum 24.02  
Map values for surface ""best_model.pdb_B SES surface"": minimum -28.65, mean
-5.09, maximum 23.77  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U168/U168_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U168/U168_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> U181

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U181/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
5 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U181/U181_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U181/U181_contacts_hbonds_rot.mp4  
  
Changed 8811 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U181/U181_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U181/U181_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -17.51, mean
-5.36, maximum 10.83  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -22.93, mean
-0.07, maximum 18.91  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U181/U181_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U181/U181_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -24.06, mean
-3.834, maximum 20.12  
Map values for surface ""best_model.pdb_B SES surface"": minimum -28.14, mean
-3.16, maximum 24.29  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/U181/U181_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../U181/U181_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> V139

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V139/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
13 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V139/V139_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V139/V139_contacts_hbonds_rot.mp4  
  
Changed 6417 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V139/V139_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V139/V139_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -15.63, mean
-1.93, maximum 18.79  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -19.55, mean
-2.60, maximum 11.98  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V139/V139_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V139/V139_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -30.7, mean
-5.511, maximum 22.83  
Map values for surface ""best_model.pdb_B SES surface"": minimum -30.93, mean
-5.365, maximum 24.34  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V139/V139_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V139/V139_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> V142

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V142/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
6 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V142/V142_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V142/V142_contacts_hbonds_rot.mp4  
  
Changed 7491 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V142/V142_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V142/V142_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -17.17, mean
-1.14, maximum 17.41  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -17.17, mean
1.17, maximum 20.04  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V142/V142_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V142/V142_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -27.59, mean
-5.329, maximum 21.93  
Map values for surface ""best_model.pdb_B SES surface"": minimum -30.22, mean
-3.754, maximum 24.74  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V142/V142_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V142/V142_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> V143

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V143/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
11 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V143/V143_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V143/V143_contacts_hbonds_rot.mp4  
  
Changed 7562 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V143/V143_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V143/V143_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -17.31, mean
-1.24, maximum 18.49  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -20.42, mean
0.45, maximum 19.37  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V143/V143_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V143/V143_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -28.81, mean
-5.284, maximum 21.46  
Map values for surface ""best_model.pdb_B SES surface"": minimum -30.01, mean
-3.498, maximum 25.47  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V143/V143_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V143/V143_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> V173

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V173/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
5 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V173/V173_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V173/V173_contacts_hbonds_rot.mp4  
  
Changed 6995 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V173/V173_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V173/V173_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -20.55, mean
-2.48, maximum 17.12  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -16.14, mean
-0.35, maximum 17.74  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V173/V173_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V173/V173_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -24.15, mean
-4.967, maximum 27.85  
Map values for surface ""best_model.pdb_B SES surface"": minimum -32.62, mean
-4.467, maximum 25.2  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V173/V173_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V173/V173_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> V181

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V181/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
1 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V181/V181_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V181/V181_contacts_hbonds_rot.mp4  
  
Changed 9108 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V181/V181_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V181/V181_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -19.93, mean
-1.17, maximum 16.60  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -20.19, mean
-0.13, maximum 16.80  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V181/V181_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V181/V181_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -26.24, mean
-5.43, maximum 22.03  
Map values for surface ""best_model.pdb_B SES surface"": minimum -29.84, mean
-3.222, maximum 27.55  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/V181/V181_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../V181/V181_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> W123

> key lipophilicity :-20 :0 :20 white:

> key darkcyan:-20 white:0 darkgoldenrod:20 white: white:

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W123/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
0 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W123/W123_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W123/W123_contacts_hbonds_rot.mp4  
  
Changed 3494 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W123/W123_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W123/W123_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -20.12, mean
-3.52, maximum 8.53  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -24.87, mean
-0.67, maximum 11.88  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W123/W123_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W123/W123_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -27.02, mean
-6.604, maximum 22.22  
Map values for surface ""best_model.pdb_B SES surface"": minimum -27.4, mean
-1.407, maximum 24.07  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W123/W123_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W123/W123_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> W135

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W135/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
1 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W135/W135_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W135/W135_contacts_hbonds_rot.mp4  
  
Changed 4940 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W135/W135_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W135/W135_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -22.35, mean
-4.28, maximum 8.59  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -23.99, mean
0.69, maximum 17.52  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W135/W135_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W135/W135_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -33.07, mean
-6.808, maximum 22.97  
Map values for surface ""best_model.pdb_B SES surface"": minimum -29.32, mean
-2.714, maximum 24.53  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W135/W135_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W135/W135_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> W139

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W139/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
10 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W139/W139_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W139/W139_contacts_hbonds_rot.mp4  
  
Changed 6397 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W139/W139_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W139/W139_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -19.85, mean
-5.49, maximum 7.56  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -34.76, mean
-2.90, maximum 13.36  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W139/W139_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W139/W139_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -26.99, mean
-6.956, maximum 22.21  
Map values for surface ""best_model.pdb_B SES surface"": minimum -34.58, mean
-5.318, maximum 23.88  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W139/W139_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W139/W139_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> W142

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W142/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
3 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W142/W142_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W142/W142_contacts_hbonds_rot.mp4  
  
Changed 7471 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W142/W142_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W142/W142_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -21.38, mean
-4.72, maximum 10.92  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -16.31, mean
1.27, maximum 19.35  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W142/W142_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W142/W142_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -28.4, mean
-6.661, maximum 21.77  
Map values for surface ""best_model.pdb_B SES surface"": minimum -32.41, mean
-3.752, maximum 24.66  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W142/W142_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W142/W142_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> W143

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W143/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
6 hydrogen bonds found  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W143/W143_contacts_hbonds.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W143/W143_contacts_hbonds_rot.mp4  
  
Changed 7542 atom styles  

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W143/W143_sphere.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W143/W143_sphere_rot.mp4  
  
Changed 0 atom styles  
Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.3: minimum, -19.48, mean
-4.31, maximum 10.66  
Coulombic values for best_model.pdb_B SES surface #1.4: minimum, -20.19, mean
0.44, maximum 20.10  

> key red-white-blue :-10 :0 :10 showTool true

> ui mousemode right ""color key""

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W143/W143_coulombic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W143/W143_coulombic_rot.mp4  
  
Changed 0 atom styles  
Map values for surface ""best_model.pdb_A SES surface"": minimum -34.86, mean
-6.835, maximum 21.92  
Map values for surface ""best_model.pdb_B SES surface"": minimum -29.08, mean
-3.558, maximum 24.54  

> key lipophilicity :-20 :0 :20 showTool true

> save ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W143/W143_hydrophobic.jpg""
> supersample 2

Movie saved to /Users/neyrinck/.../W143/W143_hydrophobic_rot.mp4  
  

> makepicture 0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy
> W168

> ui mousemode right translate

> open ""/Users/neyrinck/Google Drive/My
> Drive/0_DUF1220_202208_howard/0_AlphaFold_results/0_MarksResults_copy/W168/best_model.pdb""

Chain information for best_model.pdb #1  
---  
Chain | Description  
A | No description available  
B | No description available  
  
Alignment identifier is 1/A  
Alignment identifier is 1/B  
Exception ignored in tp_clear of:   
Traceback (most recent call last):  
File
""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/atomic/molarray.py"", line 161, in   
self._object_list = [c.c_ptr_to_py_inst(p) for p in self._pointers]  
^^^^^^^^^^^^^^^^^^^^^  
TypeError: NoneType takes no arguments  


===== Log before crash end =====

Log:
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  




OpenGL version: 4.1 Metal - 88
OpenGL renderer: Apple M1 Max
OpenGL vendor: Apple

Python: 3.11.2
Locale: UTF-8
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: MacBook Pro
      Model Identifier: MacBookPro18,2
      Model Number: Z14W00106LL/A
      Chip: Apple M1 Max
      Total Number of Cores: 10 (8 performance and 2 efficiency)
      Memory: 32 GB
      System Firmware Version: 10151.61.4
      OS Loader Version: 10151.61.4

Software:

    System Software Overview:

      System Version: macOS 14.2.1 (23C71)
      Kernel Version: Darwin 23.2.0
      Time since boot: 16 hours, 31 minutes

Graphics/Displays:

    Apple M1 Max:

      Chipset Model: Apple M1 Max
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 24
      Vendor: Apple (0x106b)
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-in Liquid Retina XDR Display
          Resolution: 3456 x 2234 Retina
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal


Installed Packages:
    alabaster: 0.7.16
    appdirs: 1.4.4
    appnope: 0.1.3
    asttokens: 2.4.1
    Babel: 2.14.0
    backcall: 0.2.0
    beautifulsoup4: 4.11.2
    blockdiag: 3.0.0
    blosc2: 2.0.0
    build: 0.10.0
    certifi: 2022.12.7
    cftime: 1.6.3
    charset-normalizer: 3.3.2
    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
    ChimeraX-Atomic: 1.49.1
    ChimeraX-AtomicLibrary: 12.1.5
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.3.2
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 2.1.2
    ChimeraX-BondRot: 2.0.4
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.10.5
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.2.2
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.3.2
    ChimeraX-ChangeChains: 1.1
    ChimeraX-CheckWaters: 1.3.2
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.2.4
    ChimeraX-ColorActions: 1.0.3
    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
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.3
    ChimeraX-Dicom: 1.2
    ChimeraX-DistMonitor: 1.4
    ChimeraX-DockPrep: 1.1.3
    ChimeraX-Dssp: 2.0
    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-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
    ChimeraX-mmCIF: 2.12.1
    ChimeraX-MMTF: 2.2
    ChimeraX-Modeller: 1.5.14
    ChimeraX-ModelPanel: 1.4
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0.3
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.2
    ChimeraX-MouseModes: 1.2
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.1
    ChimeraX-NRRD: 1.1
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.13.1
    ChimeraX-PDB: 2.7.3
    ChimeraX-PDBBio: 1.0.1
    ChimeraX-PDBLibrary: 1.0.4
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0.1
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.1
    ChimeraX-PubChem: 2.1
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.2
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.1
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.2
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 4.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.5.1
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0.2
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.11
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.1.1
    ChimeraX-ShowSequences: 1.0.2
    ChimeraX-SideView: 1.0.1
    ChimeraX-Smiles: 2.1.2
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.12.4
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.1.2
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.2.2
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-TaskManager: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.1.2
    ChimeraX-ToolshedUtils: 1.2.4
    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
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-vrml: 1.0
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.3
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.2.1
    contourpy: 1.2.0
    cxservices: 1.2.2
    cycler: 0.12.1
    Cython: 0.29.33
    debugpy: 1.8.0
    decorator: 5.1.1
    docutils: 0.19
    executing: 2.0.1
    filelock: 3.9.0
    fonttools: 4.47.2
    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: 21.3
    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
    setuptools-scm: 7.0.5
    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

}}}
"	defect	closed	normal		Core		fixed		Tom Goddard Greg Couch			yakonfire@yahoo.com	all	ChimeraX
