﻿id	summary	reporter	owner	description	type	status	priority	milestone	component	version	resolution	keywords	cc	blockedby	blocking	notify_on_close	platform	project
16723	Crash on Mac waking from sleep	chimerax-bug-report@…	Tom Goddard	"{{{
The following bug report has been submitted:
Platform:        macOS-13.2-arm64-arm-64bit
ChimeraX Version: 1.9 (2024-12-11 19:11:19 UTC)
Description
Last time you used ChimeraX it crashed.
This is a known crash that we are unable to fix. Here is information that may help you avoid this crash. The Qt window toolkit crashed due to a display configuration change, typically when waking from sleep or when an external display is disconnected or connected. This has only been seen on Mac computers. We hope a newer version of Qt will fix it. We update ChimeraX daily builds whenever a new Qt is released. You can check here https://www.cgl.ucsf.edu/chimerax/docs/troubleshoot.html#macdisplay to see if it has been fixed in a newer ChimeraX.
Fatal Python error: Segmentation fault

Current thread 0x00000001f6ad4100 (most recent call first):
  File ""/Applications/ChimeraX-1.9.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py"", line 330 in event_loop
  File ""/Applications/ChimeraX-1.9.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 1054 in init
  File ""/Applications/ChimeraX-1.9.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 1217 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.QtNetwork, PyQt6.QtPrintSupport, PyQt6.QtWebChannel, PyQt6.QtWebEngineCore, PyQt6.QtWebEngineWidgets, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.map._map, charset_normalizer.md, requests.packages.charset_normalizer.md, requests.packages.chardet.md, PIL._imaging, kiwisolver._cext, chimerax.pdb_lib._load_libs, chimerax.surface._surface, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.pdb._pdbio, PIL._imagingmath, chimerax.alignment_algs._sw, chimerax.dssp._dssp, chimerax.alignment_algs._nw, lz4._version, lz4.frame._frame, msgpack._cmsgpack, chimerax.core._serialize, psutil._psutil_osx, psutil._psutil_posix, PyQt6.QtOpenGL, PyQt6.QtOpenGLWidgets, cython.cimports.libc.math, scipy._lib._ccallback_c, scipy.linalg._fblas, scipy.linalg._flapack, scipy.linalg.cython_lapack, scipy.linalg._cythonized_array_utils, scipy.linalg._solve_toeplitz, scipy.linalg._decomp_lu_cython, scipy.linalg._matfuncs_sqrtm_triu, scipy.linalg.cython_blas, scipy.linalg._matfuncs_expm, scipy.linalg._decomp_update, scipy.sparse._sparsetools, _csparsetools, scipy.sparse._csparsetools, scipy.sparse.linalg._dsolve._superlu, scipy.sparse.linalg._eigen.arpack._arpack, scipy.sparse.linalg._propack._spropack, scipy.sparse.linalg._propack._dpropack, scipy.sparse.linalg._propack._cpropack, scipy.sparse.linalg._propack._zpropack, scipy.sparse.csgraph._tools, scipy.sparse.csgraph._shortest_path, scipy.sparse.csgraph._traversal, scipy.sparse.csgraph._min_spanning_tree, scipy.sparse.csgraph._flow, scipy.sparse.csgraph._matching, scipy.sparse.csgraph._reordering, scipy.optimize._group_columns, scipy._lib.messagestream, scipy.optimize._trlib._trlib, scipy.optimize._lbfgsb, _moduleTNC, scipy.optimize._moduleTNC, scipy.optimize._cobyla, scipy.optimize._slsqp, scipy.optimize._minpack, scipy.optimize._lsq.givens_elimination, scipy.optimize._zeros, scipy.optimize._highs.cython.src._highs_wrapper, scipy.optimize._highs._highs_wrapper, scipy.optimize._highs.cython.src._highs_constants, scipy.optimize._highs._highs_constants, scipy.linalg._interpolative, scipy.optimize._bglu_dense, scipy.optimize._lsap, scipy.spatial._ckdtree, scipy.spatial._qhull, scipy.spatial._voronoi, scipy.spatial._distance_wrap, scipy.spatial._hausdorff, scipy.special._ufuncs_cxx, scipy.special._ufuncs, scipy.special._specfun, scipy.special._comb, scipy.special._ellip_harm_2, scipy.spatial.transform._rotation, scipy.optimize._direct, lxml._elementpath, lxml.etree (total: 121)


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===== Log before crash start =====
Startup Messages  
---  
note | available bundle cache has not been initialized yet  
  
UCSF ChimeraX version: 1.9 (2024-12-11)  
© 2016-2024 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open /Users/nezakoritnik/Desktop/HCPro-struktura/monomerhcpro.cif

Summary of feedback from opening /Users/nezakoritnik/Desktop/HCPro-
struktura/monomerhcpro.cif  
---  
warnings | Unknown polymer entity '1' on line 131  
Missing or incomplete sequence information. Inferred polymer connectivity.  
  
  
Chain information for monomerhcpro.cif #1  
---  
Chain | Description  
Ab | No description available  
  

> set bgColor white

> open ""/Users/nezakoritnik/Documents/REZULTATI/Bioinformatske
> analize/AlphaFold/ALFAFOLD3/PVA-
> HCPro_2024_05_09_pva_hcpro/fold_2024_05_09_pva_hcpro_model_0.cif""

Chain information for fold_2024_05_09_pva_hcpro_model_0.cif #2  
---  
Chain | Description  
A | .  
  
Computing secondary structure  

> ui tool show Matchmaker

> matchmaker #2 to #1

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 1127.3  
RMSD between 151 pruned atom pairs is 0.771 angstroms; (across all 261 pairs:
36.016)  
  

> ui tool show Matchmaker

> ui tool show ""Show Sequence Viewer""

> sequence chain #1/Ab

Alignment identifier is 1/Ab  

> select #1/Ab:102

11 atoms, 11 bonds, 1 residue, 1 model selected  

> select #1/Ab:102-174

584 atoms, 594 bonds, 73 residues, 1 model selected  

> ui tool show Matchmaker

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 342  
RMSD between 63 pruned atom pairs is 0.737 angstroms; (across all 73 pairs:
2.555)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 342  
RMSD between 63 pruned atom pairs is 0.737 angstroms; (across all 73 pairs:
2.555)  
  

> matchmaker #2 to #1

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 1127.3  
RMSD between 151 pruned atom pairs is 0.771 angstroms; (across all 261 pairs:
36.016)  
  

> ui tool show ""Command Line Interface""

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 64

> cartoon style (sel & coil) xsection oval

> cartoon style sel xsection barbell modeHelix default

> select add #2

4180 atoms, 4262 bonds, 530 residues, 2 models selected  

> hide #!1 models

> color (#2 & sel) dim gray

> color (#2 & sel) gray

> color (#2 & sel) light gray

> hide #2 models

> select subtract #2

584 atoms, 594 bonds, 73 residues, 1 model selected  

> show #2 models

> show #!1 models

> select add #2

4180 atoms, 4262 bonds, 530 residues, 2 models selected  

> select subtract #2

584 atoms, 594 bonds, 73 residues, 1 model selected  

> hide #2 models

> show #2 models

> select add #2

4180 atoms, 4262 bonds, 530 residues, 2 models selected  

> hide #!1 models

> show #!1 models

> ui tool show ""Color Actions""

> color sel pale violet red

> undo

> select subtract #2

584 atoms, 594 bonds, 73 residues, 1 model selected  

> select add #1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> select subtract #1

Nothing selected  

> select add #1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> color sel pale violet red

> select clear

> save ""/Users/nezakoritnik/Desktop/Alphafold C.png"" width 3000 height 2487
> supersample 3 transparentBackground true

> save /Users/nezakoritnik/Desktop/alphafoldC.cxs

> save ""/Users/nezakoritnik/Desktop/AlphaFold C2.png"" width 3000 height 2487
> supersample 3 transparentBackground true

No reference and/or match structure/chain chosen  

> matchmaker #2 to #1 & sel

No 'to' model specified  

> select #1/Ab:102

11 atoms, 11 bonds, 1 residue, 1 model selected  

> select #1/Ab:102-186

673 atoms, 684 bonds, 85 residues, 1 model selected  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> select clear

> save ""/Users/nezakoritnik/Desktop/Alphafold N.png"" width 3000 height 2487
> supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/Alphafold N2.png"" width 3000 height 2487
> supersample 3 transparentBackground true

> hide #2 models

> show #2 models

> save /Users/nezakoritnik/Desktop/alphafoldN.cxs

> hide #2 models

> save /Users/nezakoritnik/Desktop/monomer.cxs

> save ""/Users/nezakoritnik/Desktop/monomer 1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 0

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 64

> save ""/Users/nezakoritnik/Desktop/monomer 2.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> show #2 models

> matchmaker #2 to #1

Computing secondary structure  
Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 1127.3  
RMSD between 151 pruned atom pairs is 0.771 angstroms; (across all 261 pairs:
36.016)  
  

> hide #!1 models

> show #!1 models

> select add #1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> ui tool show ""Color Actions""

> color sel pink

> hide #2 models

> select clear

> save ""/Users/nezakoritnik/Desktop/monomer 1.1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/monomer 2.1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> select #1/Ab:410-411

18 atoms, 18 bonds, 2 residues, 1 model selected  

> select #1/Ab:410-457

386 atoms, 393 bonds, 48 residues, 1 model selected  
Drag select of 1 residues  

> select #1/Ab:343

6 atoms, 5 bonds, 1 residue, 1 model selected  

> select #1/Ab:343-457

904 atoms, 922 bonds, 115 residues, 1 model selected  

> select #1/Ab:342

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #1/Ab:342-343

18 atoms, 18 bonds, 2 residues, 1 model selected  

> select #1/Ab:342

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #1/Ab:342-457

916 atoms, 935 bonds, 116 residues, 1 model selected  

> rainbow sel

> select clear

> rainbow #!1

> save ""/Users/nezakoritnik/Desktop/monomer 1.png"" width 3000 height 2435
> supersample 3

> save ""/Users/nezakoritnik/Desktop/monomer 1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> rotate 180

Unknown command: rotate 180  

> rot 180

Unknown command: rot 180  

> turn z 180

> turn y 180

> save ""/Users/nezakoritnik/Desktop/monomer 2.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> select #1/Ab:293

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> color sel byhetero

> select #1/Ab:279

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> color sel byhetero

> disulphides

Unknown command: disulphides  

> show disulfides

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> show /ss

> select #1/Ab:279@CA

1 atom, 1 residue, 1 model selected  

> select #1/Ab:279@SG

1 atom, 1 residue, 1 model selected  

> select #1/Ab:290

7 atoms, 7 bonds, 1 residue, 1 model selected  

> select #1/Ab:279@SG

1 atom, 1 residue, 1 model selected  

> select add #1/Ab:293@SG

2 atoms, 2 residues, 1 model selected  

> bond sel

Created 1 bond  

> ui tool show ""Side View""

> save /Users/nezakoritnik/Desktop/disulfid.png width 3000 height 2579
> supersample 3 transparentBackground true

> select clear

> save /Users/nezakoritnik/Desktop/disulfid.png width 3000 height 2579
> supersample 3 transparentBackground true

> select #1/Ab:180

11 atoms, 11 bonds, 1 residue, 1 model selected  

> select #1/Ab:180

11 atoms, 11 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #1/Ab:181

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #1/Ab:182

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #1/Ab:183

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> color #1 byhetero

> save /Users/nezakoritnik/Desktop/monomer.cxs

> open /Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-
> Andreja/Rigidbodyrefine16/chains_filament16_real_space_refined.pdb

Summary of feedback from opening /Users/nezakoritnik/Desktop/HCPro-
struktura/NOVHCPro-
Andreja/Rigidbodyrefine16/chains_filament16_real_space_refined.pdb  
---  
warnings | Ignored bad PDB record found on line 379  
SSBOND 1 CYS Aa 279 CYS Aa 293  
  
Ignored bad PDB record found on line 380  
SSBOND 2 CYS Ab 279 CYS Ab 293  
  
Ignored bad PDB record found on line 381  
SSBOND 3 CYS Ac 279 CYS Ac 293  
  
Ignored bad PDB record found on line 382  
SSBOND 4 CYS Ad 279 CYS Ad 293  
  
Ignored bad PDB record found on line 383  
SSBOND 5 CYS Ae 279 CYS Ae 293  
  
19 messages similar to the above omitted  
  
Chain information for chains_filament16_real_space_refined.pdb #3  
---  
Chain | Description  
Aa Ab Ac Ad Ae Af Ag Ah Ai Aj Ak Al Am An Ao Ap Aq Ar As At Au Av Aw Ax | No description available  
  

> hide #!1 models

> show #!1 models

> hide #!1 models

> show #!3 surfaces

> open /Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-Andreja/newPVA-
> HCPro_P130_J481.mrc

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 2, values float32  

> transparency 50

> color #4 #ebebebff models

> transparency 0

> transparency 50

> hide #!4 models

> lighting soft

> select #3/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> color (#!3 & sel) red

> select clear

> save /Users/nezakoritnik/Desktop/interakcije1.png width 3000 height 2871
> supersample 3 transparentBackground true

> close #4

> save /Users/nezakoritnik/Desktop/interakcije.cxs

> open /Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-Andreja/newPVA-
> HCPro_P130_J481.mrc

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 2, values float32  

> select add #4

2 models selected  

> transparency sel 50

> color #4 white models

> hide #!4 models

> show #!4 models

> select subtract #4

Nothing selected  

> lighting soft

> color #4 #ebebebff models

> volume #4 step 1

> surface dust #4 size 8.34

> select add #4

2 models selected  

> transparency sel 50

> select subtract #4

Nothing selected  

> hide #!4 models

> show #!4 models

> select add #4

3 models selected  

> color #4 #d6d6d6ff models

> transparency #4.1 70

> select subtract #4

Nothing selected  

> save ""/Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-
> Andreja/interakcije 1.1.cxs"" includeMaps true

> save ""/Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-
> Andreja/interakcije 1.1.png"" width 3000 height 2871 supersample 3
> transparentBackground true

> hide #!4 models

> show #!4 models

> hide #!4 models

> save ""/Users/nezakoritnik/Desktop/interakcije 2.png"" width 3000 height 2605
> supersample 3 transparentBackground true

> show #!4 models

> color #4 darkgrey models

> save ""/Users/nezakoritnik/Desktop/interakcije 1.1.png"" width 3000 height
> 2605 supersample 3

> hide #!3 models

> hide #!4 models

> show #!3 models

> show #!4 models

> hide #!4 models

> hide #!3 surfaces

> style #!3 stick

Changed 49344 atom styles  

> show #!3 cartoons

> hide #!3 atoms

> cartoon style #3 modeHelix tube sides 20

> show #!3 surfaces

> transparency #3 0

> ui tool show ""Command Line Interface""

> split

Did not split monomerhcpro.cif, has only one piece  
Did not split fold_2024_05_09_pva_hcpro_model_0.cif, has only one piece  
Split chains_filament16_real_space_refined.pdb (#3) into 24 models  
Chain information for chains_filament16_real_space_refined.pdb Aa #3.1  
---  
Chain | Description  
Aa | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ab #3.2  
---  
Chain | Description  
Ab | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ac #3.3  
---  
Chain | Description  
Ac | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ad #3.4  
---  
Chain | Description  
Ad | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ae #3.5  
---  
Chain | Description  
Ae | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Af #3.6  
---  
Chain | Description  
Af | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ag #3.7  
---  
Chain | Description  
Ag | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ah #3.8  
---  
Chain | Description  
Ah | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ai #3.9  
---  
Chain | Description  
Ai | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Aj #3.10  
---  
Chain | Description  
Aj | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ak #3.11  
---  
Chain | Description  
Ak | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Al #3.12  
---  
Chain | Description  
Al | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Am #3.13  
---  
Chain | Description  
Am | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb An #3.14  
---  
Chain | Description  
An | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ao #3.15  
---  
Chain | Description  
Ao | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ap #3.16  
---  
Chain | Description  
Ap | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Aq #3.17  
---  
Chain | Description  
Aq | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ar #3.18  
---  
Chain | Description  
Ar | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb As #3.19  
---  
Chain | Description  
As | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb At #3.20  
---  
Chain | Description  
At | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Au #3.21  
---  
Chain | Description  
Au | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Av #3.22  
---  
Chain | Description  
Av | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Aw #3.23  
---  
Chain | Description  
Aw | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ax #3.24  
---  
Chain | Description  
Ax | No description available  
  

> show #!3.1-24 surfaces

> hide #!3 models

> show #!3 models

> hide #!3.2 models

> hide #!3.3 models

> hide #!3.4 models

> show #!3.4 models

> hide #!3.4 models

> hide #!3.5 models

> hide #!3.6 models

> hide #!3.7 models

> show #!3.7 models

> hide #!3.8 models

> hide #!3.7 models

> hide #!3.9 models

> hide #!3.10 models

> hide #!3.11 models

> hide #!3.12 models

> hide #!3.13 models

> hide #!3.14 models

> hide #!3.15 models

> hide #!3.16 models

> hide #!3.17 models

> hide #!3.18 models

> hide #!3.19 models

> hide #!3.20 models

> hide #!3.21 models

> hide #!3.22 models

> hide #!3.23 models

> hide #!3.24 models

> show #!3.7 models

> hide #!3.7 models

> show #!3.3 models

> hide #!3.3 models

> show #!3.4 models

> hide #!3.1,4 surfaces

> show #!3.1,4 surfaces

> hide #!3.1,4 surfaces

> hide #!3.4 models

> show #!3.3 models

> show #!3.1,3 surfaces

> hide #!3.3 models

> show #!3.8 models

> hide #!3.8 models

> show #!3.21 models

> hide #!3.21 models

> show #!3.2 models

> show #!3.11 models

> hide #!3.11 models

> show #!3.17 models

> hide #!3.17 models

> show #!3.17 models

> hide #!3.17 models

> hide #!3.2 models

> hide #!3.1 models

> show #!3.3 models

> show #!3.1 models

> show #!3.4 models

> hide #!3.3 models

> hide #!3.1,4 surfaces

> cartoon style #3.1,4#!3 modeHelix tube sides 20

> cartoon style (#3.1,4#!3 & coil) xsection oval

> cartoon style #3.1,4#!3 xsection barbell modeHelix default

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 64

> select add #3.1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> ui tool show ""Color Actions""

> color sel pink

> select clear

> show #!3.1,4 atoms

> color #3.1,4#!3 byhetero

> ui mousemode right distance

> distance #3.4/Ad:135@OE1 #3.1/Aa:455@NH1

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLU 135
OE1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 455 NH1:
5.036Å  

> hide #!3.1,4 atoms

> select #3.4/Ad:135

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:455

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> ui tool show ""Color Actions""

> color sel lime

> select #3.4/Ad:126

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:413

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:413@NZ #3.4/Ad:126@OG1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 413
NZ and chains_filament16_real_space_refined.pdb Ad #3.4/Ad THR 126 OG1: 3.203Å  

> select clear

> hide #5.1 models

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.cxs""

> close #4

> hide #!3.1,4 atoms

> select #3.1/Aa:450

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:127

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:128

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> select clear

> hide #!3.1,4 atoms

> ui tool show ""Show Sequence Viewer""

> sequence chain #2/A

Alignment identifier is 2/A  

> select #2/A:109

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:109-220

889 atoms, 905 bonds, 112 residues, 1 model selected  

> select #2/A:260-261

13 atoms, 12 bonds, 2 residues, 1 model selected  

> select #2/A:260-325

506 atoms, 515 bonds, 66 residues, 1 model selected  

> select #2/A:321-322

15 atoms, 15 bonds, 2 residues, 1 model selected  

> select #2/A:209-322

892 atoms, 910 bonds, 114 residues, 1 model selected  

> select #2/A:5

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select #2/A:5-423

3296 atoms, 3363 bonds, 419 residues, 1 model selected  

> select #2/A:158

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:158-260

831 atoms, 845 bonds, 103 residues, 1 model selected  

> select #2/A:52-102

414 atoms, 421 bonds, 51 residues, 1 model selected  

> select #2/A:1-102

805 atoms, 821 bonds, 102 residues, 1 model selected  

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.1/Aa

Alignment identifier is 3.1/Aa  

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.4/Ad

Alignment identifier is 3.4/Ad  

> select #3.4/Ad:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:298-457

994 atoms, 1015 bonds, 1 pseudobond, 126 residues, 2 models selected  

> select #3.4/Ad:267-268

13 atoms, 12 bonds, 2 residues, 1 model selected  

> select #3.4/Ad:267-457

1226 atoms, 1250 bonds, 1 pseudobond, 157 residues, 2 models selected  

> select #3.4/Ad:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:170-457

1502 atoms, 1527 bonds, 2 pseudobonds, 192 residues, 2 models selected  

> select #3.4/Ad:146

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:146-457

1689 atoms, 1717 bonds, 2 pseudobonds, 216 residues, 2 models selected  

> cartoon hide (#!3.4 & sel)

> select #3.1/Aa:101-102

23 atoms, 24 bonds, 2 residues, 1 model selected  

> select #3.1/Aa:101-145

367 atoms, 375 bonds, 45 residues, 1 model selected  

> hide (#!3.1 & sel) target a

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:298-457

994 atoms, 1015 bonds, 1 pseudobond, 126 residues, 2 models selected  

> select #3.1/Aa:170-171

16 atoms, 15 bonds, 2 residues, 1 model selected  

> select #3.1/Aa:170-457

1502 atoms, 1527 bonds, 2 pseudobonds, 192 residues, 2 models selected  

> hide (#!3.1 & sel) target a

> cartoon hide (#!3.1 & sel)

> show sel atoms

> hide sel atoms

> select clear

> show #!3.1,4 atoms

> undo

> select #3.4/Ad:117

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:163

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:163@NH1 #3.4/Ad:117@OE1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163
NH1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLU 117 OE1:
4.957Å  

> ui tool show ""Color Actions""

> color sel lime

> select #3.1/Aa:166

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:169

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:127

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:168

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:166

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:167

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:168

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:168-297

526 atoms, 529 bonds, 1 pseudobond, 68 residues, 2 models selected  

> select #3.4/Ad:160

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:160-252

253 atoms, 254 bonds, 1 pseudobond, 31 residues, 2 models selected  

> cartoon (#!3.4 & sel)

> select #3.4/Ad:160

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:101-160

473 atoms, 483 bonds, 60 residues, 1 model selected  

> select
> #3.1/Aa:112-122,128-141,143-145,148-166,177-179,258-265,289-291,345-354,363-369,371-375,381-394,436-443,451-453

863 atoms, 865 bonds, 108 residues, 1 model selected  

> select #3.1/Aa:168-297

526 atoms, 529 bonds, 1 pseudobond, 68 residues, 2 models selected  

> select #3.1/Aa:146

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:146-297

695 atoms, 701 bonds, 1 pseudobond, 90 residues, 2 models selected  

> show sel cartoons

> select #3.4/Ad:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.4/Ad

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> select clear

> select #3.1/Aa:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-252

717 atoms, 729 bonds, 1 pseudobond, 90 residues, 2 models selected  

> cartoon (#!3.1 & sel)

> select #3.4/Ad:169

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> select #3.4/Ad:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:168

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> hide #!3.1,4 atoms

> select #3.4/Ad:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:168

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> distance #3.4/Ad:170@OD1 #3.1/Aa:168@NH1

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad ASP 170
OD1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 168 NH1:
4.754Å  

> color sel lime

> select clear

> ui tool show ""Side View""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/zanka-zanka.cxs""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/zanka-zanka.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> open ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.cxs""

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 1, values float32  
opened ChimeraX session  

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> hide #!3.1,4 atoms

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.1/Aa

Alignment identifier is 3.1/Aa  

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:377-457

635 atoms, 649 bonds, 81 residues, 1 model selected  

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:273-457

1181 atoms, 1205 bonds, 1 pseudobond, 151 residues, 2 models selected  

> select #3.1/Aa:253

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:253-457

1339 atoms, 1363 bonds, 1 pseudobond, 171 residues, 2 models selected  

> select #3.1/Aa:167

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:167-457

1528 atoms, 1553 bonds, 2 pseudobonds, 195 residues, 2 models selected  

> select #3.1/Aa:175

4 atoms, 3 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:175-457

1460 atoms, 1485 bonds, 2 pseudobonds, 187 residues, 2 models selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-140

333 atoms, 341 bonds, 40 residues, 1 model selected  

> select #3.1/Aa:145

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-145

367 atoms, 375 bonds, 45 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.4/Ad

Alignment identifier is 3.4/Ad  

> select #3.4/Ad:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:253-457

1339 atoms, 1363 bonds, 1 pseudobond, 171 residues, 2 models selected  

> select #3.4/Ad:167

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:167-457

1528 atoms, 1553 bonds, 2 pseudobonds, 195 residues, 2 models selected  

> select #3.4/Ad:148

7 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:148-457

1677 atoms, 1705 bonds, 2 pseudobonds, 214 residues, 2 models selected  

> hide sel cartoons

> select #3.1/Aa:166

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:130

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:166@NH1 #3.4/Ad:130@OH

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 166
NH1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad TYR 130 OH: 3.848Å  

> select clear

> select #3.1/Aa:163

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:117

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:169

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:169@OG1 #3.4/Ad:130@OH

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa THR 169
OG1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad TYR 130 OH: 2.497Å  

> select #3.1/Aa:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:127

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> show sel atoms

> distance #3.1/Aa:171@OD1 #3.4/Ad:127@NE2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ASN 171
OD1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLN 127 NE2:
6.116Å  

> hide sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:159

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:133

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:118

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:114

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:162

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:155

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:141

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:140

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:158

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.4/Ad:140

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:154

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:111

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.4/Ad:136

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:161

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:136@CA

1 atom, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.4/Ad:136

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:162

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:161

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:165

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:129

7 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:136

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:151

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od.cxs""

> ui tool show ""Side View""

> select #3.4/Ad:109

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> distance #3.4/Ad:109@OD1 #3.1/Aa:163@NH1

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad ASN 109
OD1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163 NH1:
14.827Å  

> ~distance #3.4/Ad:109@OD1 #3.1/Aa:163@NH1

> distance #3.1/Aa:163@NH1 #3.4/Ad:117@OE1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163
NH1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLU 117 OE1:
4.957Å  

> distance #3.4/Ad:109@OD1 #3.1/Aa:155@OG

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad ASN 109
OD1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa SER 155 OG: 3.725Å  

> turn y 180

> select #3.4/Ad:129

7 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> turn y 180

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od1.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od1.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> undo

> select clear

> color sel lime

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od1.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od2.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od.cxs""

> hide #!5 models

> select #3.4/Ad:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.4/Ad

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> hide sel atoms

> select #3.1/Aa:456-457

12 atoms, 11 bonds, 2 residues, 1 model selected  

> select #3.1/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> hide sel atoms

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/celoten.cxs""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/celoten.png"" width 3000 height
> 2435 supersample 3

> show #!3.3 models

> hide #!3.4 models

> hide #!3.1,3 surfaces

> select add #3.3

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> ui tool show ""Color Actions""

> color sel aquamarine

> color sel medium aquamarine

> color sel mint cream

> color sel pale turquoise

> show #!3.4 models

> ui tool show ""Color Actions""

> color #3.3 #a4c4b3ff

> color #3.3 #dbfdefff

> color #3.3 #cdf4e1ff

> hide #!3.4 models

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/celoten.png"" width 3000 height
> 2435 supersample 3

> show #!3.4 models

> hide #!3.3 models

> select clear

> select #3.4/Ad:450

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:126

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:127

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> select #3.1/Aa:128

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:453

10 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:164

11 atoms, 11 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:157

10 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:132

10 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> show #!3.3 models

> hide #!3.4 models

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:169-457

1509 atoms, 1534 bonds, 2 pseudobonds, 193 residues, 2 models selected  

> hide sel cartoons

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.3/Ac

Alignment identifier is 3.3/Ac  

> select #3.3/Ac:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:101-183

666 atoms, 678 bonds, 83 residues, 1 model selected  

> hide sel cartoons

> hide sel atoms

> select clear

> hide #!3.1,3 atoms

> select #3.1/Aa:113

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:106

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:362

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> color #3.1,3#!3 byhetero

> distance #3.1/Aa:106@NH1 #3.3/Ac:362@OD2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 106
NH1 and chains_filament16_real_space_refined.pdb Ac #3.3/Ac ASP 362 OD2:
2.728Å  

> distance #3.3/Ac:362@OD2 #3.1/Aa:106@NH1

Distance already exists; modify distance properties with 'distance style'  

> show #!5 models

> color sel lime

> select #3.1/Aa:145

11 atoms, 10 bonds, 1 residue, 1 model selected  

> ui mousemode right ""translate selected models""

> show sel atoms

> select #3.3/Ac:357

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:358

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:359

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:360

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select clear

> select #3.3/Ac:358

6 atoms, 5 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:145

11 atoms, 10 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.3/Ac:359

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.3/Ac:357

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:115

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:389

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> ui mousemode right distance

> distance #3.1/Aa:115@OH #3.3/Ac:389@OG

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa TYR 115
OH and chains_filament16_real_space_refined.pdb Ac #3.3/Ac SER 389 OG: 2.696Å  

> select #3.1/Aa:116

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:374

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:116@NH1 #3.3/Ac:374@OD2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 116
NH1 and chains_filament16_real_space_refined.pdb Ac #3.3/Ac ASP 374 OD2:
3.301Å  

> color sel lime

> select #3.1/Aa:120

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:445

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:120@NZ #3.3/Ac:445@OD1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 120
NZ and chains_filament16_real_space_refined.pdb Ac #3.3/Ac ASN 445 OD1: 3.904Å  

> select #3.1/Aa:138

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:135

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:440

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:135

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.3/Ac:393

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:142

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:394

11 atoms, 11 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:142

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:141

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:390

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:142

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:119

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:386

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:390

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:440

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:443

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> cartoon style (#!3.3 & sel) modeHelix tube sides 20

> cartoon style (#!3.3 & sel & coil) xsection oval

> cartoon style (#!3.3 & sel) xsection barbell modeHelix default

> select clear

> select #3.1/Aa:138

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface1.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface2.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface.cxs""

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface11.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface 21.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> open ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface.cxs""

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 1, values float32  
opened ChimeraX session  

> close #4

> show #!3.2 models

> ui tool show ""Side View""

> hide #!3.1 models

> show #!3.1 models

> hide #!3.2 models

> show #!3.5 models

> hide #!3.5 models

> show #!3.5 models

> hide #!3.5 models

> show #!3.7 models

> hide #!3.7 models

> show #!3.9 models

> show #!3.8 models

> hide #!3.8 models

> hide #!3.9 models

> show #!3.10 models

> hide #!3.10 models

> show #!3.11 models

> show #!3.12 models

> hide #!3.11 models

> hide #!3.12 models

> show #!3.14 models

> hide #!3.14 models

> show #!3.15 models

> hide #!3.15 models

> show #!3.16 models

> hide #!3.16 models

> show #!3.17 models

> hide #!3.17 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.21 models

> hide #!3.21 models

> show #!3.21 models

> hide #!3.21 models

> show #!3.22 models

> hide #!3.22 models

> show #!3.21 models

> hide #!3.21 models

> select #3.3/Ac:407-457

409 atoms, 416 bonds, 51 residues, 1 model selected  

> select #3.3/Ac

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> show #!3.21 models

> hide sel surfaces

> select clear

> hide #!3.1,3,21 surfaces

> color #3.21 #e0fef3ff

> color #3.21 #c8e7d8ff

> cartoon style (#3.1,3,21#!3,5 & coil) xsection oval

> cartoon style #3.1,3,21#!3,5 xsection barbell modeHelix default

> hide #!3.3 models

> hide #!3.1,21 atoms

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/celotna.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/celotna.cxs""

> select #3.1/Aa:265

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:261

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:258

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:254

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:254

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:258

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:261

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:265

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:298-457

994 atoms, 1015 bonds, 1 pseudobond, 126 residues, 2 models selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:297

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:270-297

213 atoms, 215 bonds, 28 residues, 1 model selected  

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:272-297

196 atoms, 198 bonds, 26 residues, 1 model selected  

> surface hidePatches (#!3.1 & sel)

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.21/Au

Alignment identifier is 3.21/Au  

> select #3.21/Au:449-457

77 atoms, 78 bonds, 9 residues, 1 model selected  

> select #3.21/Au:272-457

1190 atoms, 1214 bonds, 1 pseudobond, 152 residues, 2 models selected  

> cartoon hide (#!3.21 & sel)

> select #3.21/Au:189

10 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.21/Au:101-189

709 atoms, 722 bonds, 89 residues, 1 model selected  

> cartoon hide (#!3.21 & sel)

> select #3.1/Aa:189

10 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-189

709 atoms, 722 bonds, 89 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:281-282

14 atoms, 13 bonds, 2 residues, 1 model selected  

> select #3.1/Aa:281-297

132 atoms, 134 bonds, 17 residues, 1 model selected  

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:272-297

196 atoms, 198 bonds, 26 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:266

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:266-271

45 atoms, 44 bonds, 6 residues, 1 model selected  

> hide (#!3.1 & sel) target a

> select #3.21/Au:266

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.21/Au:266-275

75 atoms, 74 bonds, 10 residues, 1 model selected  

> select #3.21/Au:267-268

13 atoms, 12 bonds, 2 residues, 1 model selected  

> select #3.21/Au:267-284

128 atoms, 127 bonds, 18 residues, 1 model selected  

> cartoon hide (#!3.21 & sel)

> select #3.1/Aa:267

4 atoms, 3 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:267-278

87 atoms, 86 bonds, 12 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/interface.cxs""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/interface.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> undo

> surface hidePatches (#!3.1 & sel)

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> select #3.21/Au:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.21/Au

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> ui tool show ""Model Panel""

> show #!3.2 models

> show sel surfaces

> select clear

> show #!3.1-2,21 surfaces

> hide #!3.1-2,21 surfaces

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.2/Ab

Alignment identifier is 3.2/Ab  

> select #3.2/Ab:105

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:105-386

1462 atoms, 1484 bonds, 2 pseudobonds, 186 residues, 2 models selected  

> select #3.2/Ab:386-387

13 atoms, 12 bonds, 2 residues, 1 model selected  

> select #3.2/Ab:101-387

1507 atoms, 1532 bonds, 2 pseudobonds, 191 residues, 2 models selected  

> select #3.2/Ab:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> color #3.2 #daf6e9ff

> color #3.2 #d4efe3ff

> select add #3.2

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 5 models selected  

> select subtract #3.2

1 model selected  

> hide #!3.21 models

> hide #!3.1-2 atoms

> select #3.1/Aa:173

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:285

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select clear

> hide #!3.1-2 atoms

> cartoon style (#3.1-2#!3,5 & coil) xsection oval

> cartoon style #3.1-2#!3,5 xsection barbell modeHelix default

> ui tool show ""Side View""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/celotna.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/celotna.cxs""

> select #3.1/Aa:173

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:284

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> select clear

> color #3.1-2#!3,5 byhetero

> select #3.2/Ab:285

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:163

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:120

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:117

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.2/Ab:117@OE2 #3.1/Aa:163@NH1

Distance between chains_filament16_real_space_refined.pdb Ab #3.2/Ab GLU 117
OE2 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163 NH1:
5.233Å  

> show #5.1 models

> hide #5.1 models

> ui tool show ""Color Actions""

> color sel lime

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select add #3.1/Aa:173@NZ

2 atoms, 2 residues, 3 models selected  

> select subtract #3.2/Ab:284@OD2

1 atom, 1 residue, 3 models selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  
Drag select of 1 atoms  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> distance #3.1/Aa:173@NZ #3.2/Ab:284@OD2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 173
NZ and chains_filament16_real_space_refined.pdb Ab #3.2/Ab ASP 284 OD2: 3.248Å  

> distance #3.1/Aa:173@NZ #3.2/Ab:285@OD1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 173
NZ and chains_filament16_real_space_refined.pdb Ab #3.2/Ab ASN 285 OD1: 3.099Å  

> color sel lime

> select #3.2/Ab:187

9 atoms, 8 bonds, 1 residue, 1 model selected  

> ui mousemode right ""translate selected models""

> show sel atoms

> select #3.1/Aa:268

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> ui mousemode right distance

> distance #3.1/Aa:268@OE2 #3.2/Ab:187@NZ

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa GLU 268
OE2 and chains_filament16_real_space_refined.pdb Ab #3.2/Ab LYS 187 NZ: 5.543Å  

> select clear

> color sel lime

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:276

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:275

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:274

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:277

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:287

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

Drag select of 1 residues  

> select #3.2/Ab:290

7 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:287

12 atoms, 12 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.2/Ab:286@CA

1 atom, 1 residue, 1 model selected  

> hide sel atoms

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:277

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:276

7 atoms, 6 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:275

7 atoms, 6 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:274

5 atoms, 4 bonds, 1 residue, 1 model selected  

> hide sel atoms

> show sel atoms

> hide sel atoms

> select #3.2/Ab:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> select #3.1/Aa:411

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:287

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> distance #3.2/Ab:437@NH2 #3.1/Aa:411@OD2

Distance between chains_filament16_real_space_refined.pdb Ab #3.2/Ab ARG 437
NH2 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ASP 411 OD2:
7.180Å  

> show #5.1 models

> hide #5.1 models

> select clear

> color sel lime

> select #3.1/Aa:277

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:413

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> hide sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/interakcijska površina.cxs""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/interakcijska povrina.png""
> width 3000 height 2435 supersample 3 transparentBackground true


===== Log before crash end =====

Log:
UCSF ChimeraX version: 1.9 (2024-12-11)  
© 2016-2024 Regents of the University of California. All rights reserved.  

> open ""/Users/nezakoritnik/Desktop/INTERFACE 4/interakcijska površina.cxs""

Log from Wed Jan 29 07:29:35 2025UCSF ChimeraX version: 1.9 (2024-12-11)  
© 2016-2024 Regents of the University of California. All rights reserved.  

> open ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface.cxs""

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 1, values float32  
Log from Tue Jan 28 14:16:05 2025UCSF ChimeraX version: 1.9 (2024-12-11)  
© 2016-2024 Regents of the University of California. All rights reserved.  

> open ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.cxs""

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 1, values float32  
Log from Tue Jan 28 10:12:17 2025 Startup Messages  
---  
note | available bundle cache has not been initialized yet  
  
UCSF ChimeraX version: 1.9 (2024-12-11)  
© 2016-2024 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open /Users/nezakoritnik/Desktop/HCPro-struktura/monomerhcpro.cif

Summary of feedback from opening /Users/nezakoritnik/Desktop/HCPro-
struktura/monomerhcpro.cif  
---  
warnings | Unknown polymer entity '1' on line 131  
Missing or incomplete sequence information. Inferred polymer connectivity.  
  
  
Chain information for monomerhcpro.cif #1  
---  
Chain | Description  
Ab | No description available  
  

> set bgColor white

> open ""/Users/nezakoritnik/Documents/REZULTATI/Bioinformatske
> analize/AlphaFold/ALFAFOLD3/PVA-
> HCPro_2024_05_09_pva_hcpro/fold_2024_05_09_pva_hcpro_model_0.cif""

Chain information for fold_2024_05_09_pva_hcpro_model_0.cif #2  
---  
Chain | Description  
A | .  
  
Computing secondary structure  

> ui tool show Matchmaker

> matchmaker #2 to #1

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 1127.3  
RMSD between 151 pruned atom pairs is 0.771 angstroms; (across all 261 pairs:
36.016)  
  

> ui tool show Matchmaker

> ui tool show ""Show Sequence Viewer""

> sequence chain #1/Ab

Alignment identifier is 1/Ab  

> select #1/Ab:102

11 atoms, 11 bonds, 1 residue, 1 model selected  

> select #1/Ab:102-174

584 atoms, 594 bonds, 73 residues, 1 model selected  

> ui tool show Matchmaker

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 342  
RMSD between 63 pruned atom pairs is 0.737 angstroms; (across all 73 pairs:
2.555)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 342  
RMSD between 63 pruned atom pairs is 0.737 angstroms; (across all 73 pairs:
2.555)  
  

> matchmaker #2 to #1

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 1127.3  
RMSD between 151 pruned atom pairs is 0.771 angstroms; (across all 261 pairs:
36.016)  
  

> ui tool show ""Command Line Interface""

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 64

> cartoon style (sel & coil) xsection oval

> cartoon style sel xsection barbell modeHelix default

> select add #2

4180 atoms, 4262 bonds, 530 residues, 2 models selected  

> hide #!1 models

> color (#2 & sel) dim gray

> color (#2 & sel) gray

> color (#2 & sel) light gray

> hide #2 models

> select subtract #2

584 atoms, 594 bonds, 73 residues, 1 model selected  

> show #2 models

> show #!1 models

> select add #2

4180 atoms, 4262 bonds, 530 residues, 2 models selected  

> select subtract #2

584 atoms, 594 bonds, 73 residues, 1 model selected  

> hide #2 models

> show #2 models

> select add #2

4180 atoms, 4262 bonds, 530 residues, 2 models selected  

> hide #!1 models

> show #!1 models

> ui tool show ""Color Actions""

> color sel pale violet red

> undo

> select subtract #2

584 atoms, 594 bonds, 73 residues, 1 model selected  

> select add #1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> select subtract #1

Nothing selected  

> select add #1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> color sel pale violet red

> select clear

> save ""/Users/nezakoritnik/Desktop/Alphafold C.png"" width 3000 height 2487
> supersample 3 transparentBackground true

> save /Users/nezakoritnik/Desktop/alphafoldC.cxs

> save ""/Users/nezakoritnik/Desktop/AlphaFold C2.png"" width 3000 height 2487
> supersample 3 transparentBackground true

No reference and/or match structure/chain chosen  

> matchmaker #2 to #1 & sel

No 'to' model specified  

> select #1/Ab:102

11 atoms, 11 bonds, 1 residue, 1 model selected  

> select #1/Ab:102-186

673 atoms, 684 bonds, 85 residues, 1 model selected  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> matchmaker #2 to #1 & sel

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 397.4  
RMSD between 60 pruned atom pairs is 0.699 angstroms; (across all 85 pairs:
11.855)  
  

> select clear

> save ""/Users/nezakoritnik/Desktop/Alphafold N.png"" width 3000 height 2487
> supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/Alphafold N2.png"" width 3000 height 2487
> supersample 3 transparentBackground true

> hide #2 models

> show #2 models

> save /Users/nezakoritnik/Desktop/alphafoldN.cxs

> hide #2 models

> save /Users/nezakoritnik/Desktop/monomer.cxs

> save ""/Users/nezakoritnik/Desktop/monomer 1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 0

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 64

> save ""/Users/nezakoritnik/Desktop/monomer 2.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> show #2 models

> matchmaker #2 to #1

Computing secondary structure  
[Repeated 1 time(s)]  Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker monomerhcpro.cif, chain Ab (#1) with
fold_2024_05_09_pva_hcpro_model_0.cif, chain A (#2), sequence alignment score
= 1127.3  
RMSD between 151 pruned atom pairs is 0.771 angstroms; (across all 261 pairs:
36.016)  
  

> hide #!1 models

> show #!1 models

> select add #1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> ui tool show ""Color Actions""

> color sel pink

> hide #2 models

> select clear

> save ""/Users/nezakoritnik/Desktop/monomer 1.1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/monomer 2.1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> select #1/Ab:410-411

18 atoms, 18 bonds, 2 residues, 1 model selected  

> select #1/Ab:410-457

386 atoms, 393 bonds, 48 residues, 1 model selected  
Drag select of 1 residues  

> select #1/Ab:343

6 atoms, 5 bonds, 1 residue, 1 model selected  

> select #1/Ab:343-457

904 atoms, 922 bonds, 115 residues, 1 model selected  

> select #1/Ab:342

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #1/Ab:342-343

18 atoms, 18 bonds, 2 residues, 1 model selected  

> select #1/Ab:342

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #1/Ab:342-457

916 atoms, 935 bonds, 116 residues, 1 model selected  

> rainbow sel

> select clear

> rainbow #!1

> save ""/Users/nezakoritnik/Desktop/monomer 1.png"" width 3000 height 2435
> supersample 3

> save ""/Users/nezakoritnik/Desktop/monomer 1.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> rotate 180

Unknown command: rotate 180  

> rot 180

Unknown command: rot 180  

> turn z 180

[Repeated 1 time(s)]

> turn y 180

> save ""/Users/nezakoritnik/Desktop/monomer 2.png"" width 3000 height 2435
> supersample 3 transparentBackground true

> select #1/Ab:293

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> color sel byhetero

> select #1/Ab:279

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

[Repeated 2 time(s)]

> color sel byhetero

> disulphides

Unknown command: disulphides  

> show disulfides

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> show /ss

> select #1/Ab:279@CA

1 atom, 1 residue, 1 model selected  

> select #1/Ab:279@SG

1 atom, 1 residue, 1 model selected  

> select #1/Ab:290

7 atoms, 7 bonds, 1 residue, 1 model selected  

> select #1/Ab:279@SG

1 atom, 1 residue, 1 model selected  

> select add #1/Ab:293@SG

2 atoms, 2 residues, 1 model selected  

> bond sel

Created 1 bond  

> ui tool show ""Side View""

> save /Users/nezakoritnik/Desktop/disulfid.png width 3000 height 2579
> supersample 3 transparentBackground true

> select clear

> save /Users/nezakoritnik/Desktop/disulfid.png width 3000 height 2579
> supersample 3 transparentBackground true

> select #1/Ab:180

11 atoms, 11 bonds, 1 residue, 1 model selected  

> select #1/Ab:180

11 atoms, 11 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #1/Ab:181

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #1/Ab:182

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #1/Ab:183

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> color #1 byhetero

> save /Users/nezakoritnik/Desktop/monomer.cxs

> open /Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-
> Andreja/Rigidbodyrefine16/chains_filament16_real_space_refined.pdb

Summary of feedback from opening /Users/nezakoritnik/Desktop/HCPro-
struktura/NOVHCPro-
Andreja/Rigidbodyrefine16/chains_filament16_real_space_refined.pdb  
---  
warnings | Ignored bad PDB record found on line 379  
SSBOND 1 CYS Aa 279 CYS Aa 293  
  
Ignored bad PDB record found on line 380  
SSBOND 2 CYS Ab 279 CYS Ab 293  
  
Ignored bad PDB record found on line 381  
SSBOND 3 CYS Ac 279 CYS Ac 293  
  
Ignored bad PDB record found on line 382  
SSBOND 4 CYS Ad 279 CYS Ad 293  
  
Ignored bad PDB record found on line 383  
SSBOND 5 CYS Ae 279 CYS Ae 293  
  
19 messages similar to the above omitted  
  
Chain information for chains_filament16_real_space_refined.pdb #3  
---  
Chain | Description  
Aa Ab Ac Ad Ae Af Ag Ah Ai Aj Ak Al Am An Ao Ap Aq Ar As At Au Av Aw Ax | No description available  
  

> hide #!1 models

> show #!1 models

> hide #!1 models

> show #!3 surfaces

> open /Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-Andreja/newPVA-
> HCPro_P130_J481.mrc

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 2, values float32  

> transparency 50

> color #4 #ebebebff models

> transparency 0

> transparency 50

> hide #!4 models

> lighting soft

> select #3/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> color (#!3 & sel) red

> select clear

> save /Users/nezakoritnik/Desktop/interakcije1.png width 3000 height 2871
> supersample 3 transparentBackground true

> close #4

> save /Users/nezakoritnik/Desktop/interakcije.cxs

> open /Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-Andreja/newPVA-
> HCPro_P130_J481.mrc

Opened newPVA-HCPro_P130_J481.mrc as #4, grid size 512,512,512, pixel 0.834,
shown at level 0.0803, step 2, values float32  

> select add #4

2 models selected  

> transparency sel 50

> color #4 white models

> hide #!4 models

> show #!4 models

> select subtract #4

Nothing selected  

> lighting soft

> color #4 #ebebebff models

> volume #4 step 1

> surface dust #4 size 8.34

> select add #4

2 models selected  

> transparency sel 50

> select subtract #4

Nothing selected  

> hide #!4 models

> show #!4 models

> select add #4

3 models selected  

> color #4 #d6d6d6ff models

> transparency #4.1 70

> select subtract #4

Nothing selected  

> save ""/Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-
> Andreja/interakcije 1.1.cxs"" includeMaps true

> save ""/Users/nezakoritnik/Desktop/HCPro-struktura/NOVHCPro-
> Andreja/interakcije 1.1.png"" width 3000 height 2871 supersample 3
> transparentBackground true

> hide #!4 models

> show #!4 models

> hide #!4 models

> save ""/Users/nezakoritnik/Desktop/interakcije 2.png"" width 3000 height 2605
> supersample 3 transparentBackground true

> show #!4 models

> color #4 darkgrey models

> save ""/Users/nezakoritnik/Desktop/interakcije 1.1.png"" width 3000 height
> 2605 supersample 3

> hide #!3 models

> hide #!4 models

> show #!3 models

> show #!4 models

> hide #!4 models

> hide #!3 surfaces

> style #!3 stick

Changed 49344 atom styles  

> show #!3 cartoons

> hide #!3 atoms

> cartoon style #3 modeHelix tube sides 20

> show #!3 surfaces

[Repeated 5 time(s)]

> transparency #3 0

> ui tool show ""Command Line Interface""

> split

Did not split monomerhcpro.cif, has only one piece  
Did not split fold_2024_05_09_pva_hcpro_model_0.cif, has only one piece  
Split chains_filament16_real_space_refined.pdb (#3) into 24 models  
Chain information for chains_filament16_real_space_refined.pdb Aa #3.1  
---  
Chain | Description  
Aa | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ab #3.2  
---  
Chain | Description  
Ab | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ac #3.3  
---  
Chain | Description  
Ac | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ad #3.4  
---  
Chain | Description  
Ad | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ae #3.5  
---  
Chain | Description  
Ae | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Af #3.6  
---  
Chain | Description  
Af | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ag #3.7  
---  
Chain | Description  
Ag | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ah #3.8  
---  
Chain | Description  
Ah | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ai #3.9  
---  
Chain | Description  
Ai | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Aj #3.10  
---  
Chain | Description  
Aj | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ak #3.11  
---  
Chain | Description  
Ak | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Al #3.12  
---  
Chain | Description  
Al | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Am #3.13  
---  
Chain | Description  
Am | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb An #3.14  
---  
Chain | Description  
An | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ao #3.15  
---  
Chain | Description  
Ao | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ap #3.16  
---  
Chain | Description  
Ap | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Aq #3.17  
---  
Chain | Description  
Aq | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ar #3.18  
---  
Chain | Description  
Ar | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb As #3.19  
---  
Chain | Description  
As | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb At #3.20  
---  
Chain | Description  
At | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Au #3.21  
---  
Chain | Description  
Au | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Av #3.22  
---  
Chain | Description  
Av | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Aw #3.23  
---  
Chain | Description  
Aw | No description available  
  
Chain information for chains_filament16_real_space_refined.pdb Ax #3.24  
---  
Chain | Description  
Ax | No description available  
  

> show #!3.1-24 surfaces

> hide #!3 models

> show #!3 models

> hide #!3.2 models

> hide #!3.3 models

> hide #!3.4 models

> show #!3.4 models

> hide #!3.4 models

> hide #!3.5 models

> hide #!3.6 models

> hide #!3.7 models

> show #!3.7 models

> hide #!3.8 models

> hide #!3.7 models

> hide #!3.9 models

> hide #!3.10 models

> hide #!3.11 models

> hide #!3.12 models

> hide #!3.13 models

> hide #!3.14 models

> hide #!3.15 models

> hide #!3.16 models

> hide #!3.17 models

> hide #!3.18 models

> hide #!3.19 models

> hide #!3.20 models

> hide #!3.21 models

> hide #!3.22 models

> hide #!3.23 models

> hide #!3.24 models

> show #!3.7 models

> hide #!3.7 models

> show #!3.3 models

> hide #!3.3 models

> show #!3.4 models

> hide #!3.1,4 surfaces

> show #!3.1,4 surfaces

> hide #!3.1,4 surfaces

> hide #!3.4 models

> show #!3.3 models

> show #!3.1,3 surfaces

> hide #!3.3 models

> show #!3.8 models

> hide #!3.8 models

> show #!3.21 models

> hide #!3.21 models

> show #!3.2 models

> show #!3.11 models

> hide #!3.11 models

> show #!3.17 models

> hide #!3.17 models

> show #!3.17 models

> hide #!3.17 models

> hide #!3.2 models

> hide #!3.1 models

> show #!3.3 models

> show #!3.1 models

> show #!3.4 models

> hide #!3.3 models

> hide #!3.1,4 surfaces

> cartoon style #3.1,4#!3 modeHelix tube sides 20

> cartoon style (#3.1,4#!3 & coil) xsection oval

> cartoon style #3.1,4#!3 xsection barbell modeHelix default

> lighting intensity 0.45 ambientIntensity 0.14 fillIntensity 1 depthCue true
> shadows true multiShadow 64

> select add #3.1

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> ui tool show ""Color Actions""

> color sel pink

> select clear

> show #!3.1,4 atoms

> color #3.1,4#!3 byhetero

> ui mousemode right distance

> distance #3.4/Ad:135@OE1 #3.1/Aa:455@NH1

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLU 135
OE1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 455 NH1:
5.036Å  

> hide #!3.1,4 atoms

> select #3.4/Ad:135

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:455

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> ui tool show ""Color Actions""

> color sel lime

> select #3.4/Ad:126

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:413

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:413@NZ #3.4/Ad:126@OG1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 413
NZ and chains_filament16_real_space_refined.pdb Ad #3.4/Ad THR 126 OG1: 3.203Å  

> select clear

> hide #5.1 models

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.cxs""

——— End of log from Tue Jan 28 10:12:17 2025 ———

opened ChimeraX session  

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-cd.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> hide #!3.1,4 atoms

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.1/Aa

Alignment identifier is 3.1/Aa  

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:377-457

635 atoms, 649 bonds, 81 residues, 1 model selected  

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:273-457

1181 atoms, 1205 bonds, 1 pseudobond, 151 residues, 2 models selected  

> select #3.1/Aa:253

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:253-457

1339 atoms, 1363 bonds, 1 pseudobond, 171 residues, 2 models selected  

> select #3.1/Aa:167

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:167-457

1528 atoms, 1553 bonds, 2 pseudobonds, 195 residues, 2 models selected  

> select #3.1/Aa:175

4 atoms, 3 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:175-457

1460 atoms, 1485 bonds, 2 pseudobonds, 187 residues, 2 models selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-140

333 atoms, 341 bonds, 40 residues, 1 model selected  

> select #3.1/Aa:145

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-145

367 atoms, 375 bonds, 45 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.4/Ad

Alignment identifier is 3.4/Ad  

> select #3.4/Ad:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:253-457

1339 atoms, 1363 bonds, 1 pseudobond, 171 residues, 2 models selected  

> select #3.4/Ad:167

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:167-457

1528 atoms, 1553 bonds, 2 pseudobonds, 195 residues, 2 models selected  

> select #3.4/Ad:148

7 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:148-457

1677 atoms, 1705 bonds, 2 pseudobonds, 214 residues, 2 models selected  

> hide sel cartoons

> select #3.1/Aa:166

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:130

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:166@NH1 #3.4/Ad:130@OH

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 166
NH1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad TYR 130 OH: 3.848Å  

> select clear

> select #3.1/Aa:163

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:117

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:169

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:169@OG1 #3.4/Ad:130@OH

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa THR 169
OG1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad TYR 130 OH: 2.497Å  

> select #3.1/Aa:170

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:127

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> show sel atoms

> distance #3.1/Aa:171@OD1 #3.4/Ad:127@NE2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ASN 171
OD1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLN 127 NE2:
6.116Å  

> hide sel atoms

> select #3.1/Aa:171

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:159

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:133

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:118

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:114

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:162

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:155

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:141

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:140

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:158

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.4/Ad:140

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:154

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:111

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.4/Ad:136

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:161

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:136@CA

1 atom, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.4/Ad:136

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:162

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:161

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:165

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:129

7 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.4/Ad:136

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:137

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:151

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od.cxs""

> ui tool show ""Side View""

> select #3.4/Ad:109

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> distance #3.4/Ad:109@OD1 #3.1/Aa:163@NH1

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad ASN 109
OD1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163 NH1:
14.827Å  

> ~distance #3.4/Ad:109@OD1 #3.1/Aa:163@NH1

> distance #3.1/Aa:163@NH1 #3.4/Ad:117@OE1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163
NH1 and chains_filament16_real_space_refined.pdb Ad #3.4/Ad GLU 117 OE1:
4.957Å  

> distance #3.4/Ad:109@OD1 #3.1/Aa:155@OG

Distance between chains_filament16_real_space_refined.pdb Ad #3.4/Ad ASN 109
OD1 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa SER 155 OG: 3.725Å  

> turn y 180

[Repeated 18 time(s)]

> select #3.4/Ad:129

7 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> turn y 180

[Repeated 4 time(s)]

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od1.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od1.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> undo

[Repeated 1 time(s)]

> select clear

> color sel lime

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od1.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od2.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/od-od.cxs""

> hide #!5 models

> select #3.4/Ad:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.4/Ad

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> hide sel atoms

> select #3.1/Aa:456-457

12 atoms, 11 bonds, 2 residues, 1 model selected  

> select #3.1/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> hide sel atoms

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/celoten.cxs""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 1/celoten.png"" width 3000 height
> 2435 supersample 3

> show #!3.3 models

> hide #!3.4 models

> hide #!3.1,3 surfaces

> select add #3.3

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> ui tool show ""Color Actions""

> color sel aquamarine

> color sel medium aquamarine

> color sel mint cream

> color sel pale turquoise

> show #!3.4 models

> ui tool show ""Color Actions""

> color #3.3 #a4c4b3ff

> color #3.3 #dbfdefff

> color #3.3 #cdf4e1ff

> hide #!3.4 models

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/celoten.png"" width 3000 height
> 2435 supersample 3

> show #!3.4 models

> hide #!3.3 models

> select clear

> select #3.4/Ad:450

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:126

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:127

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

[Repeated 1 time(s)]

> select clear

> select #3.1/Aa:128

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.4/Ad:453

10 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:164

11 atoms, 11 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:157

10 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:132

10 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> show #!3.3 models

> hide #!3.4 models

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:169-457

1509 atoms, 1534 bonds, 2 pseudobonds, 193 residues, 2 models selected  

> hide sel cartoons

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.3/Ac

Alignment identifier is 3.3/Ac  

> select #3.3/Ac:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:101-183

666 atoms, 678 bonds, 83 residues, 1 model selected  

> hide sel cartoons

[Repeated 1 time(s)]

> hide sel atoms

[Repeated 1 time(s)]

> select clear

> hide #!3.1,3 atoms

> select #3.1/Aa:113

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:106

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:362

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select clear

> color #3.1,3#!3 byhetero

> distance #3.1/Aa:106@NH1 #3.3/Ac:362@OD2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 106
NH1 and chains_filament16_real_space_refined.pdb Ac #3.3/Ac ASP 362 OD2:
2.728Å  

> distance #3.3/Ac:362@OD2 #3.1/Aa:106@NH1

Distance already exists; modify distance properties with 'distance style'  

> show #!5 models

> color sel lime

> select #3.1/Aa:145

11 atoms, 10 bonds, 1 residue, 1 model selected  

> ui mousemode right ""translate selected models""

[Repeated 1 time(s)]

> show sel atoms

> select #3.3/Ac:357

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:358

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:359

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

[Repeated 1 time(s)]

> select #3.3/Ac:360

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select clear

> select #3.3/Ac:358

6 atoms, 5 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:145

11 atoms, 10 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.3/Ac:359

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.3/Ac:357

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:115

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:389

6 atoms, 5 bonds, 1 residue, 1 model selected  

> show sel atoms

> ui mousemode right distance

> distance #3.1/Aa:115@OH #3.3/Ac:389@OG

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa TYR 115
OH and chains_filament16_real_space_refined.pdb Ac #3.3/Ac SER 389 OG: 2.696Å  

> select #3.1/Aa:116

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:374

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:116@NH1 #3.3/Ac:374@OD2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 116
NH1 and chains_filament16_real_space_refined.pdb Ac #3.3/Ac ASP 374 OD2:
3.301Å  

> color sel lime

> select #3.1/Aa:120

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:445

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.1/Aa:120@NZ #3.3/Ac:445@OD1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 120
NZ and chains_filament16_real_space_refined.pdb Ac #3.3/Ac ASN 445 OD1: 3.904Å  

> select #3.1/Aa:138

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:135

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:440

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:135

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.3/Ac:393

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:142

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:394

11 atoms, 11 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:142

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:141

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:390

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:142

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

[Repeated 1 time(s)]

> select #3.1/Aa:119

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:386

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.3/Ac:390

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:440

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.3/Ac:443

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

[Repeated 1 time(s)]

> hide sel atoms

> cartoon style (#!3.3 & sel) modeHelix tube sides 20

[Repeated 1 time(s)]

> cartoon style (#!3.3 & sel & coil) xsection oval

> cartoon style (#!3.3 & sel) xsection barbell modeHelix default

> select clear

> select #3.1/Aa:138

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> turn y 180

[Repeated 1 time(s)]

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface1.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> turn y 180

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface2.png"" width 3000
> height 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 2/interface.cxs""

——— End of log from Tue Jan 28 14:16:05 2025 ———

opened ChimeraX session  

> close #4

> show #!3.2 models

> ui tool show ""Side View""

> hide #!3.1 models

> show #!3.1 models

> hide #!3.2 models

> show #!3.5 models

> hide #!3.5 models

> show #!3.5 models

> hide #!3.5 models

> show #!3.7 models

> hide #!3.7 models

> show #!3.9 models

> show #!3.8 models

> hide #!3.8 models

> hide #!3.9 models

> show #!3.10 models

> hide #!3.10 models

> show #!3.11 models

> show #!3.12 models

> hide #!3.11 models

> hide #!3.12 models

> show #!3.14 models

> hide #!3.14 models

> show #!3.15 models

> hide #!3.15 models

> show #!3.16 models

> hide #!3.16 models

> show #!3.17 models

> hide #!3.17 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.20 models

> hide #!3.20 models

> show #!3.21 models

> hide #!3.21 models

> show #!3.21 models

> hide #!3.21 models

> show #!3.22 models

> hide #!3.22 models

> show #!3.21 models

> hide #!3.21 models

> select #3.3/Ac:407-457

409 atoms, 416 bonds, 51 residues, 1 model selected  

> select #3.3/Ac

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> show #!3.21 models

> hide sel surfaces

> select clear

> hide #!3.1,3,21 surfaces

> color #3.21 #e0fef3ff

> color #3.21 #c8e7d8ff

> cartoon style (#3.1,3,21#!3,5 & coil) xsection oval

> cartoon style #3.1,3,21#!3,5 xsection barbell modeHelix default

> hide #!3.3 models

> hide #!3.1,21 atoms

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/celotna.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/celotna.cxs""

> select #3.1/Aa:265

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:261

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:258

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:254

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:254

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:258

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:261

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.21/Au:265

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:298-457

994 atoms, 1015 bonds, 1 pseudobond, 126 residues, 2 models selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:297

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:270-297

213 atoms, 215 bonds, 28 residues, 1 model selected  

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:272-297

196 atoms, 198 bonds, 26 residues, 1 model selected  

> surface hidePatches (#!3.1 & sel)

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.21/Au

Alignment identifier is 3.21/Au  

> select #3.21/Au:449-457

77 atoms, 78 bonds, 9 residues, 1 model selected  

> select #3.21/Au:272-457

1190 atoms, 1214 bonds, 1 pseudobond, 152 residues, 2 models selected  

> cartoon hide (#!3.21 & sel)

> select #3.21/Au:189

10 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.21/Au:101-189

709 atoms, 722 bonds, 89 residues, 1 model selected  

> cartoon hide (#!3.21 & sel)

> select #3.1/Aa:189

10 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:101-189

709 atoms, 722 bonds, 89 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:281-282

14 atoms, 13 bonds, 2 residues, 1 model selected  

> select #3.1/Aa:281-297

132 atoms, 134 bonds, 17 residues, 1 model selected  

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:272-297

196 atoms, 198 bonds, 26 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> select #3.1/Aa:266

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:266-271

45 atoms, 44 bonds, 6 residues, 1 model selected  

> hide (#!3.1 & sel) target a

> select #3.21/Au:266

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.21/Au:266-275

75 atoms, 74 bonds, 10 residues, 1 model selected  

> select #3.21/Au:267-268

13 atoms, 12 bonds, 2 residues, 1 model selected  

> select #3.21/Au:267-284

128 atoms, 127 bonds, 18 residues, 1 model selected  

> cartoon hide (#!3.21 & sel)

> select #3.1/Aa:267

4 atoms, 3 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:267-278

87 atoms, 86 bonds, 12 residues, 1 model selected  

> cartoon hide (#!3.1 & sel)

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/interface.cxs""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 3/interface.png"" width 3000
> height 2435 supersample 3 transparentBackground true

[Repeated 1 time(s)]

> undo

> surface hidePatches (#!3.1 & sel)

> select #3.1/Aa:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.1/Aa

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> select #3.21/Au:457

5 atoms, 4 bonds, 1 residue, 1 model selected  

> select #3.21/Au

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 2 models selected  

> show sel cartoons

> ui tool show ""Model Panel""

> show #!3.2 models

> show sel surfaces

> select clear

> show #!3.1-2,21 surfaces

> hide #!3.1-2,21 surfaces

> ui tool show ""Show Sequence Viewer""

> sequence chain #3.2/Ab

Alignment identifier is 3.2/Ab  

> select #3.2/Ab:105

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:105-386

1462 atoms, 1484 bonds, 2 pseudobonds, 186 residues, 2 models selected  

> select #3.2/Ab:386-387

13 atoms, 12 bonds, 2 residues, 1 model selected  

> select #3.2/Ab:101-387

1507 atoms, 1532 bonds, 2 pseudobonds, 191 residues, 2 models selected  

> select #3.2/Ab:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:101

12 atoms, 12 bonds, 1 residue, 1 model selected  

> color #3.2 #daf6e9ff

> color #3.2 #d4efe3ff

> select add #3.2

2056 atoms, 2093 bonds, 2 pseudobonds, 261 residues, 5 models selected  

> select subtract #3.2

1 model selected  

> hide #!3.21 models

> hide #!3.1-2 atoms

> select #3.1/Aa:173

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:285

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select clear

[Repeated 1 time(s)]

> hide #!3.1-2 atoms

> cartoon style (#3.1-2#!3,5 & coil) xsection oval

> cartoon style #3.1-2#!3,5 xsection barbell modeHelix default

> ui tool show ""Side View""

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/celotna.png"" width 3000 height
> 2435 supersample 3 transparentBackground true

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/celotna.cxs""

> select #3.1/Aa:173

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:284

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> select clear

> color #3.1-2#!3,5 byhetero

> select #3.2/Ab:285

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:163

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:120

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:117

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> distance #3.2/Ab:117@OE2 #3.1/Aa:163@NH1

Distance between chains_filament16_real_space_refined.pdb Ab #3.2/Ab GLU 117
OE2 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ARG 163 NH1:
5.233Å  

> show #5.1 models

> hide #5.1 models

> ui tool show ""Color Actions""

> color sel lime

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select clear

[Repeated 1 time(s)]

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select add #3.1/Aa:173@NZ

2 atoms, 2 residues, 3 models selected  

> select subtract #3.2/Ab:284@OD2

1 atom, 1 residue, 3 models selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  
Drag select of 1 atoms  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> select #3.2/Ab:284@OD2

1 atom, 1 residue, 1 model selected  

> select clear

> select #3.1/Aa:173@NZ

1 atom, 1 residue, 1 model selected  

> distance #3.1/Aa:173@NZ #3.2/Ab:284@OD2

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 173
NZ and chains_filament16_real_space_refined.pdb Ab #3.2/Ab ASP 284 OD2: 3.248Å  

> distance #3.1/Aa:173@NZ #3.2/Ab:285@OD1

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa LYS 173
NZ and chains_filament16_real_space_refined.pdb Ab #3.2/Ab ASN 285 OD1: 3.099Å  

> color sel lime

> select #3.2/Ab:187

9 atoms, 8 bonds, 1 residue, 1 model selected  

> ui mousemode right ""translate selected models""

> show sel atoms

> select #3.1/Aa:268

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> ui mousemode right distance

> distance #3.1/Aa:268@OE2 #3.2/Ab:187@NZ

Distance between chains_filament16_real_space_refined.pdb Aa #3.1/Aa GLU 268
OE2 and chains_filament16_real_space_refined.pdb Ab #3.2/Ab LYS 187 NZ: 5.543Å  

> select clear

> color sel lime

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:276

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:275

7 atoms, 6 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:274

5 atoms, 4 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:277

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #3.2/Ab:287

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

Drag select of 1 residues  

> select #3.2/Ab:290

7 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:287

12 atoms, 12 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.2/Ab:286@CA

1 atom, 1 residue, 1 model selected  

> hide sel atoms

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:277

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:276

7 atoms, 6 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:275

7 atoms, 6 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:274

5 atoms, 4 bonds, 1 residue, 1 model selected  

> hide sel atoms

> show sel atoms

> hide sel atoms

> select #3.2/Ab:437

11 atoms, 10 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:272

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> select #3.1/Aa:411

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.1/Aa:273

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> select #3.2/Ab:287

12 atoms, 12 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:288

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.2/Ab:289

12 atoms, 12 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select #3.2/Ab:286

8 atoms, 7 bonds, 1 residue, 1 model selected  

> hide sel atoms

> distance #3.2/Ab:437@NH2 #3.1/Aa:411@OD2

Distance between chains_filament16_real_space_refined.pdb Ab #3.2/Ab ARG 437
NH2 and chains_filament16_real_space_refined.pdb Aa #3.1/Aa ASP 411 OD2:
7.180Å  

> show #5.1 models

> hide #5.1 models

> select clear

[Repeated 2 time(s)]

> color sel lime

> select #3.1/Aa:277

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> select #3.1/Aa:413

9 atoms, 8 bonds, 1 residue, 1 model selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> hide sel atoms

> select #3.1/Aa:271

9 atoms, 8 bonds, 1 residue, 1 model selected  

> hide sel atoms

> select clear

> save ""/Users/nezakoritnik/Desktop/INTERFACE 4/interakcijska površina.cxs""

——— End of log from Wed Jan 29 07:29:35 2025 ———

opened ChimeraX session  




OpenGL version: 4.1 Metal - 83
OpenGL renderer: Apple M1
OpenGL vendor: Apple

Python: 3.11.4
Locale: UTF-8
Qt version: PyQt6 6.7.1, Qt 6.7.1
Qt runtime version: 6.7.3
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: MacBook Air
      Model Identifier: MacBookAir10,1
      Model Number: Z128000N6ZE/A
      Chip: Apple M1
      Total Number of Cores: 8 (4 performance and 4 efficiency)
      Memory: 16 GB
      System Firmware Version: 8419.80.7
      OS Loader Version: 8419.80.7

Software:

    System Software Overview:

      System Version: macOS 13.2 (22D49)
      Kernel Version: Darwin 22.3.0
      Time since boot: 16 days, 19 hours, 49 minutes

Graphics/Displays:

    Apple M1:

      Chipset Model: Apple M1
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 8
      Vendor: Apple (0x106b)
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-In Retina LCD
          Resolution: 2560 x 1600 Retina
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal
        HP E243i:
          Resolution: 1920 x 1200 (WUXGA - Widescreen Ultra eXtended Graphics Array)
          UI Looks like: 1920 x 1200 @ 60.00Hz
          Mirror: Off
          Online: Yes
          Rotation: Supported


Installed Packages:
    alabaster: 1.0.0
    anyio: 4.7.0
    appdirs: 1.4.4
    appnope: 0.1.4
    asttokens: 3.0.0
    auditwheel: 6.1.0
    babel: 2.16.0
    beautifulsoup4: 4.12.3
    blockdiag: 3.0.0
    blosc2: 3.0.0
    build: 1.2.1
    certifi: 2023.11.17
    cftime: 1.6.4.post1
    charset-normalizer: 3.4.0
    ChimeraX-AddCharge: 1.5.18
    ChimeraX-AddH: 2.2.6
    ChimeraX-AlignmentAlgorithms: 2.0.2
    ChimeraX-AlignmentHdrs: 3.5
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.16.1
    ChimeraX-AlphaFold: 1.0.1
    ChimeraX-AltlocExplorer: 1.1.2
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.58.8
    ChimeraX-AtomicLibrary: 14.1.11
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.4
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 3.0.0
    ChimeraX-BondRot: 2.0.4
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.13.1
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.4.0
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.4
    ChimeraX-ChangeChains: 1.1
    ChimeraX-CheckWaters: 1.4
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.3
    ChimeraX-ColorActions: 1.0.5
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.6
    ChimeraX-CommandLine: 1.2.5
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.9
    ChimeraX-CoreFormats: 1.2
    ChimeraX-coulombic: 1.4.4
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.3
    ChimeraX-Dicom: 1.2.6
    ChimeraX-DistMonitor: 1.4.2
    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: 1.4.1
    ChimeraX-Hbonds: 2.5
    ChimeraX-Help: 1.3
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.3
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-KVFinder: 1.2.1
    ChimeraX-Label: 1.1.14
    ChimeraX-ListInfo: 1.2.2
    ChimeraX-Log: 1.2
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.9.1
    ChimeraX-Map: 1.3
    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: 2.1.6
    ChimeraX-MCopy: 1.0
    ChimeraX-MDcrds: 2.7.2
    ChimeraX-MedicalToolbar: 1.1
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.14.2
    ChimeraX-MMTF: 2.2
    ChimeraX-ModelArchive: 1.0
    ChimeraX-Modeller: 1.5.18
    ChimeraX-ModelPanel: 1.5
    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-MutationScores: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.2
    ChimeraX-NMRSTAR: 1.0.2
    ChimeraX-NRRD: 1.2
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.14
    ChimeraX-OrthoPick: 1.0.1
    ChimeraX-PDB: 2.7.6
    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: 1.1.2
    ChimeraX-PubChem: 2.2
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.2
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.6.2
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.3.1
    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-Segmentations: 3.5.6
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.14
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.2.0
    ChimeraX-ShowSequences: 1.0.3
    ChimeraX-SideView: 1.0.1
    ChimeraX-SimilarStructures: 1.0.1
    ChimeraX-Smiles: 2.1.2
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.18.1
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.2.1
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.5
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-TaskManager: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.2.3
    ChimeraX-ToolshedUtils: 1.2.4
    ChimeraX-Topography: 1.0
    ChimeraX-ToQuest: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.41
    ChimeraX-Umap: 1.0
    ChimeraX-uniprot: 2.3.1
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.4.4
    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: 1.1.4
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.2.2
    contourpy: 1.3.1
    cxservices: 1.2.3
    cycler: 0.12.1
    Cython: 3.0.10
    debugpy: 1.8.9
    decorator: 5.1.1
    docutils: 0.21.2
    executing: 2.1.0
    filelock: 3.15.4
    fonttools: 4.55.3
    funcparserlib: 2.0.0a0
    glfw: 2.8.0
    grako: 3.16.5
    h11: 0.14.0
    h5py: 3.12.1
    html2text: 2024.2.26
    httpcore: 1.0.7
    httpx: 0.28.1
    idna: 3.10
    ihm: 1.3
    imagecodecs: 2024.6.1
    imagesize: 1.4.1
    ipykernel: 6.29.5
    ipython: 8.26.0
    ipywidgets: 8.1.5
    jedi: 0.19.1
    Jinja2: 3.1.4
    jupyter_client: 8.6.2
    jupyter_core: 5.7.2
    jupyterlab_widgets: 3.0.13
    kiwisolver: 1.4.7
    line_profiler: 4.1.3
    lxml: 5.2.2
    lz4: 4.3.3
    MarkupSafe: 3.0.2
    matplotlib: 3.9.2
    matplotlib-inline: 0.1.7
    msgpack: 1.0.8
    ndindex: 1.9.2
    nest-asyncio: 1.6.0
    netCDF4: 1.6.5
    networkx: 3.3
    nibabel: 5.2.0
    nptyping: 2.5.0
    numexpr: 2.10.2
    numpy: 1.26.4
    openvr: 1.26.701
    packaging: 23.2
    ParmEd: 4.2.2
    parso: 0.8.4
    pep517: 0.13.1
    pexpect: 4.9.0
    pillow: 10.4.0
    pip: 24.2
    pkginfo: 1.11.1
    platformdirs: 4.3.6
    prompt_toolkit: 3.0.48
    psutil: 6.0.0
    ptyprocess: 0.7.0
    pure_eval: 0.2.3
    py-cpuinfo: 9.0.0
    pycollada: 0.8
    pydicom: 2.4.4
    pyelftools: 0.31
    Pygments: 2.18.0
    pynmrstar: 3.3.4
    pynrrd: 1.0.0
    PyOpenGL: 3.1.7
    PyOpenGL-accelerate: 3.1.7
    pyopenxr: 1.0.3401
    pyparsing: 3.2.0
    pyproject_hooks: 1.2.0
    PyQt6-commercial: 6.7.1
    PyQt6-Qt6: 6.7.3
    PyQt6-WebEngine-commercial: 6.7.0
    PyQt6-WebEngine-Qt6: 6.7.3
    PyQt6-WebEngineSubwheel-Qt6: 6.7.3
    PyQt6_sip: 13.8.0
    python-dateutil: 2.9.0.post0
    pytz: 2024.2
    pyzmq: 26.2.0
    qtconsole: 5.5.2
    QtPy: 2.4.2
    qtshim: 1.0
    RandomWords: 0.4.0
    requests: 2.32.3
    scipy: 1.14.0
    setuptools: 72.1.0
    sfftk-rw: 0.8.1
    six: 1.16.0
    sniffio: 1.3.1
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    soupsieve: 2.6
    Sphinx: 8.0.2
    sphinx-autodoc-typehints: 2.2.3
    sphinxcontrib-applehelp: 2.0.0
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 2.0.0
    sphinxcontrib-htmlhelp: 2.1.0
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 2.0.0
    sphinxcontrib-serializinghtml: 2.0.0
    stack-data: 0.6.3
    superqt: 0.6.3
    tables: 3.10.1
    tcia_utils: 1.5.1
    tifffile: 2024.7.24
    tinyarray: 1.2.4
    tornado: 6.4.2
    traitlets: 5.14.3
    typing_extensions: 4.12.2
    tzdata: 2024.2
    urllib3: 2.2.3
    wcwidth: 0.2.13
    webcolors: 24.6.0
    wheel: 0.43.0
    wheel-filename: 1.4.1
    widgetsnbextension: 4.0.13
}}}
"	defect	closed	normal		Window Toolkit		duplicate						all	ChimeraX
