parsing cs and angles

store_cs.py

import numpy as np

if __name__ == "__main__":
  # parse angles to get an array like
  x = [
    [160, 90],
    [80, 120]
  ]
  
  # save the parsed data
  np.save('ALA_angles.npy')
  
  # Do this for all the chemical shifts that you want, which is ha, hn, ca, cb, co, n of each of the three residues
  # parse chemical shifts to get an array like (you will need to specify the index of the atom you want)
  y = [150, 160]
  # save the parsed data (in this case central cb)
  np.save('ALA_central_cb_cs.npy')
  
  # The files can be loaded again with 'x = np.load('ALA_angles.npy')