*HEADER    TOXIN                                   02-JUL-20   6XN9              
*TITLE     SOLUTION NMR STRUCTURE OF RECIFIN, A CYSTEINE-RICH TYROSYL-DNA        
*TITLE    2 PHOSPHODIESTERASE I MODULATORY PEPTIDE FROM THE MARINE SPONGE        
*TITLE    3 AXINELLA SP.                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RECIFIN MODULATORY PEPTIDE;                                
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: AXINELLA SP. 1 TF-2017;                         
*SOURCE   3 ORGANISM_TAXID: 2041915                                              
*KEYWDS    CYSTINE-RICH PEPTIDE, PROTEIN KNOT, TYROSYL-DNA PHOSPHODIESTERASE I   
*KEYWDS   2 INHIBITOR, MARINE NATURAL PRODUCT, TOXIN                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.I.SCHROEDER,K.J.ROSENGREN,B.R.O'KEEFE                               
*REVDAT   1   10-FEB-21 6XN9    0                                                
# Restraints file 1: restraints.tbl
assign (resid 2     and name N    ) (resid 2     and name CA   ) (resid 2     and name CB   ) (resid 2     and name CG   )    1.0  -60.0   30.0 2 !NOE pattern and structures
assign (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name CB   ) (resid 4     and name CG   )    1.0  -60.0   30.0 2 !TALOS-N
assign (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name CB   ) (resid 5     and name SG   )    1.0  -60.0   30.0 2 !DISH
assign (resid 5     and name CA   ) (resid 5     and name CB   ) (resid 5     and name SG   ) (resid 21    and name SG   )    1.0  -60.0   30.0 2 !DISH
assign (resid 6     and name N    ) (resid 6     and name CA   ) (resid 6     and name CB   ) (resid 6     and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name CB   ) (resid 9     and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name CB   ) (resid 10    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name CB   ) (resid 11    and name SG   )    1.0  -60.0   30.0 2 !DISH
assign (resid 11    and name CA   ) (resid 11    and name CB   ) (resid 11    and name SG   ) (resid 39    and name SG   )    1.0  -60.0   30.0 2 !DISH
assign (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name CB   ) (resid 12    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 13    and name N    ) (resid 13    and name CA   ) (resid 13    and name CB   ) (resid 13    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name CB   ) (resid 14    and name CG   )    1.0  180.0   30.0 2 !NOE and structures
assign (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name CB   ) (resid 17    and name OG   )    1.0   60.0   30.0 2 !TALOS
assign (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name CB   ) (resid 21    and name SG   )    1.0  180.0   30.0 2 !DISH
assign (resid 21    and name CA   ) (resid 21    and name CB   ) (resid 21    and name SG   ) (resid 5     and name SG   )    1.0   60.0   30.0 2 !DISH
assign (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name CB   ) (resid 22    and name SG   )    1.0  -60.0   30.0 2 !NOE and structures 
assign (resid 23    and name N    ) (resid 23    and name CA   ) (resid 23    and name CB   ) (resid 23    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 29    and name N    ) (resid 29    and name CA   ) (resid 29    and name CB   ) (resid 29    and name OG   )    1.0   60.0   30.0 2 !TALOS
assign (resid 30    and name N    ) (resid 30    and name CA   ) (resid 30    and name CB   ) (resid 30    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 32    and name N    ) (resid 32    and name CA   ) (resid 32    and name CB   ) (resid 32    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 33    and name N    ) (resid 33    and name CA   ) (resid 33    and name CB   ) (resid 33    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 39    and name CA   ) (resid 39    and name CB   ) (resid 39    and name SG   ) (resid 39    and name SG   )    1.0   60.0   30.0 2 !DISH
assign (resid 39    and name N    ) (resid 39    and name CA   ) (resid 39    and name CB   ) (resid 11    and name CG   )    1.0  -60.0   30.0 2 !DISH
assign (resid 40    and name N    ) (resid 40    and name CA   ) (resid 40    and name CB   ) (resid 40    and name CG   )    1.0  -60.0   30.0 2 !TALOS
assign (resid 42    and name N    ) (resid 42    and name CA   ) (resid 42    and name CB   ) (resid 42    and name SG   )    1.0  -60.0   30.0 2 !NOE and structures
assign (resid 1     and name C    ) (resid 2     and name N    ) (resid 2     and name CA   ) (resid 2     and name C    )    1.0 -100.0   80.0 2 !Stronger sequential HA-HN than intra HA-HN
assign (resid 20    and name C    ) (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name C    )    1.0 -100.0   80.0 2 !Stronger sequential HA-HN than intra HA-HN
assign (resid 2     and name C    ) (resid 3     and name N    ) (resid 3     and name CA   ) (resid 3     and name C    )    1.0  -77.0   27.0 2
assign (resid 3     and name N    ) (resid 3     and name CA   ) (resid 3     and name C    ) (resid 4     and name N    )    1.0  140.6   20.0 2
assign (resid 4     and name C    ) (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name C    )    1.0  -99.9   20.0 2
assign (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name C    ) (resid 6     and name N    )    1.0  130.3   20.0 2
assign (resid 5     and name C    ) (resid 6     and name N    ) (resid 6     and name CA   ) (resid 6     and name C    )    1.0 -112.9   24.6 2
assign (resid 6     and name N    ) (resid 6     and name CA   ) (resid 6     and name C    ) (resid 7     and name N    )    1.0  138.8   21.2 2
assign (resid 6     and name C    ) (resid 7     and name N    ) (resid 7     and name CA   ) (resid 7     and name C    )    1.0  -75.1   26.2 2
assign (resid 7     and name C    ) (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    )    1.0 -115.8   43.3 2
assign (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    ) (resid 9     and name N    )    1.0  138.9   55.1 2
assign (resid 10    and name C    ) (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    )    1.0   54.8   30.0 2
assign (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    ) (resid 12    and name N    )    1.0   39.6   35.9 2
assign (resid 12    and name C    ) (resid 13    and name N    ) (resid 13    and name CA   ) (resid 13    and name C    )    1.0 -104.1   49.9 2
assign (resid 13    and name N    ) (resid 13    and name CA   ) (resid 13    and name C    ) (resid 14    and name N    )    1.0  122.2   39.4 2
assign (resid 13    and name C    ) (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name C    )    1.0  -79.0   36.5 2
assign (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name C    ) (resid 15    and name N    )    1.0  134.7   21.4 2
assign (resid 14    and name C    ) (resid 15    and name N    ) (resid 15    and name CA   ) (resid 15    and name C    )    1.0 -109.9   20.0 2
assign (resid 15    and name N    ) (resid 15    and name CA   ) (resid 15    and name C    ) (resid 16    and name N    )    1.0  -17.9   23.0 2
assign (resid 15    and name C    ) (resid 16    and name N    ) (resid 16    and name CA   ) (resid 16    and name C    )    1.0 -172.5   71.7 2
assign (resid 16    and name N    ) (resid 16    and name CA   ) (resid 16    and name C    ) (resid 17    and name N    )    1.0  171.2   37.2 2
assign (resid 16    and name C    ) (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name C    )    1.0 -143.9   20.0 2
assign (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name C    ) (resid 18    and name N    )    1.0  151.1   20.0 2
assign (resid 17    and name C    ) (resid 18    and name N    ) (resid 18    and name CA   ) (resid 18    and name C    )    1.0 -122.6   54.0 2
assign (resid 18    and name N    ) (resid 18    and name CA   ) (resid 18    and name C    ) (resid 19    and name N    )    1.0  123.7   70.6 2
assign (resid 21    and name C    ) (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name C    )    1.0  -88.5   35.3 2
assign (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name C    ) (resid 23    and name N    )    1.0   -5.3   30.0 2
assign (resid 24    and name C    ) (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    and name C    )    1.0  -56.6   20.0 2
assign (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    and name C    ) (resid 26    and name N    )    1.0  132.3   20.0 2
assign (resid 26    and name C    ) (resid 27    and name N    ) (resid 27    and name CA   ) (resid 27    and name C    )    1.0 -112.5   27.7 2
assign (resid 27    and name N    ) (resid 27    and name CA   ) (resid 27    and name C    ) (resid 28    and name N    )    1.0  155.1   20.0 2
assign (resid 27    and name C    ) (resid 28    and name N    ) (resid 28    and name CA   ) (resid 28    and name C    )    1.0 -127.2   30.7 2
assign (resid 28    and name N    ) (resid 28    and name CA   ) (resid 28    and name C    ) (resid 29    and name N    )    1.0  149.8   27.4 2
assign (resid 28    and name C    ) (resid 29    and name N    ) (resid 29    and name CA   ) (resid 29    and name C    )    1.0 -141.8   25.2 2
assign (resid 29    and name N    ) (resid 29    and name CA   ) (resid 29    and name C    ) (resid 30    and name N    )    1.0  147.9   22.3 2
assign (resid 29    and name C    ) (resid 30    and name N    ) (resid 30    and name CA   ) (resid 30    and name C    )    1.0  -95.0   27.7 2
assign (resid 30    and name C    ) (resid 31    and name N    ) (resid 31    and name CA   ) (resid 31    and name C    )    1.0 -132.6   27.0 2
assign (resid 31    and name N    ) (resid 31    and name CA   ) (resid 31    and name C    ) (resid 32    and name N    )    1.0  142.5   24.6 2
assign (resid 31    and name C    ) (resid 32    and name N    ) (resid 32    and name CA   ) (resid 32    and name C    )    1.0  -70.7   30.0 2
assign (resid 32    and name N    ) (resid 32    and name CA   ) (resid 32    and name C    ) (resid 33    and name N    )    1.0  132.8   30.0 2
assign (resid 34    and name N    ) (resid 34    and name CA   ) (resid 34    and name C    ) (resid 35    and name N    )    1.0  154.0   21.6 2
assign (resid 35    and name N    ) (resid 35    and name CA   ) (resid 35    and name C    ) (resid 36    and name N    )    1.0  147.5   22.5 2
assign (resid 36    and name N    ) (resid 36    and name CA   ) (resid 36    and name C    ) (resid 37    and name N    )    1.0  -35.0   20.0 2
assign (resid 36    and name C    ) (resid 37    and name N    ) (resid 37    and name CA   ) (resid 37    and name C    )    1.0  -72.5   20.0 2
assign (resid 37    and name N    ) (resid 37    and name CA   ) (resid 37    and name C    ) (resid 38    and name N    )    1.0  -15.7   20.0 2
assign (resid 37    and name C    ) (resid 38    and name N    ) (resid 38    and name CA   ) (resid 38    and name C    )    1.0  -97.5   20.0 2
assign (resid 38    and name C    ) (resid 39    and name N    ) (resid 39    and name CA   ) (resid 39    and name C    )    1.0  -72.0   26.1 2
assign (resid 39    and name N    ) (resid 39    and name CA   ) (resid 39    and name C    ) (resid 40    and name N    )    1.0  135.4   23.9 2
assign (resid 4     and name HN   ) (resid 29    and name O    )    2.30    2.30    0.00
assign (resid 4     and name N    ) (resid 29    and name O    )    3.30    3.30    0.00
assign (resid 4     and name O    ) (resid 29    and name HN   )    2.30    2.30    0.00
assign (resid 4     and name O    ) (resid 29    and name N    )    3.30    3.30    0.00
assign (resid 6     and name HN   ) (resid 27    and name O    )    2.30    2.30    0.00
assign (resid 6     and name N    ) (resid 27    and name O    )    3.30    3.30    0.00
assign (resid 6     and name O    ) (resid 27    and name HN   )    2.30    2.30    0.00
assign (resid 6     and name O    ) (resid 27    and name N    )    3.30    3.30    0.00
assign (resid 28    and name O    ) (resid 40    and name HN   )    2.30    2.30    0.00
assign (resid 28    and name O    ) (resid 40    and name N    )    3.30    3.30    0.00
assign (resid 28    and name HN   ) (resid 40    and name O    )    2.30    2.30    0.00
assign (resid 28    and name N    ) (resid 40    and name O    )    3.30    3.30    0.00
assign (resid 5     and name HN   ) (resid 16    and name O    )    2.30    2.30    0.00
assign (resid 5     and name N    ) (resid 16    and name O    )    3.30    3.30    0.00
assign (resid 8     and name O    ) (resid 11    and name HN   )    2.30    2.30    0.00
assign (resid 8     and name O    ) (resid 11    and name N    )    3.30    3.30    0.00
assign (resid 6     and name HH   ) (resid 31    and name O    )    2.30    2.30    0.00
assign (resid 6     and name OH   ) (resid 31    and name O    )    3.30    3.30    0.00
assign (resid 8     and name O    ) (resid 27    and name HG   )    2.30    2.30    0.00
assign (resid 8     and name O    ) (resid 27    and name OG   )    3.30    3.30    0.00
assign (resid 29    and name HG   ) (resid 31    and name O    )    2.30    2.30    0.00
assign (resid 29    and name OG   ) (resid 31    and name O    )    3.30    3.30    0.00
assign (resid 22    and name HA   ) (resid 24    and name HN   )    4.00    4.00    0.00 
assign (resid 6     and name HB2  ) (resid 13    and name HN   )    4.00    4.00    0.00 
assign (resid 13    and name HB1  ) (resid 7     and name HN   )    4.00    4.00    0.00 
assign (resid 13    and name HB2  ) (resid 7     and name HN   )    3.50    3.50    0.00 
assign (resid 6     and name HD2  ) (resid 13    and name HN   )    4.00    4.00    0.00 
assign (resid 9     and name HA   ) (resid 27    and name HG   )    3.50    3.50    0.00 
assign (resid 21    and name HA   ) (resid 18    and name HD1# )    4.00    4.00    0.00 
assign (resid 9     and name HA   ) (resid 9     and name HD#  )    3.78    3.78    0.00
assign (resid 3     and name HN   ) (resid 3     and name HB#  )    3.30    3.30    0.00
assign (resid 2     and name HN   ) (resid 2     and name HG#  )    4.05    4.05    0.00
assign (resid 2     and name HA   ) (resid 3     and name HN   )    3.05    3.05    0.00
assign (resid 2     and name HB1  ) (resid 3     and name HN   )    4.87    4.87    0.00
assign (resid 2     and name HB2  ) (resid 3     and name HN   )    4.87    4.87    0.00
assign (resid 2     and name HG#  ) (resid 3     and name HN   )    5.50    5.50    0.00
assign (resid 4     and name HN   ) (resid 4     and name HB2  )    3.52    3.52    0.00
assign (resid 3     and name HB#  ) (resid 4     and name HN   )    3.65    3.65    0.00
assign (resid 3     and name HB#  ) (resid 29    and name HN   )    4.12    4.12    0.00
assign (resid 3     and name HB#  ) (resid 30    and name HD#  )    4.16    4.16    0.00
assign (resid 5     and name HN   ) (resid 5     and name HB1  )    3.80    3.80    0.00
assign (resid 5     and name HN   ) (resid 5     and name HB2  )    3.80    3.80    0.00
assign (resid 4     and name HB1  ) (resid 5     and name HN   )    4.43    4.43    0.00
assign (resid 4     and name HB2  ) (resid 5     and name HN   )    5.50    5.50    0.00
assign (resid 4     and name HA   ) (resid 5     and name HN   )    3.19    3.19    0.00
assign (resid 5     and name HA   ) (resid 6     and name HN   )    3.08    3.08    0.00
assign (resid 28    and name HB2  ) (resid 40    and name HD#  )    5.50    5.50    0.00
assign (resid 7     and name HN   ) (resid 7     and name HB2  )    4.18    4.18    0.00
assign (resid 7     and name HN   ) (resid 7     and name HB1  )    4.18    4.18    0.00
assign (resid 6     and name HA   ) (resid 7     and name HN   )    3.15    3.15    0.00
assign (resid 8     and name HN   ) (resid 8     and name HB1  )    3.78    3.78    0.00
assign (resid 8     and name HN   ) (resid 8     and name HB2  )    3.78    3.78    0.00
assign (resid 9     and name HN   ) (resid 9     and name HG2  )    4.28    4.28    0.00
assign (resid 9     and name HN   ) (resid 9     and name HG1  )    4.28    4.28    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB2  )    3.97    3.97    0.00
assign (resid 8     and name HA   ) (resid 9     and name HN   )    3.35    3.35    0.00
assign (resid 7     and name HN   ) (resid 8     and name HN   )    3.41    3.41    0.00
assign (resid 10    and name HA   ) (resid 10    and name HE#  )    4.62    4.62    0.00
assign (resid 10    and name HA   ) (resid 10    and name HD#  )    3.30    3.30    0.00
assign (resid 9     and name HN   ) (resid 10    and name HN   )    3.57    3.57    0.00
assign (resid 25    and name HB2  ) (resid 25    and name HE   )    5.50    5.50    0.00
assign (resid 25    and name HB1  ) (resid 25    and name HE   )    5.50    5.50    0.00
assign (resid 32    and name HA   ) (resid 32    and name HD1# )    4.01    4.01    0.00
assign (resid 32    and name HA   ) (resid 32    and name HD2# )    4.01    4.01    0.00
assign (resid 32    and name HB2  ) (resid 32    and name HD2# )    3.99    3.99    0.00
assign (resid 32    and name HB1  ) (resid 32    and name HD2# )    3.99    3.99    0.00
assign (resid 32    and name HB2  ) (resid 32    and name HD1# )    3.99    3.99    0.00
assign (resid 32    and name HB1  ) (resid 32    and name HD1# )    3.99    3.99    0.00
assign (resid 31    and name HN   ) (resid 31    and name HG#  )    4.36    4.36    0.00
assign (resid 30    and name HB1  ) (resid 31    and name HN   )    5.32    5.32    0.00
assign (resid 30    and name HB2  ) (resid 31    and name HN   )    5.32    5.32    0.00
assign (resid 30    and name HA   ) (resid 30    and name HD#  )    3.42    3.42    0.00
assign (resid 30    and name HN   ) (resid 31    and name HN   )    3.45    3.45    0.00
assign (resid 30    and name HN   ) (resid 30    and name HD#  )    4.66    4.66    0.00
assign (resid 6     and name HB1  ) (resid 6     and name HD2  )    3.68    3.68    0.00
assign (resid 28    and name HB2  ) (resid 29    and name HN   )    3.38    3.38    0.00
assign (resid 28    and name HB1  ) (resid 29    and name HN   )    4.12    4.12    0.00
assign (resid 28    and name HA   ) (resid 29    and name HN   )    3.23    3.23    0.00
assign (resid 31    and name HA   ) (resid 32    and name HN   )    3.21    3.21    0.00
assign (resid 32    and name HA   ) (resid 33    and name HN   )    3.11    3.11    0.00
assign (resid 32    and name HN   ) (resid 32    and name HG   )    4.12    4.12    0.00
assign (resid 6     and name HH   ) (resid 32    and name HD2# )    5.50    5.50    0.00
assign (resid 4     and name HE#  ) (resid 32    and name HD2# )    4.86    4.86    0.00
assign (resid 14    and name HD#  ) (resid 32    and name HD2# )    5.50    5.50    0.00
assign (resid 14    and name HE#  ) (resid 32    and name HD2# )    5.16    5.16    0.00
assign (resid 6     and name HH   ) (resid 32    and name HD1# )    5.50    5.50    0.00
assign (resid 33    and name HA   ) (resid 33    and name HG1  )    4.15    4.15    0.00
assign (resid 33    and name HA   ) (resid 33    and name HG2  )    4.15    4.15    0.00
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assign (resid 37    and name HB2  ) (resid 37    and name HE3  )    4.16    4.16    0.00
assign (resid 36    and name HD1  ) (resid 37    and name HN   )    4.55    4.55    0.00
assign (resid 17    and name HN   ) (resid 17    and name HB#  )    3.28    3.28    0.00
assign (resid 17    and name HA   ) (resid 18    and name HN   )    3.22    3.22    0.00
assign (resid 17    and name HB#  ) (resid 18    and name HN   )    5.00    5.00    0.00
assign (resid 18    and name HA   ) (resid 18    and name HG2# )    3.32    3.32    0.00
assign (resid 18    and name HA   ) (resid 19    and name HD2  )    3.18    3.18    0.00
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assign (resid 16    and name HA1  ) (resid 17    and name HN   )    3.36    3.36    0.00
assign (resid 15    and name HN   ) (resid 15    and name HG12 )    4.36    4.36    0.00
assign (resid 35    and name HB1  ) (resid 37    and name HZ2  )    5.18    5.18    0.00
assign (resid 12    and name HN   ) (resid 12    and name HB1  )    4.03    4.03    0.00
assign (resid 12    and name HN   ) (resid 12    and name HB2  )    4.03    4.03    0.00
assign (resid 12    and name HN   ) (resid 12    and name HG#  )    3.63    3.63    0.00
assign (resid 12    and name HB1  ) (resid 13    and name HN   )    4.72    4.72    0.00
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assign (resid 12    and name HG#  ) (resid 13    and name HN   )    5.50    5.50    0.00
assign (resid 13    and name HA   ) (resid 14    and name HN   )    2.88    2.88    0.00
assign (resid 14    and name HA   ) (resid 15    and name HN   )    3.20    3.20    0.00
assign (resid 14    and name HN   ) (resid 14    and name HB1  )    3.29    3.29    0.00
assign (resid 14    and name HN   ) (resid 14    and name HB2  )    3.34    3.34    0.00
assign (resid 27    and name HB#  ) (resid 28    and name HN   )    3.17    3.17    0.00
assign (resid 27    and name HA   ) (resid 28    and name HN   )    3.25    3.25    0.00
assign (resid 26    and name HA2  ) (resid 27    and name HN   )    3.51    3.51    0.00
assign (resid 26    and name HA1  ) (resid 27    and name HN   )    3.51    3.51    0.00
assign (resid 6     and name HE1  ) (resid 28    and name HA   )    4.13    4.13    0.00
assign (resid 28    and name HD#  ) (resid 29    and name HN   )    4.61    4.61    0.00
assign (resid 28    and name HN   ) (resid 28    and name HD#  )    3.88    3.88    0.00
assign (resid 6     and name HE1  ) (resid 29    and name HN   )    3.62    3.62    0.00
assign (resid 6     and name HE2  ) (resid 14    and name HN   )    4.63    4.63    0.00
assign (resid 6     and name HD2  ) (resid 14    and name HN   )    5.03    5.03    0.00
assign (resid 4     and name HN   ) (resid 29    and name HN   )    4.09    4.09    0.00
assign (resid 28    and name HN   ) (resid 40    and name HN   )    4.47    4.47    0.00
assign (resid 6     and name HN   ) (resid 27    and name HN   )    4.24    4.24    0.00
assign (resid 11    and name HN   ) (resid 12    and name HN   )    4.48    4.48    0.00
assign (resid 10    and name HN   ) (resid 12    and name HN   )    4.69    4.69    0.00
assign (resid 21    and name HN   ) (resid 22    and name HN   )    5.50    5.50    0.00
assign (resid 22    and name HN   ) (resid 23    and name HN   )    5.50    5.50    0.00
assign (resid 6     and name HN   ) (resid 6     and name HD1  )    3.52    3.52    0.00
assign (resid 4     and name HN   ) (resid 4     and name HD#  )    3.91    3.91    0.00
assign (resid 14    and name HN   ) (resid 14    and name HD#  )    4.40    4.40    0.00
assign (resid 40    and name HN   ) (resid 40    and name HD#  )    3.92    3.92    0.00
assign (resid 6     and name HD1  ) (resid 29    and name HN   )    5.02    5.02    0.00
assign (resid 5     and name HN   ) (resid 14    and name HE#  )    3.76    3.76    0.00
assign (resid 6     and name HE1  ) (resid 6     and name HH   )    3.30    3.30    0.00
assign (resid 37    and name HN   ) (resid 37    and name HE3  )    3.32    3.32    0.00
assign (resid 37    and name HN   ) (resid 38    and name HN   )    3.61    3.61    0.00
assign (resid 28    and name HD#  ) (resid 30    and name HE#  )    3.79    3.79    0.00
assign (resid 6     and name HN   ) (resid 28    and name HA   )    4.65    4.65    0.00
assign (resid 10    and name HN   ) (resid 11    and name HN   )    3.63    3.63    0.00
assign (resid 6     and name HB2  ) (resid 7     and name HN   )    4.07    4.07    0.00
assign (resid 12    and name HG#  ) (resid 12    and name HE21 )    3.89    3.89    0.00
assign (resid 12    and name HG#  ) (resid 12    and name HE22 )    3.89    3.89    0.00
assign (resid 14    and name HA   ) (resid 14    and name HD#  )    3.19    3.19    0.00
assign (resid 23    and name HN   ) (resid 23    and name HB1  )    4.20    4.20    0.00
assign (resid 23    and name HN   ) (resid 23    and name HB2  )    4.20    4.20    0.00
assign (resid 23    and name HA   ) (resid 23    and name HD#  )    4.16    4.16    0.00
assign (resid 5     and name HA   ) (resid 28    and name HA   )    3.57    3.57    0.00
assign (resid 34    and name HA   ) (resid 35    and name HD2  )    3.26    3.26    0.00
assign (resid 34    and name HA   ) (resid 35    and name HD1  )    3.28    3.28    0.00
assign (resid 35    and name HA   ) (resid 36    and name HD2  )    3.79    3.79    0.00
assign (resid 35    and name HA   ) (resid 36    and name HD1  )    3.79    3.79    0.00
assign (resid 15    and name HA   ) (resid 15    and name HG2# )    3.24    3.24    0.00
assign (resid 40    and name HA   ) (resid 41    and name HN   )    2.96    2.96    0.00
assign (resid 41    and name HA   ) (resid 42    and name HN   )    3.48    3.48    0.00
!assign (resid 20    and name HN   ) (resid 21    and name HN   )    5.50    5.50    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB1  )    3.97    3.97    0.00
assign (resid 15    and name HN   ) (resid 15    and name HG2# )    4.64    4.64    0.00
assign (resid 39    and name HA   ) (resid 40    and name HE#  )    5.20    5.20    0.00
assign (resid 15    and name HN   ) (resid 15    and name HD1# )    4.09    4.09    0.00
assign (resid 15    and name HN   ) (resid 16    and name HN   )    3.46    3.46    0.00
assign (resid 14    and name HD#  ) (resid 16    and name HN   )    3.86    3.86    0.00
assign (resid 14    and name HE#  ) (resid 16    and name HN   )    4.24    4.24    0.00
assign (resid 40    and name HN   ) (resid 41    and name HN   )    5.07    5.07    0.00
assign (resid 1     and name HA   ) (resid 1     and name HG#  )    3.83    3.83    0.00
assign (resid 26    and name HN   ) (resid 27    and name HN   )    4.65    4.65    0.00
assign (resid 32    and name HN   ) (resid 32    and name HB1  )    3.93    3.93    0.00
assign (resid 41    and name HA   ) (resid 41    and name HG2  )    4.04    4.04    0.00
assign (resid 41    and name HA   ) (resid 41    and name HG1  )    4.04    4.04    0.00
assign (resid 31    and name HG#  ) (resid 32    and name HN   )    4.10    4.10    0.00
assign (resid 10    and name HN   ) (resid 10    and name HD#  )    4.00    4.00    0.00
assign (resid 4     and name HD#  ) (resid 31    and name HN   )    4.39    4.39    0.00
assign (resid 38    and name HA   ) (resid 38    and name HG2  )    4.23    4.23    0.00
assign (resid 38    and name HA   ) (resid 38    and name HG1  )    4.23    4.23    0.00
assign (resid 39    and name HN   ) (resid 39    and name HB2  )    3.70    3.70    0.00
assign (resid 39    and name HN   ) (resid 39    and name HB1  )    3.70    3.70    0.00
assign (resid 38    and name HN   ) (resid 39    and name HN   )    3.20    3.20    0.00
assign (resid 27    and name HA   ) (resid 42    and name HN   )    3.82    3.82    0.00
assign (resid 5     and name HN   ) (resid 17    and name HA   )    4.47    4.47    0.00
assign (resid 4     and name HD#  ) (resid 30    and name HA   )    3.90    3.90    0.00
assign (resid 27    and name HA   ) (resid 28    and name HD#  )    4.09    4.09    0.00
assign (resid 6     and name HA   ) (resid 6     and name HD2  )    3.97    3.97    0.00
assign (resid 28    and name HE#  ) (resid 42    and name HA   )    3.82    3.82    0.00
assign (resid 6     and name HE2  ) (resid 14    and name HA   )    3.47    3.47    0.00
assign (resid 29    and name HA   ) (resid 40    and name HD#  )    3.81    3.81    0.00
assign (resid 29    and name HA   ) (resid 40    and name HE#  )    4.43    4.43    0.00
assign (resid 11    and name HN   ) (resid 27    and name HG   )    3.89    3.89    0.00
assign (resid 27    and name HN   ) (resid 27    and name HG   )    3.64    3.64    0.00
assign (resid 6     and name HH   ) (resid 29    and name HG   )    3.62    3.62    0.00
assign (resid 29    and name HG   ) (resid 31    and name HN   )    3.93    3.93    0.00
assign (resid 6     and name HH   ) (resid 29    and name HB1  )    5.48    5.48    0.00
assign (resid 36    and name HA   ) (resid 38    and name HN   )    5.50    5.50    0.00
assign (resid 3     and name HA   ) (resid 30    and name HD#  )    4.22    4.22    0.00
assign (resid 4     and name HE#  ) (resid 31    and name HA   )    3.36    3.36    0.00
assign (resid 4     and name HA   ) (resid 4     and name HD#  )    3.51    3.51    0.00
assign (resid 14    and name HE#  ) (resid 16    and name HA2  )    4.02    4.02    0.00
assign (resid 6     and name HE2  ) (resid 14    and name HB2  )    3.05    3.05    0.00
assign (resid 6     and name HD1  ) (resid 28    and name HB1  )    5.50    5.50    0.00
assign (resid 6     and name HE2  ) (resid 14    and name HB1  )    4.32    4.32    0.00
assign (resid 6     and name HD2  ) (resid 11    and name HA   )    4.09    4.09    0.00
assign (resid 4     and name HB1  ) (resid 14    and name HD#  )    3.96    3.96    0.00
assign (resid 6     and name HD1  ) (resid 11    and name HA   )    4.61    4.61    0.00
assign (resid 28    and name HE#  ) (resid 40    and name HB2  )    4.10    4.10    0.00
assign (resid 4     and name HB1  ) (resid 29    and name HN   )    5.30    5.30    0.00
assign (resid 6     and name HB2  ) (resid 28    and name HN   )    5.50    5.50    0.00
assign (resid 6     and name HB2  ) (resid 8     and name HN   )    4.23    4.23    0.00
assign (resid 33    and name HN   ) (resid 34    and name HD1  )    3.81    3.81    0.00
assign (resid 33    and name HN   ) (resid 34    and name HD2  )    3.81    3.81    0.00
assign (resid 11    and name HN   ) (resid 27    and name HB#  )    4.79    4.79    0.00
assign (resid 4     and name HB1  ) (resid 6     and name HH   )    4.69    4.69    0.00
assign (resid 6     and name HH   ) (resid 34    and name HD1  )    4.55    4.55    0.00
assign (resid 4     and name HB2  ) (resid 6     and name HH   )    4.18    4.18    0.00
assign (resid 6     and name HH   ) (resid 32    and name HA   )    3.96    3.96    0.00
assign (resid 6     and name HH   ) (resid 34    and name HD2  )    4.55    4.55    0.00
assign (resid 28    and name HE#  ) (resid 40    and name HB1  )    4.10    4.10    0.00
assign (resid 3     and name HB#  ) (resid 28    and name HE#  )    4.44    4.44    0.00
assign (resid 18    and name HN   ) (resid 18    and name HG12 )    4.04    4.04    0.00
assign (resid 7     and name HN   ) (resid 15    and name HG2# )    3.96    3.96    0.00
assign (resid 7     and name HN   ) (resid 15    and name HD1# )    4.34    4.34    0.00
assign (resid 18    and name HN   ) (resid 18    and name HG2# )    4.01    4.01    0.00
assign (resid 18    and name HN   ) (resid 18    and name HD1# )    4.22    4.22    0.00
assign (resid 17    and name HN   ) (resid 18    and name HG2# )    4.74    4.74    0.00
assign (resid 17    and name HN   ) (resid 18    and name HD1# )    5.40    5.40    0.00
assign (resid 35    and name HB2  ) (resid 37    and name HZ2  )    5.18    5.18    0.00
assign (resid 35    and name HG2  ) (resid 37    and name HE1  )    5.04    5.04    0.00
assign (resid 35    and name HG1  ) (resid 37    and name HE1  )    5.04    5.04    0.00
assign (resid 6     and name HA   ) (resid 14    and name HA   )    4.13    4.13    0.00
assign (resid 6     and name HH   ) (resid 29    and name HB2  )    5.48    5.48    0.00
assign (resid 21    and name HN   ) (resid 21    and name HB1  )    3.60    3.60    0.00
assign (resid 20    and name HB#  ) (resid 21    and name HN   )    5.34    5.34    0.00
assign (resid 6     and name HB1  ) (resid 8     and name HN   )    5.50    5.50    0.00
assign (resid 6     and name HB1  ) (resid 27    and name HN   )    4.96    4.96    0.00
assign (resid 14    and name HB2  ) (resid 15    and name HN   )    5.50    5.50    0.00
assign (resid 14    and name HB1  ) (resid 15    and name HN   )    5.48    5.48    0.00
assign (resid 21    and name HN   ) (resid 21    and name HB2  )    3.60    3.60    0.00
assign (resid 37    and name HD1  ) (resid 38    and name HG1  )    3.79    3.79    0.00
assign (resid 6     and name HB1  ) (resid 11    and name HN   )    4.71    4.71    0.00
assign (resid 6     and name HB2  ) (resid 11    and name HN   )    5.50    5.50    0.00
assign (resid 5     and name HA   ) (resid 29    and name HN   )    4.96    4.96    0.00
assign (resid 6     and name HD1  ) (resid 28    and name HA   )    3.08    3.08    0.00
assign (resid 28    and name HD#  ) (resid 42    and name HA   )    4.37    4.37    0.00
assign (resid 6     and name HH   ) (resid 34    and name HG#  )    4.57    4.57    0.00
assign (resid 6     and name HB2  ) (resid 12    and name HN   )    5.50    5.50    0.00
assign (resid 36    and name HG2  ) (resid 37    and name HE3  )    4.64    4.64    0.00
assign (resid 15    and name HB   ) (resid 15    and name HD1# )    3.51    3.51    0.00
assign (resid 3     and name HB#  ) (resid 28    and name HB2  )    3.56    3.56    0.00
assign (resid 6     and name HA   ) (resid 15    and name HN   )    3.78    3.78    0.00
assign (resid 18    and name HG2# ) (resid 19    and name HD1  )    3.87    3.87    0.00
assign (resid 16    and name HA1  ) (resid 18    and name HG2# )    4.47    4.47    0.00
assign (resid 17    and name HA   ) (resid 18    and name HG2# )    5.25    5.25    0.00
assign (resid 17    and name HA   ) (resid 18    and name HD1# )    5.50    5.50    0.00
assign (resid 3     and name HN   ) (resid 4     and name HN   )    5.48    5.48    0.00
assign (resid 23    and name HA   ) (resid 23    and name HE#  )    4.97    4.97    0.00
assign (resid 29    and name HA   ) (resid 31    and name HN   )    5.18    5.18    0.00
assign (resid 32    and name HN   ) (resid 32    and name HB2  )    3.93    3.93    0.00
assign (resid 37    and name HN   ) (resid 37    and name HD1  )    4.58    4.58    0.00
assign (resid 4     and name HB2  ) (resid 31    and name HN   )    4.86    4.86    0.00
assign (resid 4     and name HZ   ) (resid 31    and name HA   )    4.82    4.82    0.00
assign (resid 4     and name HZ   ) (resid 30    and name HA   )    5.50    5.50    0.00
assign (resid 4     and name HE#  ) (resid 30    and name HA   )    5.50    5.50    0.00
assign (resid 4     and name HB1  ) (resid 14    and name HE#  )    3.44    3.44    0.00
assign (resid 14    and name HE#  ) (resid 17    and name HA   )    5.20    5.20    0.00
assign (resid 4     and name HD#  ) (resid 17    and name HB#  )    4.38    4.38    0.00
assign (resid 27    and name HA   ) (resid 41    and name HA   )    3.99    3.99    0.00
assign (resid 28    and name HN   ) (resid 41    and name HA   )    5.50    5.50    0.00
assign (resid 27    and name HB#  ) (resid 41    and name HA   )    3.85    3.85    0.00
assign (resid 6     and name HB2  ) (resid 27    and name HG   )    4.19    4.19    0.00
assign (resid 6     and name HB1  ) (resid 27    and name HG   )    4.59    4.59    0.00
assign (resid 18    and name HB   ) (resid 19    and name HD1  )    3.62    3.62    0.00
assign (resid 29    and name HB1  ) (resid 34    and name HG#  )    4.08    4.08    0.00
assign (resid 15    and name HA   ) (resid 15    and name HD1# )    4.30    4.30    0.00
assign (resid 6     and name HE1  ) (resid 34    and name HG#  )    5.50    5.50    0.00
assign (resid 31    and name HB1  ) (resid 32    and name HN   )    4.60    4.60    0.00
assign (resid 31    and name HB2  ) (resid 32    and name HN   )    4.60    4.60    0.00
assign (resid 6     and name HB1  ) (resid 7     and name HN   )    4.20    4.20    0.00
assign (resid 18    and name HN   ) (resid 18    and name HG11 )    4.04    4.04    0.00
assign (resid 15    and name HN   ) (resid 15    and name HG11 )    4.36    4.36    0.00
assign (resid 3     and name HB#  ) (resid 30    and name HE#  )    3.76    3.76    0.00
assign (resid 6     and name HN   ) (resid 6     and name HB2  )    4.20    4.20    0.00
assign (resid 6     and name HB2  ) (resid 6     and name HD1  )    3.55    3.55    0.00
assign (resid 6     and name HB2  ) (resid 6     and name HE1  )    4.90    4.90    0.00
assign (resid 32    and name HB#  ) (resid 32    and name HD2# )    3.71    3.71    0.00
assign (resid 32    and name HB#  ) (resid 32    and name HD1# )    3.71    3.71    0.00
assign (resid 4     and name HD#  ) (resid 32    and name HD2# )    5.09    5.09    0.00
assign (resid 4     and name HE#  ) (resid 32    and name HD1# )    4.86    4.86    0.00
assign (resid 4     and name HD#  ) (resid 32    and name HD1# )    5.09    5.09    0.00
assign (resid 18    and name HA   ) (resid 19    and name HD1  )    3.18    3.18    0.00
assign (resid 27    and name HN   ) (resid 27    and name HB#  )    3.78    3.78    0.00
assign (resid 4     and name HA   ) (resid 14    and name HE#  )    3.42    3.42    0.00
assign (resid 4     and name HD#  ) (resid 14    and name HE#  )    3.70    3.70    0.00
assign (resid 40    and name HA   ) (resid 40    and name HE#  )    5.20    5.20    0.00
assign (resid 40    and name HA   ) (resid 40    and name HD#  )    3.89    3.89    0.00
assign (resid 4     and name HD#  ) (resid 31    and name HA   )    4.11    4.11    0.00
assign (resid 5     and name HA   ) (resid 6     and name HD1  )    4.12    4.12    0.00
assign (resid 6     and name HD2  ) (resid 14    and name HB2  )    4.29    4.29    0.00
assign (resid 4     and name HB1  ) (resid 6     and name HE1  )    4.00    4.00    0.00
assign (resid 4     and name HB2  ) (resid 29    and name HN   )    4.73    4.73    0.00
assign (resid 37    and name HD1  ) (resid 38    and name HG2  )    3.79    3.79    0.00
assign (resid 3     and name HB#  ) (resid 28    and name HD#  )    3.44    3.44    0.00
assign (resid 27    and name HB#  ) (resid 40    and name HN   )    4.91    4.91    0.00
assign (resid 6     and name HB2  ) (resid 27    and name HN   )    4.60    4.60    0.00
assign (resid 6     and name HD2  ) (resid 14    and name HA   )    3.52    3.52    0.00
assign (resid 36    and name HG1  ) (resid 37    and name HE3  )    4.64    4.64    0.00
assign (resid 18    and name HG2# ) (resid 19    and name HD2  )    3.87    3.87    0.00
assign (resid 27    and name HA   ) (resid 28    and name HE#  )    5.50    5.50    0.00
assign (resid 18    and name HB   ) (resid 19    and name HD2  )    3.62    3.62    0.00
assign (resid 14    and name HE#  ) (resid 32    and name HD1# )    5.16    5.16    0.00
assign (resid 14    and name HD#  ) (resid 32    and name HD1# )    5.50    5.50    0.00
assign (resid 4     and name HE#  ) (resid 32    and name HB#  )    5.11    5.11    0.00
assign (resid 6     and name HE1  ) (resid 11    and name HA   )    5.50    5.50    0.00
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assign (resid 3     and name HB#  ) (resid 28    and name HB1  )    4.45    4.45    0.00
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assign (resid 5     and name HA   ) (resid 6     and name HE1  )    5.50    5.50    0.00
assign (resid 30    and name HD#  ) (resid 40    and name HE#  )    3.81    3.81    0.00
assign (resid 30    and name HD#  ) (resid 40    and name HD#  )    4.96    4.96    0.00
assign (resid 28    and name HE#  ) (resid 30    and name HE#  )    3.60    3.60    0.00
assign (resid 6     and name HB1  ) (resid 6     and name HE2  )    4.67    4.67    0.00
assign (resid 15    and name HG2# ) (resid 15    and name HD1# )    3.32    3.32    0.00
assign (resid 1     and name HB#  ) (resid 1     and name HG#  )    2.43    2.43    0.00
assign (resid 1     and name HB#  ) (resid 2     and name HN   )    4.08    4.08    0.00
assign (resid 2     and name HN   ) (resid 2     and name HB#  )    3.50    3.50    0.00
assign (resid 2     and name HB#  ) (resid 3     and name HN   )    4.06    4.06    0.00
assign (resid 4     and name HE#  ) (resid 32    and name HD## )    4.10    4.10    0.00
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assign (resid 5     and name HB#  ) (resid 15    and name HD1# )    4.16    4.16    0.00
assign (resid 5     and name HB#  ) (resid 18    and name HG1# )    4.85    4.85    0.00
assign (resid 5     and name HB#  ) (resid 18    and name HD1# )    4.06    4.06    0.00
assign (resid 6     and name HA   ) (resid 7     and name HB#  )    4.18    4.18    0.00
assign (resid 6     and name HE1  ) (resid 11    and name HB#  )    5.34    5.34    0.00
assign (resid 6     and name HE1  ) (resid 29    and name HB#  )    4.03    4.03    0.00
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assign (resid 6     and name HD2  ) (resid 11    and name HB#  )    5.34    5.34    0.00
assign (resid 6     and name HH   ) (resid 29    and name HB#  )    4.81    4.81    0.00
assign (resid 6     and name HH   ) (resid 32    and name HD## )    4.82    4.82    0.00
assign (resid 6     and name HH   ) (resid 34    and name HD#  )    3.73    3.73    0.00
assign (resid 7     and name HN   ) (resid 7     and name HB#  )    3.51    3.51    0.00
assign (resid 7     and name HB#  ) (resid 15    and name HG2# )    3.49    3.49    0.00
assign (resid 7     and name HB#  ) (resid 15    and name HD1# )    3.69    3.69    0.00
assign (resid 8     and name HN   ) (resid 8     and name HB#  )    3.27    3.27    0.00
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assign (resid 8     and name HB#  ) (resid 10    and name HN   )    4.22    4.22    0.00
assign (resid 8     and name HB#  ) (resid 10    and name HD#  )    4.68    4.68    0.00
assign (resid 8     and name HB#  ) (resid 11    and name HN   )    5.21    5.21    0.00
assign (resid 8     and name HB#  ) (resid 13    and name HD2# )    4.24    4.24    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB#  )    3.23    3.23    0.00
assign (resid 9     and name HN   ) (resid 9     and name HG#  )    3.62    3.62    0.00
assign (resid 9     and name HA   ) (resid 9     and name HG#  )    3.63    3.63    0.00
assign (resid 9     and name HB#  ) (resid 9     and name HE   )    4.43    4.43    0.00
assign (resid 9     and name HB#  ) (resid 10    and name HD#  )    4.16    4.16    0.00
assign (resid 9     and name HB#  ) (resid 10    and name HE#  )    4.49    4.49    0.00
assign (resid 9     and name HG#  ) (resid 9     and name HE   )    3.53    3.53    0.00
assign (resid 10    and name HN   ) (resid 10    and name HB#  )    3.31    3.31    0.00
assign (resid 12    and name HN   ) (resid 12    and name HB#  )    3.25    3.25    0.00
assign (resid 12    and name HN   ) (resid 12    and name HE2# )    4.84    4.84    0.00
assign (resid 12    and name HA   ) (resid 12    and name HE2# )    4.99    4.99    0.00
assign (resid 12    and name HB#  ) (resid 13    and name HN   )    3.86    3.86    0.00
assign (resid 12    and name HG#  ) (resid 12    and name HE2# )    3.20    3.20    0.00
assign (resid 13    and name HN   ) (resid 13    and name HB#  )    3.32    3.32    0.00
assign (resid 13    and name HB#  ) (resid 14    and name HN   )    4.04    4.04    0.00
assign (resid 14    and name HD#  ) (resid 32    and name HD## )    4.26    4.26    0.00
assign (resid 14    and name HE#  ) (resid 32    and name HD## )    4.03    4.03    0.00
assign (resid 15    and name HN   ) (resid 15    and name HG1# )    3.70    3.70    0.00
assign (resid 18    and name HB   ) (resid 19    and name HD#  )    3.01    3.01    0.00
assign (resid 20    and name HB#  ) (resid 21    and name HB#  )    5.34    5.34    0.00
assign (resid 23    and name HN   ) (resid 23    and name HB#  )    3.55    3.55    0.00
assign (resid 23    and name HB#  ) (resid 24    and name HN   )    4.10    4.10    0.00
assign (resid 25    and name HB#  ) (resid 26    and name HN   )    4.45    4.45    0.00
assign (resid 26    and name HA#  ) (resid 27    and name HN   )    2.94    2.94    0.00
assign (resid 28    and name HN   ) (resid 40    and name HB#  )    4.84    4.84    0.00
assign (resid 28    and name HD#  ) (resid 40    and name HB#  )    4.03    4.03    0.00
assign (resid 28    and name HD#  ) (resid 42    and name HB#  )    4.25    4.25    0.00
assign (resid 28    and name HE#  ) (resid 40    and name HB#  )    3.56    3.56    0.00
assign (resid 29    and name HB#  ) (resid 30    and name HN   )    3.72    3.72    0.00
assign (resid 29    and name HB#  ) (resid 31    and name HN   )    3.82    3.82    0.00
assign (resid 29    and name HB#  ) (resid 34    and name HG#  )    3.58    3.58    0.00
assign (resid 29    and name HB#  ) (resid 40    and name HD#  )    4.32    4.32    0.00
assign (resid 29    and name HB#  ) (resid 40    and name HE#  )    4.55    4.55    0.00
assign (resid 30    and name HN   ) (resid 30    and name HB#  )    3.52    3.52    0.00
assign (resid 32    and name HN   ) (resid 32    and name HB#  )    3.19    3.19    0.00
assign (resid 32    and name HA   ) (resid 32    and name HD## )    3.27    3.27    0.00
assign (resid 32    and name HB#  ) (resid 32    and name HD## )    2.83    2.83    0.00
assign (resid 32    and name HB#  ) (resid 33    and name HN   )    3.84    3.84    0.00
assign (resid 32    and name HD## ) (resid 33    and name HN   )    5.19    5.19    0.00
assign (resid 33    and name HN   ) (resid 33    and name HG#  )    4.36    4.36    0.00
assign (resid 33    and name HN   ) (resid 34    and name HD#  )    3.34    3.34    0.00
assign (resid 33    and name HA   ) (resid 33    and name HG#  )    3.54    3.54    0.00
assign (resid 33    and name HA   ) (resid 33    and name HE2# )    5.34    5.34    0.00
assign (resid 33    and name HA   ) (resid 34    and name HD#  )    3.15    3.15    0.00
assign (resid 33    and name HB#  ) (resid 34    and name HD#  )    4.74    4.74    0.00
assign (resid 34    and name HB#  ) (resid 35    and name HD2  )    3.63    3.63    0.00
assign (resid 34    and name HB#  ) (resid 35    and name HD1  )    4.38    4.38    0.00
assign (resid 34    and name HB#  ) (resid 38    and name HB#  )    3.96    3.96    0.00
assign (resid 35    and name HA   ) (resid 36    and name HD#  )    2.98    2.98    0.00
assign (resid 35    and name HB#  ) (resid 36    and name HD#  )    3.57    3.57    0.00
assign (resid 35    and name HB#  ) (resid 37    and name HN   )    4.08    4.08    0.00
assign (resid 35    and name HB#  ) (resid 37    and name HD1  )    5.34    5.34    0.00
assign (resid 35    and name HB#  ) (resid 37    and name HZ3  )    5.34    5.34    0.00
assign (resid 35    and name HB#  ) (resid 37    and name HH2  )    5.34    5.34    0.00
assign (resid 35    and name HG#  ) (resid 37    and name HD1  )    5.24    5.24    0.00
assign (resid 35    and name HG#  ) (resid 37    and name HE1  )    4.33    4.33    0.00
assign (resid 35    and name HG#  ) (resid 37    and name HZ2  )    5.25    5.25    0.00
assign (resid 35    and name HG#  ) (resid 38    and name HN   )    4.69    4.69    0.00
assign (resid 35    and name HG#  ) (resid 38    and name HA   )    5.35    5.35    0.00
assign (resid 35    and name HD2  ) (resid 38    and name HB#  )    4.03    4.03    0.00
assign (resid 35    and name HD2  ) (resid 38    and name HG#  )    3.89    3.89    0.00
assign (resid 36    and name HG#  ) (resid 37    and name HN   )    3.87    3.87    0.00
assign (resid 36    and name HG#  ) (resid 37    and name HE3  )    3.98    3.98    0.00
assign (resid 36    and name HD#  ) (resid 37    and name HE3  )    4.57    4.57    0.00
assign (resid 36    and name HD#  ) (resid 37    and name HZ3  )    4.02    4.02    0.00
assign (resid 37    and name HN   ) (resid 37    and name HB#  )    3.58    3.58    0.00
assign (resid 37    and name HB#  ) (resid 37    and name HD1  )    3.30    3.30    0.00
assign (resid 37    and name HB#  ) (resid 37    and name HE3  )    3.42    3.42    0.00
assign (resid 37    and name HD1  ) (resid 38    and name HG#  )    3.15    3.15    0.00
assign (resid 37    and name HE1  ) (resid 38    and name HG#  )    4.55    4.55    0.00
assign (resid 38    and name HN   ) (resid 38    and name HB#  )    3.52    3.52    0.00
assign (resid 38    and name HN   ) (resid 38    and name HG#  )    4.27    4.27    0.00
assign (resid 38    and name HA   ) (resid 38    and name HG#  )    3.68    3.68    0.00
assign (resid 39    and name HN   ) (resid 39    and name HB#  )    3.16    3.16    0.00
assign (resid 40    and name HN   ) (resid 40    and name HB#  )    3.45    3.45    0.00
assign (resid 41    and name HN   ) (resid 41    and name HB#  )    3.41    3.41    0.00
assign (resid 41    and name HN   ) (resid 41    and name HG#  )    3.65    3.65    0.00
assign (resid 41    and name HA   ) (resid 41    and name HG#  )    3.53    3.53    0.00
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    PCA   1           H        PGL   1  -8.849   6.774   2.496
    2    HA   PCA   1           HA       PGL   1  -7.147   8.510   1.915
    3    HB2  PCA   1           HB1      PGL   1  -7.263  10.217   3.445
    4    HB3  PCA   1           HB2      PGL   1  -6.290   9.204   4.547
    5    HG2  PCA   1           HG1      PGL   1  -9.159   9.818   4.676
    6    HG3  PCA   1           HG2      PGL   1  -8.124   8.965   5.875
    7    H    GLU   2           H        GLU   2  -7.228   5.997   4.207
    8    HA   GLU   2           HA       GLU   2  -4.323   5.580   4.024
    9    HB2  GLU   2           HB2      GLU   2  -6.224   4.476   6.082
   10    HB3  GLU   2           HB1      GLU   2  -4.478   4.342   6.077
   11    HG2  GLU   2           HG2      GLU   2  -4.262   6.715   6.465
   12    HG3  GLU   2           HG1      GLU   2  -6.014   6.906   6.371
   13    H    ALA   3           H        ALA   3  -4.216   4.269   2.246
   14    HA   ALA   3           HA       ALA   3  -5.952   1.984   2.030
   15    HB1  ALA   3           HB1      ALA   3  -3.518   2.771   0.409
   16    HB2  ALA   3           HB2      ALA   3  -5.192   3.126  -0.015
   17    HB3  ALA   3           HB3      ALA   3  -4.628   1.456   0.024
   18    H    PHE   4           H        PHE   4  -4.927  -0.194   1.863
   19    HA   PHE   4           HA       PHE   4  -3.347  -0.583   4.231
   20    HB2  PHE   4           HB2      PHE   4  -4.296  -2.586   2.189
   21    HB3  PHE   4           HB1      PHE   4  -3.660  -2.962   3.780
   22    HD1  PHE   4           HD1      PHE   4  -6.525  -2.624   1.909
   23    HD2  PHE   4           HD2      PHE   4  -5.005  -1.684   5.763
   24    HE1  PHE   4           HE1      PHE   4  -8.813  -2.504   2.781
   25    HE2  PHE   4           HE2      PHE   4  -7.290  -1.572   6.639
   26    HZ   PHE   4           HZ       PHE   4  -9.202  -1.992   5.136
   27    H    CYS   5           H        CYS   5  -1.233  -1.015   4.310
   28    HA   CYS   5           HA       CYS   5   0.158  -0.858   1.760
   29    HB2  CYS   5           HB2      CYS   5   1.036  -0.019   4.500
   30    HB3  CYS   5           HB1      CYS   5   2.022   0.077   3.040
   31    H    TYR   6           H        TYR   6   1.178  -2.442   1.097
   32    HA   TYR   6           HA       TYR   6   2.218  -4.505   2.929
   33    HB2  TYR   6           HB2      TYR   6   1.449  -4.784   0.034
   34    HB3  TYR   6           HB1      TYR   6   1.856  -6.088   1.150
   35    HD1  TYR   6           HD1      TYR   6  -0.785  -3.835   0.030
   36    HD2  TYR   6           HD2      TYR   6   0.284  -6.752   2.924
   37    HE1  TYR   6           HE1      TYR   6  -3.111  -4.010   0.698
   38    HE2  TYR   6           HE2      TYR   6  -2.048  -6.938   3.597
   39    HH   TYR   6           HH       TYR   6  -4.647  -5.403   1.871
   40    H    SER   7           H        SER   7   4.249  -4.399   3.062
   41    HA   SER   7           HA       SER   7   5.919  -2.652   1.647
   42    HB2  SER   7           HB2      SER   7   6.564  -5.108   3.217
   43    HB3  SER   7           HB1      SER   7   7.760  -3.864   2.779
   44    HG   SER   7           HG       SER   7   6.952  -3.530   4.861
   45    H    ASP   8           H        ASP   8   4.945  -5.843   0.928
   46    HA   ASP   8           HA       ASP   8   6.999  -6.151  -1.148
   47    HB2  ASP   8           HB2      ASP   8   6.864  -7.918   0.566
   48    HB3  ASP   8           HB1      ASP   8   5.179  -8.181   0.151
   49    H    ARG   9           H        ARG   9   6.244  -6.828  -3.281
   50    HA   ARG   9           HA       ARG   9   3.779  -5.445  -3.879
   51    HB2  ARG   9           HB2      ARG   9   5.628  -6.789  -5.850
   52    HB3  ARG   9           HB1      ARG   9   4.274  -5.759  -6.255
   53    HG2  ARG   9           HG2      ARG   9   6.051  -4.333  -6.548
   54    HG3  ARG   9           HG1      ARG   9   5.612  -3.974  -4.878
   55    HD2  ARG   9           HD2      ARG   9   8.042  -4.265  -5.179
   56    HD3  ARG   9           HD1      ARG   9   7.353  -5.457  -4.071
   57    HE   ARG   9           HE       ARG   9   7.405  -6.392  -6.759
   58   HH11  ARG   9          HH11      ARG   9   9.531  -5.960  -3.961
   59   HH12  ARG   9          HH12      ARG   9  10.533  -7.275  -4.367
   60   HH21  ARG   9          HH21      ARG   9   8.767  -8.158  -7.302
   61   HH22  ARG   9          HH22      ARG   9  10.107  -8.544  -6.328
   62    H    PHE  10           H        PHE  10   4.481  -8.601  -3.062
   63    HA   PHE  10           HA       PHE  10   2.408  -9.630  -4.743
   64    HB2  PHE  10           HB2      PHE  10   4.193 -11.002  -2.722
   65    HB3  PHE  10           HB1      PHE  10   2.928 -11.835  -3.620
   66    HD1  PHE  10           HD1      PHE  10   3.172 -12.236  -6.007
   67    HD2  PHE  10           HD2      PHE  10   6.225 -10.309  -3.769
   68    HE1  PHE  10           HE1      PHE  10   4.751 -12.616  -7.851
   69    HE2  PHE  10           HE2      PHE  10   7.821 -10.682  -5.614
   70    HZ   PHE  10           HZ       PHE  10   7.083 -11.835  -7.656
   71    H    CYS  11           H        CYS  11   2.308  -7.775  -2.182
   72    HA   CYS  11           HA       CYS  11   0.491  -6.992  -1.030
   73    HB2  CYS  11           HB2      CYS  11  -0.997  -9.239  -2.365
   74    HB3  CYS  11           HB1      CYS  11  -1.720  -7.906  -1.480
   75    H    GLN  12           H        GLN  12   2.102  -9.591  -0.079
   76    HA   GLN  12           HA       GLN  12   0.053 -10.305   1.879
   77    HB2  GLN  12           HB2      GLN  12   2.304 -12.014   0.848
   78    HB3  GLN  12           HB1      GLN  12   1.172 -12.477   2.108
   79    HG2  GLN  12           HG2      GLN  12   0.424 -11.783  -0.721
   80    HG3  GLN  12           HG1      GLN  12   0.541 -13.416  -0.063
   81   HE21  GLN  12          1HE2      GLN  12  -1.750 -11.958  -1.201
   82   HE22  GLN  12          2HE2      GLN  12  -2.962 -11.963   0.019
   83    H    ASN  13           H        ASN  13   2.357  -8.244   1.920
   84    HA   ASN  13           HA       ASN  13   3.135  -9.034   4.643
   85    HB2  ASN  13           HB2      ASN  13   4.862  -7.413   2.736
   86    HB3  ASN  13           HB1      ASN  13   5.193  -7.585   4.450
   87   HD21  ASN  13          HD21      ASN  13   6.969  -8.305   2.413
   88   HD22  ASN  13          HD22      ASN  13   7.201 -10.009   2.472
   89    H    TYR  14           H        TYR  14   1.390  -8.081   5.510
   90    HA   TYR  14           HA       TYR  14   0.669  -5.351   4.937
   91    HB2  TYR  14           HB2      TYR  14  -1.028  -7.087   5.431
   92    HB3  TYR  14           HB1      TYR  14  -0.345  -7.292   7.029
   93    HD1  TYR  14           HD1      TYR  14  -2.277  -5.000   4.866
   94    HD2  TYR  14           HD2      TYR  14  -0.926  -5.801   8.816
   95    HE1  TYR  14           HE1      TYR  14  -3.854  -3.354   5.736
   96    HE2  TYR  14           HE2      TYR  14  -2.505  -4.138   9.697
   97    HH   TYR  14           HH       TYR  14  -3.756  -2.137   8.902
   98    H    ILE  15           H        ILE  15   1.721  -3.694   5.813
   99    HA   ILE  15           HA       ILE  15   2.886  -4.070   8.489
  100    HB   ILE  15           HB       ILE  15   4.210  -2.014   8.051
  101   HG12  ILE  15          HG12      ILE  15   3.224  -2.324   5.196
  102   HG13  ILE  15          HG11      ILE  15   2.705  -1.061   6.301
  103   HG21  ILE  15          HG21      ILE  15   5.818  -3.106   6.551
  104   HG22  ILE  15          HG22      ILE  15   4.591  -4.303   6.137
  105   HG23  ILE  15          HG23      ILE  15   5.195  -4.194   7.790
  106   HD11  ILE  15          HD11      ILE  15   5.506  -1.473   5.272
  107   HD12  ILE  15          HD12      ILE  15   4.988  -0.193   6.372
  108   HD13  ILE  15          HD13      ILE  15   4.362  -0.247   4.724
  109    H    GLY  16           H        GLY  16   0.259  -2.751   6.998
  110    HA2  GLY  16           HA2      GLY  16  -1.244  -1.883   8.854
  111    HA3  GLY  16           HA1      GLY  16   0.000  -0.639   8.994
  112    H    SER  17           H        SER  17  -1.734   0.843   8.468
  113    HA   SER  17           HA       SER  17  -2.016   1.085   5.574
  114    HB2  SER  17           HB2      SER  17  -4.331   2.053   6.095
  115    HB3  SER  17           HB1      SER  17  -4.162   0.312   6.301
  116    HG   SER  17           HG       SER  17  -4.431   2.328   8.261
  117    H    ILE  18           H        ILE  18  -1.412   3.090   4.854
  118    HA   ILE  18           HA       ILE  18  -1.441   5.352   6.660
  119    HB   ILE  18           HB       ILE  18   0.953   5.949   5.938
  120   HG12  ILE  18          HG12      ILE  18   1.062   2.968   5.448
  121   HG13  ILE  18          HG11      ILE  18   1.213   4.227   4.235
  122   HG21  ILE  18          HG21      ILE  18   0.447   5.482   8.231
  123   HG22  ILE  18          HG22      ILE  18   1.996   4.750   7.810
  124   HG23  ILE  18          HG23      ILE  18   0.549   3.748   7.933
  125   HD11  ILE  18          HD11      ILE  18   3.362   3.260   4.805
  126   HD12  ILE  18          HD12      ILE  18   3.123   3.707   6.496
  127   HD13  ILE  18          HD13      ILE  18   3.292   4.962   5.262
  128    HA   PRO  19           HA       PRO  19  -2.350   7.317   2.790
  129    HB2  PRO  19           HB2      PRO  19  -2.230   9.883   3.534
  130    HB3  PRO  19           HB1      PRO  19  -3.499   8.807   4.138
  131    HG2  PRO  19           HG2      PRO  19  -1.014   9.764   5.478
  132    HG3  PRO  19           HG1      PRO  19  -2.632   9.524   6.155
  133    HD2  PRO  19           HD2      PRO  19  -0.531   7.746   6.422
  134    HD3  PRO  19           HD1      PRO  19  -2.244   7.325   6.593
  135    H    ASP  20           H        ASP  20   0.636   7.380   4.197
  136    HA   ASP  20           HA       ASP  20   1.899   8.776   1.929
  137    HB2  ASP  20           HB2      ASP  20   3.810   9.228   3.408
  138    HB3  ASP  20           HB1      ASP  20   2.337   9.852   4.132
  139    H    CYS  21           H        CYS  21   0.924   6.270   1.824
  140    HA   CYS  21           HA       CYS  21   2.475   4.081   2.578
  141    HB2  CYS  21           HB2      CYS  21   0.074   4.206   1.716
  142    HB3  CYS  21           HB1      CYS  21   0.777   4.195   0.103
  143    H    CYS  22           H        CYS  22   2.790   6.205  -0.190
  144    HA   CYS  22           HA       CYS  22   4.571   4.366  -1.513
  145    HB2  CYS  22           HB2      CYS  22   3.464   7.026  -2.367
  146    HB3  CYS  22           HB1      CYS  22   4.497   6.000  -3.360
  147    H    PHE  23           H        PHE  23   5.141   6.281   0.944
  148    HA   PHE  23           HA       PHE  23   7.573   7.443  -0.135
  149    HB2  PHE  23           HB2      PHE  23   6.144   7.855   2.490
  150    HB3  PHE  23           HB1      PHE  23   7.730   8.548   2.146
  151    HD1  PHE  23           HD1      PHE  23   4.164   8.610   1.231
  152    HD2  PHE  23           HD2      PHE  23   7.968  10.416   0.681
  153    HE1  PHE  23           HE1      PHE  23   3.087  10.520   0.106
  154    HE2  PHE  23           HE2      PHE  23   6.907  12.326  -0.441
  155    HZ   PHE  23           HZ       PHE  23   4.461  12.381  -0.731
  156    H    GLY  24           H        GLY  24   7.062   4.605   0.350
  157    HA2  GLY  24           HA2      GLY  24   9.653   3.914   1.205
  158    HA3  GLY  24           HA1      GLY  24   8.411   3.404   2.362
  159    H    ARG  25           H        ARG  25   9.399   1.272   1.470
  160    HA   ARG  25           HA       ARG  25   8.495   0.375  -1.077
  161    HB2  ARG  25           HB2      ARG  25   9.072  -1.254   1.415
  162    HB3  ARG  25           HB1      ARG  25   8.931  -1.886  -0.213
  163    HG2  ARG  25           HG2      ARG  25  10.942  -0.684  -0.865
  164    HG3  ARG  25           HG1      ARG  25  11.076  -0.011   0.766
  165    HD2  ARG  25           HD2      ARG  25  11.178  -2.346   1.636
  166    HD3  ARG  25           HD1      ARG  25  11.212  -2.912  -0.028
  167    HE   ARG  25           HE       ARG  25  13.273  -1.270  -0.046
  168   HH11  ARG  25          HH11      ARG  25  12.370  -3.731   2.333
  169   HH12  ARG  25          HH12      ARG  25  13.961  -4.070   2.816
  170   HH21  ARG  25          HH21      ARG  25  15.478  -1.746   0.625
  171   HH22  ARG  25          HH22      ARG  25  15.765  -2.901   1.847
  172    H    GLY  26           H        GLY  26   6.430  -0.146  -1.614
  173    HA2  GLY  26           HA2      GLY  26   4.691  -1.395   0.185
  174    HA3  GLY  26           HA1      GLY  26   4.367   0.327   0.165
  175    H    SER  27           H        SER  27   2.920  -2.022  -0.644
  176    HA   SER  27           HA       SER  27   2.039  -1.063  -3.257
  177    HB2  SER  27           HB2      SER  27   1.628  -3.813  -2.049
  178    HB3  SER  27           HB1      SER  27   1.351  -3.315  -3.717
  179    HG   SER  27           HG       SER  27   3.617  -4.101  -2.448
  180    H    TYR  28           H        TYR  28  -0.086  -0.474  -3.148
  181    HA   TYR  28           HA       TYR  28  -1.358  -0.880  -0.547
  182    HB2  TYR  28           HB2      TYR  28  -2.468   1.311  -0.755
  183    HB3  TYR  28           HB1      TYR  28  -0.720   1.456  -0.706
  184    HD1  TYR  28           HD1      TYR  28  -3.740   2.040  -2.662
  185    HD2  TYR  28           HD2      TYR  28   0.515   2.072  -2.768
  186    HE1  TYR  28           HE1      TYR  28  -3.803   3.373  -4.717
  187    HE2  TYR  28           HE2      TYR  28   0.470   3.387  -4.793
  188    HH   TYR  28           HH       TYR  28  -1.026   3.808  -6.640
  189    H    SER  29           H        SER  29  -3.433  -1.354  -0.442
  190    HA   SER  29           HA       SER  29  -5.022  -1.422  -2.853
  191    HB2  SER  29           HB2      SER  29  -5.761  -3.746  -2.340
  192    HB3  SER  29           HB1      SER  29  -4.046  -3.673  -2.744
  193    HG   SER  29           HG       SER  29  -5.141  -4.644  -0.526
  194    H    PHE  30           H        PHE  30  -7.338  -2.047  -2.137
  195    HA   PHE  30           HA       PHE  30  -7.853  -0.646   0.376
  196    HB2  PHE  30           HB2      PHE  30  -9.643  -1.007  -2.051
  197    HB3  PHE  30           HB1      PHE  30 -10.021  -0.048  -0.622
  198    HD1  PHE  30           HD1      PHE  30  -8.274  -0.121  -3.800
  199    HD2  PHE  30           HD2      PHE  30  -8.703   2.023  -0.147
  200    HE1  PHE  30           HE1      PHE  30  -7.165   1.841  -4.816
  201    HE2  PHE  30           HE2      PHE  30  -7.609   3.971  -1.171
  202    HZ   PHE  30           HZ       PHE  30  -6.841   3.882  -3.495
  203    H    GLU  31           H        GLU  31  -7.268  -3.507  -0.381
  204    HA   GLU  31           HA       GLU  31  -9.427  -4.745   1.150
  205    HB2  GLU  31           HB2      GLU  31  -9.810  -5.215  -1.249
  206    HB3  GLU  31           HB1      GLU  31  -8.179  -5.848  -1.384
  207    HG2  GLU  31           HG2      GLU  31  -9.882  -7.609  -1.275
  208    HG3  GLU  31           HG1      GLU  31  -8.730  -7.691   0.057
  209    H    LEU  32           H        LEU  32  -8.740  -6.693   2.246
  210    HA   LEU  32           HA       LEU  32  -6.047  -6.390   3.247
  211    HB2  LEU  32           HB2      LEU  32  -8.298  -8.169   4.133
  212    HB3  LEU  32           HB1      LEU  32  -6.742  -8.064   4.929
  213    HG   LEU  32           HG       LEU  32  -8.747  -5.824   4.675
  214   HD11  LEU  32          HD11      LEU  32  -9.426  -7.553   6.240
  215   HD12  LEU  32          HD12      LEU  32  -8.959  -6.073   7.087
  216   HD13  LEU  32          HD13      LEU  32  -7.854  -7.451   7.034
  217   HD21  LEU  32          HD21      LEU  32  -6.466  -4.977   4.639
  218   HD22  LEU  32          HD22      LEU  32  -6.078  -5.922   6.076
  219   HD23  LEU  32          HD23      LEU  32  -7.251  -4.608   6.169
  220    H    GLN  33           H        GLN  33  -4.460  -7.331   2.491
  221    HA   GLN  33           HA       GLN  33  -3.129  -8.618   1.253
  222    HB2  GLN  33           HB2      GLN  33  -4.324 -10.621   3.157
  223    HB3  GLN  33           HB1      GLN  33  -2.892 -10.941   2.187
  224    HG2  GLN  33           HG2      GLN  33  -1.742  -9.063   3.242
  225    HG3  GLN  33           HG1      GLN  33  -3.177  -8.718   4.200
  226   HE21  GLN  33          1HE2      GLN  33  -3.715 -11.540   4.740
  227   HE22  GLN  33          2HE2      GLN  33  -2.524 -12.028   5.893
  228    HA   PRO  34           HA       PRO  34  -6.097 -10.424  -1.788
  229    HB2  PRO  34           HB2      PRO  34  -5.984  -8.556  -3.696
  230    HB3  PRO  34           HB1      PRO  34  -6.951  -8.279  -2.243
  231    HG2  PRO  34           HG2      PRO  34  -4.228  -7.253  -2.930
  232    HG3  PRO  34           HG1      PRO  34  -5.594  -6.393  -2.196
  233    HD2  PRO  34           HD2      PRO  34  -3.476  -7.453  -0.773
  234    HD3  PRO  34           HD1      PRO  34  -5.078  -7.129  -0.105
  235    HA   PRO  35           HA       PRO  35  -2.924 -12.132  -4.508
  236    HB2  PRO  35           HB2      PRO  35  -3.966 -11.670  -7.053
  237    HB3  PRO  35           HB1      PRO  35  -4.350 -13.062  -6.039
  238    HG2  PRO  35           HG2      PRO  35  -5.868 -10.526  -6.436
  239    HG3  PRO  35           HG1      PRO  35  -6.479 -12.181  -6.273
  240    HD2  PRO  35           HD2      PRO  35  -6.613 -10.460  -4.240
  241    HD3  PRO  35           HD1      PRO  35  -6.240 -12.171  -3.965
  242    HA   PRO  36           HA       PRO  36   0.101  -9.058  -5.363
  243    HB2  PRO  36           HB2      PRO  36   0.956 -10.006  -7.894
  244    HB3  PRO  36           HB1      PRO  36   1.664 -10.392  -6.334
  245    HG2  PRO  36           HG2      PRO  36  -0.303 -11.918  -7.951
  246    HG3  PRO  36           HG1      PRO  36   0.957 -12.514  -6.858
  247    HD2  PRO  36           HD2      PRO  36  -1.596 -12.598  -6.152
  248    HD3  PRO  36           HD1      PRO  36  -0.356 -12.141  -4.961
  249    H    TRP  37           H        TRP  37  -1.981  -9.735  -8.096
  250    HA   TRP  37           HA       TRP  37  -1.238  -7.355  -9.489
  251    HB2  TRP  37           HB2      TRP  37  -3.099  -8.031 -11.062
  252    HB3  TRP  37           HB1      TRP  37  -1.754  -9.148 -10.897
  253    HD1  TRP  37           HD       TRP  37  -5.473  -8.785  -9.796
  254    HE1  TRP  37           HE1      TRP  37  -6.388 -11.142  -9.360
  255    HE3  TRP  37          3HE       TRP  37  -1.157 -11.483 -10.351
  256    HZ2  TRP  37           HZ2      TRP  37  -5.429 -13.791  -9.255
  257    HZ3  TRP  37           HZ3      TRP  37  -1.248 -13.921 -10.061
  258    HH2  TRP  37           HH       TRP  37  -3.346 -15.047  -9.523
  259    H    GLU  38           H        GLU  38  -3.399  -7.844  -6.952
  260    HA   GLU  38           HA       GLU  38  -5.295  -5.864  -7.895
  261    HB2  GLU  38           HB2      GLU  38  -5.198  -7.534  -5.404
  262    HB3  GLU  38           HB1      GLU  38  -6.460  -6.353  -5.746
  263    HG2  GLU  38           HG2      GLU  38  -5.787  -8.686  -7.507
  264    HG3  GLU  38           HG1      GLU  38  -7.092  -8.698  -6.328
  265    H    CYS  39           H        CYS  39  -2.412  -5.792  -6.241
  266    HA   CYS  39           HA       CYS  39  -3.128  -3.387  -4.741
  267    HB2  CYS  39           HB2      CYS  39  -0.489  -4.847  -4.896
  268    HB3  CYS  39           HB1      CYS  39  -0.862  -3.488  -3.844
  269    H    TYR  40           H        TYR  40  -1.867  -1.477  -5.016
  270    HA   TYR  40           HA       TYR  40  -0.768  -1.183  -7.717
  271    HB2  TYR  40           HB2      TYR  40  -1.502   0.956  -5.701
  272    HB3  TYR  40           HB1      TYR  40  -1.055   1.203  -7.379
  273    HD1  TYR  40           HD1      TYR  40  -3.702   0.115  -5.095
  274    HD2  TYR  40           HD2      TYR  40  -2.677   0.902  -9.144
  275    HE1  TYR  40           HE1      TYR  40  -6.075   0.112  -5.683
  276    HE2  TYR  40           HE2      TYR  40  -5.050   0.903  -9.747
  277    HH   TYR  40           HH       TYR  40  -7.185  -0.085  -8.809
  278    H    GLN  41           H        GLN  41   1.429  -1.094  -7.773
  279    HA   GLN  41           HA       GLN  41   2.805  -1.010  -5.239
  280    HB2  GLN  41           HB2      GLN  41   4.853  -1.542  -6.485
  281    HB3  GLN  41           HB1      GLN  41   3.572  -2.672  -6.867
  282    HG2  GLN  41           HG2      GLN  41   3.191  -1.535  -8.994
  283    HG3  GLN  41           HG1      GLN  41   4.444  -0.360  -8.595
  284   HE21  GLN  41          1HE2      GLN  41   5.724  -0.886 -10.323
  285   HE22  GLN  41          2HE2      GLN  41   6.599  -2.364 -10.454
  286    H    CYS  42           H        CYS  42   3.893   0.635  -4.439
  287    HA   CYS  42           HA       CYS  42   3.620   3.163  -5.685
  288    HB2  CYS  42           HB2      CYS  42   5.045   2.294  -3.180
  289    HB3  CYS  42           HB1      CYS  42   4.914   3.969  -3.705
  Start of MODEL    2
    1    H    PCA   1           H        PGL   1 -10.073   3.227   3.583
    2    HA   PCA   1           HA       PGL   1 -10.489   5.782   3.432
    3    HB2  PCA   1           HB1      PGL   1 -11.060   6.683   5.438
    4    HB3  PCA   1           HB2      PGL   1  -9.457   6.240   6.091
    5    HG2  PCA   1           HG1      PGL   1 -11.997   4.987   6.656
    6    HG3  PCA   1           HG2      PGL   1 -10.364   4.502   7.233
    7    H    GLU   2           H        GLU   2  -8.097   3.685   4.843
    8    HA   GLU   2           HA       GLU   2  -6.017   5.455   3.765
    9    HB2  GLU   2           HB2      GLU   2  -5.753   3.519   6.072
   10    HB3  GLU   2           HB1      GLU   2  -4.514   4.614   5.476
   11    HG2  GLU   2           HG2      GLU   2  -5.933   6.520   6.127
   12    HG3  GLU   2           HG1      GLU   2  -7.102   5.385   6.795
   13    H    ALA   3           H        ALA   3  -4.225   4.360   2.787
   14    HA   ALA   3           HA       ALA   3  -5.066   1.994   1.414
   15    HB1  ALA   3           HB1      ALA   3  -3.887   3.820   0.247
   16    HB2  ALA   3           HB2      ALA   3  -3.043   2.285   0.122
   17    HB3  ALA   3           HB3      ALA   3  -2.463   3.518   1.245
   18    H    PHE   4           H        PHE   4  -4.374  -0.004   1.775
   19    HA   PHE   4           HA       PHE   4  -2.844  -0.504   4.175
   20    HB2  PHE   4           HB2      PHE   4  -4.105  -2.409   2.190
   21    HB3  PHE   4           HB1      PHE   4  -3.387  -2.881   3.720
   22    HD1  PHE   4           HD1      PHE   4  -4.452  -1.853   5.865
   23    HD2  PHE   4           HD2      PHE   4  -6.320  -1.890   2.054
   24    HE1  PHE   4           HE1      PHE   4  -6.612  -1.527   6.930
   25    HE2  PHE   4           HE2      PHE   4  -8.500  -1.565   3.128
   26    HZ   PHE   4           HZ       PHE   4  -8.644  -1.384   5.574
   27    H    CYS   5           H        CYS   5  -0.761  -0.771   4.121
   28    HA   CYS   5           HA       CYS   5   0.517  -0.945   1.516
   29    HB2  CYS   5           HB2      CYS   5   1.673  -0.182   4.184
   30    HB3  CYS   5           HB1      CYS   5   2.466  -0.060   2.617
   31    H    TYR   6           H        TYR   6   1.619  -2.598   0.952
   32    HA   TYR   6           HA       TYR   6   2.476  -4.607   2.935
   33    HB2  TYR   6           HB2      TYR   6   1.715  -5.177   0.053
   34    HB3  TYR   6           HB1      TYR   6   2.067  -6.335   1.316
   35    HD1  TYR   6           HD1      TYR   6  -0.464  -4.012   0.022
   36    HD2  TYR   6           HD2      TYR   6   0.399  -6.970   2.946
   37    HE1  TYR   6           HE1      TYR   6  -2.821  -4.128   0.580
   38    HE2  TYR   6           HE2      TYR   6  -1.967  -7.094   3.524
   39    HH   TYR   6           HH       TYR   6  -4.409  -5.449   1.634
   40    H    SER   7           H        SER   7   4.560  -4.817   2.986
   41    HA   SER   7           HA       SER   7   6.102  -3.298   1.109
   42    HB2  SER   7           HB2      SER   7   8.000  -4.024   2.618
   43    HB3  SER   7           HB1      SER   7   6.648  -3.151   3.369
   44    HG   SER   7           HG       SER   7   7.288  -5.884   3.563
   45    H    ASP   8           H        ASP   8   4.735  -6.086   0.883
   46    HA   ASP   8           HA       ASP   8   6.812  -7.382  -0.721
   47    HB2  ASP   8           HB2      ASP   8   6.159  -8.799   1.102
   48    HB3  ASP   8           HB1      ASP   8   4.456  -8.484   0.805
   49    H    ARG   9           H        ARG   9   6.289  -7.855  -2.807
   50    HA   ARG   9           HA       ARG   9   4.124  -6.338  -3.942
   51    HB2  ARG   9           HB2      ARG   9   6.391  -7.879  -5.182
   52    HB3  ARG   9           HB1      ARG   9   5.066  -7.275  -6.156
   53    HG2  ARG   9           HG2      ARG   9   6.908  -5.742  -6.282
   54    HG3  ARG   9           HG1      ARG   9   5.590  -4.986  -5.400
   55    HD2  ARG   9           HD2      ARG   9   6.752  -5.573  -3.281
   56    HD3  ARG   9           HD1      ARG   9   8.091  -6.204  -4.241
   57    HE   ARG   9           HE       ARG   9   7.376  -3.513  -4.887
   58   HH11  ARG   9          HH11      ARG   9   9.243  -5.437  -2.569
   59   HH12  ARG   9          HH12      ARG   9  10.429  -4.239  -2.338
   60   HH21  ARG   9          HH21      ARG   9   8.990  -1.866  -4.499
   61   HH22  ARG   9          HH22      ARG   9  10.282  -2.186  -3.440
   62    H    PHE  10           H        PHE  10   4.240  -9.399  -2.687
   63    HA   PHE  10           HA       PHE  10   2.281 -10.359  -4.600
   64    HB2  PHE  10           HB2      PHE  10   3.633 -11.842  -2.337
   65    HB3  PHE  10           HB1      PHE  10   2.587 -12.549  -3.558
   66    HD1  PHE  10           HD1      PHE  10   5.914 -11.837  -2.643
   67    HD2  PHE  10           HD2      PHE  10   3.374 -12.282  -6.026
   68    HE1  PHE  10           HE1      PHE  10   7.874 -12.252  -4.058
   69    HE2  PHE  10           HE2      PHE  10   5.333 -12.694  -7.440
   70    HZ   PHE  10           HZ       PHE  10   7.585 -12.678  -6.460
   71    H    CYS  11           H        CYS  11   2.309  -8.392  -2.157
   72    HA   CYS  11           HA       CYS  11   0.703  -7.497  -0.804
   73    HB2  CYS  11           HB2      CYS  11  -1.113  -9.666  -1.883
   74    HB3  CYS  11           HB1      CYS  11  -1.600  -8.190  -1.061
   75    H    GLN  12           H        GLN  12   2.403  -9.984  -0.033
   76    HA   GLN  12           HA       GLN  12   0.578 -11.105   1.943
   77    HB2  GLN  12           HB2      GLN  12   3.243 -12.112   0.997
   78    HB3  GLN  12           HB1      GLN  12   2.253 -12.903   2.214
   79    HG2  GLN  12           HG2      GLN  12   1.452 -12.399  -0.649
   80    HG3  GLN  12           HG1      GLN  12   1.988 -13.940   0.014
   81   HE21  GLN  12          1HE2      GLN  12   0.520 -13.627   2.520
   82   HE22  GLN  12          2HE2      GLN  12  -1.137 -13.864   2.136
   83    H    ASN  13           H        ASN  13   2.703  -8.609   2.010
   84    HA   ASN  13           HA       ASN  13   3.292  -9.210   4.830
   85    HB2  ASN  13           HB2      ASN  13   5.163  -7.848   2.881
   86    HB3  ASN  13           HB1      ASN  13   5.368  -7.733   4.618
   87   HD21  ASN  13          HD21      ASN  13   4.624 -10.410   5.233
   88   HD22  ASN  13          HD22      ASN  13   5.864 -11.454   4.648
   89    H    TYR  14           H        TYR  14   1.559  -8.183   5.577
   90    HA   TYR  14           HA       TYR  14   0.894  -5.522   4.786
   91    HB2  TYR  14           HB2      TYR  14  -0.858  -7.104   5.375
   92    HB3  TYR  14           HB1      TYR  14  -0.173  -7.312   6.977
   93    HD1  TYR  14           HD1      TYR  14  -1.248  -6.217   8.687
   94    HD2  TYR  14           HD2      TYR  14  -1.375  -4.500   4.801
   95    HE1  TYR  14           HE1      TYR  14  -2.641  -4.416   9.540
   96    HE2  TYR  14           HE2      TYR  14  -2.750  -2.691   5.637
   97    HH   TYR  14           HH       TYR  14  -3.244  -2.114   8.977
   98    H    ILE  15           H        ILE  15   1.992  -3.814   5.507
   99    HA   ILE  15           HA       ILE  15   3.312  -4.004   8.110
  100    HB   ILE  15           HB       ILE  15   4.545  -1.933   7.491
  101   HG12  ILE  15          HG12      ILE  15   3.223  -2.311   4.789
  102   HG13  ILE  15          HG11      ILE  15   2.899  -0.999   5.913
  103   HG21  ILE  15          HG21      ILE  15   6.014  -2.997   5.839
  104   HG22  ILE  15          HG22      ILE  15   4.787  -4.236   5.571
  105   HG23  ILE  15          HG23      ILE  15   5.559  -4.085   7.150
  106   HD11  ILE  15          HD11      ILE  15   5.191  -0.203   5.639
  107   HD12  ILE  15          HD12      ILE  15   4.343  -0.285   4.095
  108   HD13  ILE  15          HD13      ILE  15   5.516  -1.530   4.524
  109    H    GLY  16           H        GLY  16   0.684  -2.381   6.569
  110    HA2  GLY  16           HA2      GLY  16  -0.730  -1.695   8.688
  111    HA3  GLY  16           HA1      GLY  16   0.489  -0.428   8.710
  112    H    SER  17           H        SER  17  -1.571   0.839   8.456
  113    HA   SER  17           HA       SER  17  -2.187   1.083   5.622
  114    HB2  SER  17           HB2      SER  17  -4.505   1.753   6.472
  115    HB3  SER  17           HB1      SER  17  -4.090   0.042   6.551
  116    HG   SER  17           HG       SER  17  -4.992   1.394   8.500
  117    H    ILE  18           H        ILE  18  -1.934   3.038   4.852
  118    HA   ILE  18           HA       ILE  18  -2.227   5.418   6.436
  119    HB   ILE  18           HB       ILE  18  -0.002   6.335   5.603
  120   HG12  ILE  18          HG12      ILE  18   0.622   3.408   5.171
  121   HG13  ILE  18          HG11      ILE  18   0.518   4.651   3.932
  122   HG21  ILE  18          HG21      ILE  18   0.121   4.179   7.689
  123   HG22  ILE  18          HG22      ILE  18  -0.244   5.891   7.932
  124   HG23  ILE  18          HG23      ILE  18   1.367   5.396   7.416
  125   HD11  ILE  18          HD11      ILE  18   2.825   4.085   4.447
  126   HD12  ILE  18          HD12      ILE  18   2.551   4.505   6.138
  127   HD13  ILE  18          HD13      ILE  18   2.477   5.760   4.895
  128    HA   PRO  19           HA       PRO  19  -3.431   6.541   2.276
  129    HB2  PRO  19           HB2      PRO  19  -4.179   9.067   2.689
  130    HB3  PRO  19           HB1      PRO  19  -5.071   7.729   3.426
  131    HG2  PRO  19           HG2      PRO  19  -3.089   9.583   4.647
  132    HG3  PRO  19           HG1      PRO  19  -4.584   8.926   5.337
  133    HD2  PRO  19           HD2      PRO  19  -2.005   7.954   5.812
  134    HD3  PRO  19           HD1      PRO  19  -3.513   7.070   6.114
  135    H    ASP  20           H        ASP  20  -0.676   7.206   3.611
  136    HA   ASP  20           HA       ASP  20   0.334   9.038   1.516
  137    HB2  ASP  20           HB2      ASP  20   1.320   8.704   4.374
  138    HB3  ASP  20           HB1      ASP  20   2.058   9.756   3.187
  139    H    CYS  21           H        CYS  21   0.004   6.257   1.347
  140    HA   CYS  21           HA       CYS  21   2.082   4.683   2.354
  141    HB2  CYS  21           HB2      CYS  21  -0.185   3.924   1.528
  142    HB3  CYS  21           HB1      CYS  21   0.456   4.063  -0.104
  143    H    CYS  22           H        CYS  22   1.892   6.578  -0.592
  144    HA   CYS  22           HA       CYS  22   4.102   5.168  -1.731
  145    HB2  CYS  22           HB2      CYS  22   2.529   7.514  -2.744
  146    HB3  CYS  22           HB1      CYS  22   3.902   6.814  -3.607
  147    H    PHE  23           H        PHE  23   4.218   7.136   0.717
  148    HA   PHE  23           HA       PHE  23   6.670   8.455  -0.150
  149    HB2  PHE  23           HB2      PHE  23   5.128   8.618   2.453
  150    HB3  PHE  23           HB1      PHE  23   6.663   9.426   2.179
  151    HD1  PHE  23           HD1      PHE  23   6.804  11.274   0.536
  152    HD2  PHE  23           HD2      PHE  23   3.111   9.483   1.599
  153    HE1  PHE  23           HE1      PHE  23   5.607  13.230  -0.361
  154    HE2  PHE  23           HE2      PHE  23   1.894  11.437   0.706
  155    HZ   PHE  23           HZ       PHE  23   3.147  13.312  -0.276
  156    H    GLY  24           H        GLY  24   5.822   5.479   0.715
  157    HA2  GLY  24           HA2      GLY  24   8.421   4.935   1.929
  158    HA3  GLY  24           HA1      GLY  24   6.953   4.274   2.647
  159    H    ARG  25           H        ARG  25   8.669   2.467   1.966
  160    HA   ARG  25           HA       ARG  25   8.456   1.511  -0.739
  161    HB2  ARG  25           HB2      ARG  25  10.417   1.054   0.654
  162    HB3  ARG  25           HB1      ARG  25   9.414   0.177   1.792
  163    HG2  ARG  25           HG2      ARG  25   8.877  -1.415  -0.080
  164    HG3  ARG  25           HG1      ARG  25  10.134  -0.603  -1.017
  165    HD2  ARG  25           HD2      ARG  25  10.493  -1.966   1.648
  166    HD3  ARG  25           HD1      ARG  25  11.013  -2.588   0.085
  167    HE   ARG  25           HE       ARG  25  12.289  -0.265   0.173
  168   HH11  ARG  25          HH11      ARG  25  12.001  -2.827   2.638
  169   HH12  ARG  25          HH12      ARG  25  13.527  -2.556   3.311
  170   HH21  ARG  25          HH21      ARG  25  14.432   0.109   1.120
  171   HH22  ARG  25          HH22      ARG  25  14.942  -0.841   2.428
  172    H    GLY  26           H        GLY  26   6.753   0.292  -1.527
  173    HA2  GLY  26           HA2      GLY  26   5.811  -1.963  -0.471
  174    HA3  GLY  26           HA1      GLY  26   4.849  -0.752   0.353
  175    H    SER  27           H        SER  27   3.595  -2.529  -0.942
  176    HA   SER  27           HA       SER  27   2.594  -1.370  -3.440
  177    HB2  SER  27           HB2      SER  27   1.895  -4.034  -2.174
  178    HB3  SER  27           HB1      SER  27   1.718  -3.547  -3.861
  179    HG   SER  27           HG       SER  27   3.714  -4.787  -2.682
  180    H    TYR  28           H        TYR  28   0.209  -1.054  -3.351
  181    HA   TYR  28           HA       TYR  28  -0.841  -1.155  -0.635
  182    HB2  TYR  28           HB2      TYR  28  -1.666   1.105  -0.663
  183    HB3  TYR  28           HB1      TYR  28   0.063   1.119  -0.938
  184    HD1  TYR  28           HD1      TYR  28  -3.209   1.906  -2.312
  185    HD2  TYR  28           HD2      TYR  28   0.958   1.747  -3.207
  186    HE1  TYR  28           HE1      TYR  28  -3.581   3.295  -4.279
  187    HE2  TYR  28           HE2      TYR  28   0.590   3.129  -5.171
  188    HH   TYR  28           HH       TYR  28  -1.179   3.765  -6.681
  189    H    SER  29           H        SER  29  -2.987  -1.372  -0.426
  190    HA   SER  29           HA       SER  29  -4.676  -1.278  -2.779
  191    HB2  SER  29           HB2      SER  29  -5.686  -3.472  -2.136
  192    HB3  SER  29           HB1      SER  29  -4.002  -3.634  -2.643
  193    HG   SER  29           HG       SER  29  -5.119  -4.318  -0.294
  194    H    PHE  30           H        PHE  30  -7.052  -1.511  -1.931
  195    HA   PHE  30           HA       PHE  30  -7.134  -0.163   0.658
  196    HB2  PHE  30           HB2      PHE  30  -9.106   0.023  -1.641
  197    HB3  PHE  30           HB1      PHE  30  -9.213   0.910  -0.119
  198    HD1  PHE  30           HD1      PHE  30  -7.355   2.539   0.431
  199    HD2  PHE  30           HD2      PHE  30  -7.873   0.836  -3.430
  200    HE1  PHE  30           HE1      PHE  30  -5.950   4.303  -0.537
  201    HE2  PHE  30           HE2      PHE  30  -6.471   2.596  -4.401
  202    HZ   PHE  30           HZ       PHE  30  -5.504   4.338  -2.952
  203    H    GLU  31           H        GLU  31  -7.026  -2.986  -0.045
  204    HA   GLU  31           HA       GLU  31  -9.264  -3.877   1.569
  205    HB2  GLU  31           HB2      GLU  31  -9.802  -4.150  -0.912
  206    HB3  GLU  31           HB1      GLU  31  -8.478  -5.304  -0.977
  207    HG2  GLU  31           HG2      GLU  31 -10.651  -6.397  -0.736
  208    HG3  GLU  31           HG1      GLU  31  -9.591  -6.717   0.643
  209    H    LEU  32           H        LEU  32  -8.739  -5.829   2.711
  210    HA   LEU  32           HA       LEU  32  -5.925  -6.093   3.214
  211    HB2  LEU  32           HB2      LEU  32  -8.316  -7.398   4.473
  212    HB3  LEU  32           HB1      LEU  32  -6.684  -7.889   4.860
  213    HG   LEU  32           HG       LEU  32  -7.488  -6.499   6.589
  214   HD11  LEU  32          HD11      LEU  32  -5.163  -6.217   6.060
  215   HD12  LEU  32          HD12      LEU  32  -5.861  -4.709   6.644
  216   HD13  LEU  32          HD13      LEU  32  -5.551  -4.922   4.923
  217   HD21  LEU  32          HD21      LEU  32  -8.076  -4.418   4.502
  218   HD22  LEU  32          HD22      LEU  32  -8.189  -4.180   6.244
  219   HD23  LEU  32          HD23      LEU  32  -9.270  -5.326   5.438
  220    H    GLN  33           H        GLN  33  -4.606  -7.436   2.502
  221    HA   GLN  33           HA       GLN  33  -3.615  -8.968   1.196
  222    HB2  GLN  33           HB2      GLN  33  -5.489 -10.850   2.630
  223    HB3  GLN  33           HB1      GLN  33  -3.971 -11.286   1.860
  224    HG2  GLN  33           HG2      GLN  33  -2.787  -9.814   3.453
  225    HG3  GLN  33           HG1      GLN  33  -4.325  -9.502   4.256
  226   HE21  GLN  33          1HE2      GLN  33  -5.301 -11.171   5.411
  227   HE22  GLN  33          2HE2      GLN  33  -4.441 -12.567   5.928
  228    HA   PRO  34           HA       PRO  34  -6.741  -9.631  -2.075
  229    HB2  PRO  34           HB2      PRO  34  -6.186  -7.611  -3.716
  230    HB3  PRO  34           HB1      PRO  34  -7.088  -7.309  -2.226
  231    HG2  PRO  34           HG2      PRO  34  -4.227  -6.768  -2.848
  232    HG3  PRO  34           HG1      PRO  34  -5.369  -5.812  -1.891
  233    HD2  PRO  34           HD2      PRO  34  -3.463  -7.621  -0.888
  234    HD3  PRO  34           HD1      PRO  34  -4.812  -6.912   0.014
  235    HA   PRO  35           HA       PRO  35  -3.945 -11.687  -5.004
  236    HB2  PRO  35           HB2      PRO  35  -5.048 -10.040  -7.200
  237    HB3  PRO  35           HB1      PRO  35  -4.947 -11.793  -7.066
  238    HG2  PRO  35           HG2      PRO  35  -7.249 -10.434  -6.779
  239    HG3  PRO  35           HG1      PRO  35  -6.923 -11.952  -5.919
  240    HD2  PRO  35           HD2      PRO  35  -7.024  -9.178  -4.902
  241    HD3  PRO  35           HD1      PRO  35  -7.279 -10.706  -4.048
  242    HA   PRO  36           HA       PRO  36  -0.382  -9.080  -5.308
  243    HB2  PRO  36           HB2      PRO  36   0.727 -10.151  -7.654
  244    HB3  PRO  36           HB1      PRO  36   0.999 -10.748  -6.018
  245    HG2  PRO  36           HG2      PRO  36  -0.887 -11.729  -8.102
  246    HG3  PRO  36           HG1      PRO  36   0.050 -12.646  -6.910
  247    HD2  PRO  36           HD2      PRO  36  -2.566 -12.239  -6.601
  248    HD3  PRO  36           HD1      PRO  36  -1.471 -12.209  -5.204
  249    H    TRP  37           H        TRP  37  -2.197  -9.552  -8.262
  250    HA   TRP  37           HA       TRP  37  -1.151  -7.228  -9.558
  251    HB2  TRP  37           HB2      TRP  37  -2.979  -7.708 -11.249
  252    HB3  TRP  37           HB1      TRP  37  -1.769  -8.962 -11.021
  253    HD1  TRP  37           HD       TRP  37  -5.479  -8.214 -10.106
  254    HE1  TRP  37           HE1      TRP  37  -6.668 -10.471  -9.762
  255    HE3  TRP  37          3HE       TRP  37  -1.456 -11.352 -10.512
  256    HZ2  TRP  37           HZ2      TRP  37  -6.008 -13.197  -9.659
  257    HZ3  TRP  37           HZ3      TRP  37  -1.830 -13.775 -10.272
  258    HH2  TRP  37           HH       TRP  37  -4.059 -14.671  -9.854
  259    H    GLU  38           H        GLU  38  -3.539  -7.668  -7.229
  260    HA   GLU  38           HA       GLU  38  -5.148  -5.429  -8.078
  261    HB2  GLU  38           HB2      GLU  38  -5.290  -7.244  -5.684
  262    HB3  GLU  38           HB1      GLU  38  -6.422  -5.929  -5.985
  263    HG2  GLU  38           HG2      GLU  38  -5.939  -8.184  -7.901
  264    HG3  GLU  38           HG1      GLU  38  -7.207  -8.220  -6.690
  265    H    CYS  39           H        CYS  39  -2.433  -6.064  -6.094
  266    HA   CYS  39           HA       CYS  39  -2.713  -3.667  -4.527
  267    HB2  CYS  39           HB2      CYS  39  -0.377  -5.558  -4.893
  268    HB3  CYS  39           HB1      CYS  39  -0.343  -4.141  -3.854
  269    H    TYR  40           H        TYR  40  -2.162  -1.730  -5.170
  270    HA   TYR  40           HA       TYR  40  -0.960  -1.353  -7.766
  271    HB2  TYR  40           HB2      TYR  40  -1.662   0.726  -5.680
  272    HB3  TYR  40           HB1      TYR  40  -1.376   1.000  -7.388
  273    HD1  TYR  40           HD1      TYR  40  -3.067  -0.050  -9.042
  274    HD2  TYR  40           HD2      TYR  40  -3.798   0.371  -4.875
  275    HE1  TYR  40           HE1      TYR  40  -5.476  -0.234  -9.451
  276    HE2  TYR  40           HE2      TYR  40  -6.210   0.184  -5.266
  277    HH   TYR  40           HH       TYR  40  -7.513  -0.928  -8.101
  278    H    GLN  41           H        GLN  41   0.964   0.055  -7.928
  279    HA   GLN  41           HA       GLN  41   2.707  -0.292  -5.605
  280    HB2  GLN  41           HB2      GLN  41   3.419  -0.603  -8.516
  281    HB3  GLN  41           HB1      GLN  41   4.583  -0.601  -7.201
  282    HG2  GLN  41           HG2      GLN  41   3.482  -2.592  -6.261
  283    HG3  GLN  41           HG1      GLN  41   2.370  -2.589  -7.625
  284   HE21  GLN  41          1HE2      GLN  41   5.633  -3.047  -6.631
  285   HE22  GLN  41          2HE2      GLN  41   6.157  -3.888  -8.053
  286    H    CYS  42           H        CYS  42   4.148   1.333  -5.190
  287    HA   CYS  42           HA       CYS  42   3.348   3.872  -6.259
  288    HB2  CYS  42           HB2      CYS  42   5.265   3.155  -4.030
  289    HB3  CYS  42           HB1      CYS  42   4.787   4.796  -4.459
  Start of MODEL    3
    1    H    PCA   1           H        PGL   1 -10.162   4.322   2.306
    2    HA   PCA   1           HA       PGL   1  -9.666   6.827   1.950
    3    HB2  PCA   1           HB1      PGL   1 -10.391   8.132   3.670
    4    HB3  PCA   1           HB2      PGL   1  -9.252   7.313   4.774
    5    HG2  PCA   1           HG1      PGL   1 -12.131   6.943   4.550
    6    HG3  PCA   1           HG2      PGL   1 -10.992   6.185   5.712
    7    H    GLU   2           H        GLU   2  -8.510   4.349   4.069
    8    HA   GLU   2           HA       GLU   2  -5.784   5.368   3.781
    9    HB2  GLU   2           HB2      GLU   2  -6.846   3.225   5.616
   10    HB3  GLU   2           HB1      GLU   2  -5.177   3.762   5.531
   11    HG2  GLU   2           HG2      GLU   2  -5.877   5.994   6.242
   12    HG3  GLU   2           HG1      GLU   2  -7.538   5.410   6.369
   13    H    ALA   3           H        ALA   3  -4.169   4.023   3.041
   14    HA   ALA   3           HA       ALA   3  -5.129   1.793   1.447
   15    HB1  ALA   3           HB1      ALA   3  -3.053   2.061   0.215
   16    HB2  ALA   3           HB2      ALA   3  -2.563   3.375   1.287
   17    HB3  ALA   3           HB3      ALA   3  -3.961   3.571   0.225
   18    H    PHE   4           H        PHE   4  -4.377  -0.173   1.883
   19    HA   PHE   4           HA       PHE   4  -2.875  -0.556   4.329
   20    HB2  PHE   4           HB2      PHE   4  -3.966  -2.618   2.384
   21    HB3  PHE   4           HB1      PHE   4  -3.426  -2.917   4.028
   22    HD1  PHE   4           HD1      PHE   4  -6.181  -2.162   1.936
   23    HD2  PHE   4           HD2      PHE   4  -4.806  -1.799   5.935
   24    HE1  PHE   4           HE1      PHE   4  -8.496  -1.840   2.711
   25    HE2  PHE   4           HE2      PHE   4  -7.104  -1.475   6.705
   26    HZ   PHE   4           HZ       PHE   4  -8.954  -1.499   5.095
   27    H    CYS   5           H        CYS   5  -0.728  -0.790   4.253
   28    HA   CYS   5           HA       CYS   5   0.504  -0.922   1.620
   29    HB2  CYS   5           HB2      CYS   5   1.700  -0.186   4.288
   30    HB3  CYS   5           HB1      CYS   5   2.471  -0.022   2.715
   31    H    TYR   6           H        TYR   6   1.764  -2.527   1.022
   32    HA   TYR   6           HA       TYR   6   2.532  -4.590   2.972
   33    HB2  TYR   6           HB2      TYR   6   1.744  -5.253   0.103
   34    HB3  TYR   6           HB1      TYR   6   2.063  -6.333   1.422
   35    HD1  TYR   6           HD1      TYR   6  -0.417  -3.986   0.068
   36    HD2  TYR   6           HD2      TYR   6   0.374  -6.922   3.035
   37    HE1  TYR   6           HE1      TYR   6  -2.777  -4.051   0.613
   38    HE2  TYR   6           HE2      TYR   6  -2.015  -6.994   3.598
   39    HH   TYR   6           HH       TYR   6  -4.395  -5.319   1.672
   40    H    SER   7           H        SER   7   4.566  -4.920   3.024
   41    HA   SER   7           HA       SER   7   6.349  -3.522   1.329
   42    HB2  SER   7           HB2      SER   7   7.980  -4.910   2.713
   43    HB3  SER   7           HB1      SER   7   6.867  -3.837   3.591
   44    HG   SER   7           HG       SER   7   7.018  -6.053   4.416
   45    H    ASP   8           H        ASP   8   5.106  -6.698   1.637
   46    HA   ASP   8           HA       ASP   8   6.789  -7.992  -0.266
   47    HB2  ASP   8           HB2      ASP   8   5.577  -9.254   1.459
   48    HB3  ASP   8           HB1      ASP   8   4.049  -8.765   0.737
   49    H    ARG   9           H        ARG   9   6.451  -8.342  -2.395
   50    HA   ARG   9           HA       ARG   9   4.917  -6.286  -3.663
   51    HB2  ARG   9           HB2      ARG   9   6.511  -8.478  -4.976
   52    HB3  ARG   9           HB1      ARG   9   5.990  -6.971  -5.704
   53    HG2  ARG   9           HG2      ARG   9   8.065  -7.339  -3.546
   54    HG3  ARG   9           HG1      ARG   9   8.323  -6.816  -5.207
   55    HD2  ARG   9           HD2      ARG   9   6.799  -5.287  -3.092
   56    HD3  ARG   9           HD1      ARG   9   8.453  -4.967  -3.595
   57    HE   ARG   9           HE       ARG   9   6.608  -4.905  -5.763
   58   HH11  ARG   9          HH11      ARG   9   7.870  -2.973  -3.076
   59   HH12  ARG   9          HH12      ARG   9   7.602  -1.478  -3.860
   60   HH21  ARG   9          HH21      ARG   9   6.267  -2.813  -6.831
   61   HH22  ARG   9          HH22      ARG   9   6.713  -1.400  -6.022
   62    H    PHE  10           H        PHE  10   4.122  -9.378  -2.636
   63    HA   PHE  10           HA       PHE  10   2.185  -9.678  -4.779
   64    HB2  PHE  10           HB2      PHE  10   3.276 -11.772  -2.887
   65    HB3  PHE  10           HB1      PHE  10   2.119 -12.059  -4.183
   66    HD1  PHE  10           HD1      PHE  10   5.600 -11.537  -3.326
   67    HD2  PHE  10           HD2      PHE  10   2.836 -11.910  -6.537
   68    HE1  PHE  10           HE1      PHE  10   7.463 -11.912  -4.883
   69    HE2  PHE  10           HE2      PHE  10   4.690 -12.284  -8.092
   70    HZ   PHE  10           HZ       PHE  10   7.012 -12.286  -7.271
   71    H    CYS  11           H        CYS  11   2.238  -8.121  -2.121
   72    HA   CYS  11           HA       CYS  11   0.570  -7.264  -0.765
   73    HB2  CYS  11           HB2      CYS  11  -1.278  -9.367  -1.911
   74    HB3  CYS  11           HB1      CYS  11  -1.720  -7.896  -1.057
   75    H    GLN  12           H        GLN  12   2.196  -9.833  -0.158
   76    HA   GLN  12           HA       GLN  12   0.420 -11.270   1.605
   77    HB2  GLN  12           HB2      GLN  12   3.370 -11.608   1.136
   78    HB3  GLN  12           HB1      GLN  12   2.331 -12.721   2.016
   79    HG2  GLN  12           HG2      GLN  12   1.095 -13.227   0.022
   80    HG3  GLN  12           HG1      GLN  12   1.968 -11.989  -0.878
   81   HE21  GLN  12          1HE2      GLN  12   4.139 -12.318  -1.309
   82   HE22  GLN  12          2HE2      GLN  12   4.826 -13.897  -1.407
   83    H    ASN  13           H        ASN  13   2.743  -8.705   2.014
   84    HA   ASN  13           HA       ASN  13   2.832  -9.345   4.892
   85    HB2  ASN  13           HB2      ASN  13   4.944  -7.926   3.281
   86    HB3  ASN  13           HB1      ASN  13   4.972  -8.101   5.026
   87   HD21  ASN  13          HD21      ASN  13   6.890  -9.015   3.101
   88   HD22  ASN  13          HD22      ASN  13   6.974 -10.727   3.279
   89    H    TYR  14           H        TYR  14   1.300  -8.174   5.738
   90    HA   TYR  14           HA       TYR  14   0.722  -5.483   4.942
   91    HB2  TYR  14           HB2      TYR  14  -1.068  -6.930   5.706
   92    HB3  TYR  14           HB1      TYR  14  -0.243  -7.202   7.232
   93    HD1  TYR  14           HD1      TYR  14  -0.601  -5.763   9.064
   94    HD2  TYR  14           HD2      TYR  14  -1.957  -4.610   5.204
   95    HE1  TYR  14           HE1      TYR  14  -1.822  -3.907  10.063
   96    HE2  TYR  14           HE2      TYR  14  -3.174  -2.746   6.189
   97    HH   TYR  14           HH       TYR  14  -4.176  -2.137   8.488
   98    H    ILE  15           H        ILE  15   1.823  -3.762   5.596
   99    HA   ILE  15           HA       ILE  15   3.299  -3.970   8.129
  100    HB   ILE  15           HB       ILE  15   4.846  -2.242   7.267
  101   HG12  ILE  15          HG12      ILE  15   3.348  -2.626   4.659
  102   HG13  ILE  15          HG11      ILE  15   3.319  -1.177   5.651
  103   HG21  ILE  15          HG21      ILE  15   4.599  -4.684   5.518
  104   HG22  ILE  15          HG22      ILE  15   5.383  -4.612   7.091
  105   HG23  ILE  15          HG23      ILE  15   6.054  -3.708   5.731
  106   HD11  ILE  15          HD11      ILE  15   4.762  -0.894   3.740
  107   HD12  ILE  15          HD12      ILE  15   5.702  -2.308   4.211
  108   HD13  ILE  15          HD13      ILE  15   5.719  -0.865   5.223
  109    H    GLY  16           H        GLY  16   0.540  -2.720   7.076
  110    HA2  GLY  16           HA2      GLY  16  -0.425  -1.391   9.013
  111    HA3  GLY  16           HA1      GLY  16   0.850  -0.241   8.628
  112    H    SER  17           H        SER  17  -1.597   0.762   8.595
  113    HA   SER  17           HA       SER  17  -2.162   1.017   5.755
  114    HB2  SER  17           HB2      SER  17  -4.560   1.412   6.423
  115    HB3  SER  17           HB1      SER  17  -3.982  -0.232   6.684
  116    HG   SER  17           HG       SER  17  -5.150   0.487   8.448
  117    H    ILE  18           H        ILE  18  -2.149   3.019   5.041
  118    HA   ILE  18           HA       ILE  18  -2.464   5.238   6.857
  119    HB   ILE  18           HB       ILE  18  -0.435   6.349   5.797
  120   HG12  ILE  18          HG12      ILE  18   0.267   3.475   5.195
  121   HG13  ILE  18          HG11      ILE  18   0.067   4.786   4.040
  122   HG21  ILE  18          HG21      ILE  18  -0.449   5.841   8.111
  123   HG22  ILE  18          HG22      ILE  18   1.138   5.424   7.455
  124   HG23  ILE  18          HG23      ILE  18  -0.038   4.154   7.800
  125   HD11  ILE  18          HD11      ILE  18   2.234   4.575   6.118
  126   HD12  ILE  18          HD12      ILE  18   2.046   5.886   4.949
  127   HD13  ILE  18          HD13      ILE  18   2.409   4.252   4.394
  128    HA   PRO  19           HA       PRO  19  -4.482   6.886   3.313
  129    HB2  PRO  19           HB2      PRO  19  -4.318   9.547   3.835
  130    HB3  PRO  19           HB1      PRO  19  -5.409   8.466   4.707
  131    HG2  PRO  19           HG2      PRO  19  -2.726   9.505   5.515
  132    HG3  PRO  19           HG1      PRO  19  -4.199   9.348   6.492
  133    HD2  PRO  19           HD2      PRO  19  -2.159   7.575   6.620
  134    HD3  PRO  19           HD1      PRO  19  -3.842   7.089   6.861
  135    H    ASP  20           H        ASP  20  -1.230   7.727   4.069
  136    HA   ASP  20           HA       ASP  20  -0.765   8.446   1.257
  137    HB2  ASP  20           HB2      ASP  20   0.732   9.573   3.636
  138    HB3  ASP  20           HB1      ASP  20   1.023   9.953   1.948
  139    H    CYS  21           H        CYS  21  -0.185   6.396   0.758
  140    HA   CYS  21           HA       CYS  21   1.661   4.978   2.488
  141    HB2  CYS  21           HB2      CYS  21  -0.378   3.872   1.609
  142    HB3  CYS  21           HB1      CYS  21   0.269   4.023  -0.018
  143    H    CYS  22           H        CYS  22   1.916   6.943  -0.289
  144    HA   CYS  22           HA       CYS  22   4.067   5.376  -1.363
  145    HB2  CYS  22           HB2      CYS  22   2.765   7.871  -2.433
  146    HB3  CYS  22           HB1      CYS  22   4.136   7.074  -3.203
  147    H    PHE  23           H        PHE  23   4.160   7.112   1.149
  148    HA   PHE  23           HA       PHE  23   6.693   8.404   0.610
  149    HB2  PHE  23           HB2      PHE  23   5.021   8.149   3.111
  150    HB3  PHE  23           HB1      PHE  23   6.640   8.839   3.141
  151    HD1  PHE  23           HD1      PHE  23   7.106  10.955   2.013
  152    HD2  PHE  23           HD2      PHE  23   3.160   9.371   2.189
  153    HE1  PHE  23           HE1      PHE  23   6.204  13.146   1.377
  154    HE2  PHE  23           HE2      PHE  23   2.257  11.572   1.546
  155    HZ   PHE  23           HZ       PHE  23   3.778  13.455   1.143
  156    H    GLY  24           H        GLY  24   5.651   5.368   1.027
  157    HA2  GLY  24           HA2      GLY  24   8.304   4.479   1.860
  158    HA3  GLY  24           HA1      GLY  24   6.838   3.705   2.468
  159    H    ARG  25           H        ARG  25   9.087   2.843   0.574
  160    HA   ARG  25           HA       ARG  25   7.644   2.361  -1.863
  161    HB2  ARG  25           HB2      ARG  25  10.276   1.230  -0.888
  162    HB3  ARG  25           HB1      ARG  25   9.599   0.952  -2.485
  163    HG2  ARG  25           HG2      ARG  25  10.429   3.623  -1.359
  164    HG3  ARG  25           HG1      ARG  25  11.313   2.669  -2.553
  165    HD2  ARG  25           HD2      ARG  25   9.438   2.886  -4.110
  166    HD3  ARG  25           HD1      ARG  25   8.547   3.828  -2.919
  167    HE   ARG  25           HE       ARG  25  11.042   5.001  -3.369
  168   HH11  ARG  25          HH11      ARG  25   7.951   4.552  -5.092
  169   HH12  ARG  25          HH12      ARG  25   8.107   6.011  -5.972
  170   HH21  ARG  25          HH21      ARG  25  11.204   6.979  -4.600
  171   HH22  ARG  25          HH22      ARG  25   9.954   7.403  -5.679
  172    H    GLY  26           H        GLY  26   6.365   0.726  -2.327
  173    HA2  GLY  26           HA2      GLY  26   6.477  -1.842  -1.546
  174    HA3  GLY  26           HA1      GLY  26   5.604  -1.036  -0.243
  175    H    SER  27           H        SER  27   3.946  -2.545  -1.075
  176    HA   SER  27           HA       SER  27   2.563  -1.552  -3.457
  177    HB2  SER  27           HB2      SER  27   1.973  -4.082  -1.906
  178    HB3  SER  27           HB1      SER  27   1.563  -3.675  -3.574
  179    HG   SER  27           HG       SER  27   3.824  -4.771  -2.532
  180    H    TYR  28           H        TYR  28   0.274  -1.083  -3.171
  181    HA   TYR  28           HA       TYR  28  -0.716  -1.160  -0.443
  182    HB2  TYR  28           HB2      TYR  28  -1.438   1.138  -0.395
  183    HB3  TYR  28           HB1      TYR  28   0.279   1.092  -0.705
  184    HD1  TYR  28           HD1      TYR  28  -2.931   2.262  -1.876
  185    HD2  TYR  28           HD2      TYR  28   1.094   1.559  -3.080
  186    HE1  TYR  28           HE1      TYR  28  -3.244   3.761  -3.771
  187    HE2  TYR  28           HE2      TYR  28   0.787   3.056  -4.981
  188    HH   TYR  28           HH       TYR  28  -1.066   3.906  -6.344
  189    H    SER  29           H        SER  29  -2.913  -1.299  -0.277
  190    HA   SER  29           HA       SER  29  -4.497  -1.109  -2.702
  191    HB2  SER  29           HB2      SER  29  -5.521  -3.344  -2.228
  192    HB3  SER  29           HB1      SER  29  -3.820  -3.453  -2.682
  193    HG   SER  29           HG       SER  29  -4.988  -4.307  -0.422
  194    H    PHE  30           H        PHE  30  -6.862  -1.378  -2.070
  195    HA   PHE  30           HA       PHE  30  -7.258  -0.201   0.584
  196    HB2  PHE  30           HB2      PHE  30  -9.039  -0.080  -1.863
  197    HB3  PHE  30           HB1      PHE  30  -9.342   0.733  -0.327
  198    HD1  PHE  30           HD1      PHE  30  -7.849   1.009  -3.531
  199    HD2  PHE  30           HD2      PHE  30  -7.546   2.407   0.477
  200    HE1  PHE  30           HE1      PHE  30  -6.513   2.920  -4.291
  201    HE2  PHE  30           HE2      PHE  30  -6.227   4.320  -0.288
  202    HZ   PHE  30           HZ       PHE  30  -5.703   4.579  -2.672
  203    H    GLU  31           H        GLU  31  -6.968  -2.986  -0.351
  204    HA   GLU  31           HA       GLU  31  -9.265  -4.108   1.049
  205    HB2  GLU  31           HB2      GLU  31  -8.083  -5.227  -1.516
  206    HB3  GLU  31           HB1      GLU  31  -9.349  -5.988  -0.562
  207    HG2  GLU  31           HG2      GLU  31 -10.806  -4.065  -0.991
  208    HG3  GLU  31           HG1      GLU  31  -9.547  -3.344  -1.984
  209    H    LEU  32           H        LEU  32  -8.708  -5.847   2.356
  210    HA   LEU  32           HA       LEU  32  -5.939  -5.986   3.068
  211    HB2  LEU  32           HB2      LEU  32  -8.416  -7.192   4.234
  212    HB3  LEU  32           HB1      LEU  32  -6.823  -7.651   4.796
  213    HG   LEU  32           HG       LEU  32  -7.873  -4.818   4.852
  214   HD11  LEU  32          HD11      LEU  32  -9.164  -6.255   6.328
  215   HD12  LEU  32          HD12      LEU  32  -8.103  -5.193   7.258
  216   HD13  LEU  32          HD13      LEU  32  -7.675  -6.890   7.024
  217   HD21  LEU  32          HD21      LEU  32  -5.434  -4.977   4.769
  218   HD22  LEU  32          HD22      LEU  32  -5.460  -6.127   6.104
  219   HD23  LEU  32          HD23      LEU  32  -5.978  -4.464   6.365
  220    H    GLN  33           H        GLN  33  -4.555  -7.237   2.369
  221    HA   GLN  33           HA       GLN  33  -3.512  -8.742   1.085
  222    HB2  GLN  33           HB2      GLN  33  -5.123 -10.580   2.846
  223    HB3  GLN  33           HB1      GLN  33  -3.731 -11.076   1.893
  224    HG2  GLN  33           HG2      GLN  33  -2.311  -9.555   3.144
  225    HG3  GLN  33           HG1      GLN  33  -3.706  -9.011   4.076
  226   HE21  GLN  33          1HE2      GLN  33  -1.466 -11.599   3.525
  227   HE22  GLN  33          2HE2      GLN  33  -1.865 -12.496   4.930
  228    HA   PRO  34           HA       PRO  34  -6.665  -9.919  -1.981
  229    HB2  PRO  34           HB2      PRO  34  -6.301  -8.003  -3.807
  230    HB3  PRO  34           HB1      PRO  34  -7.243  -7.666  -2.354
  231    HG2  PRO  34           HG2      PRO  34  -4.451  -6.872  -3.021
  232    HG3  PRO  34           HG1      PRO  34  -5.692  -5.976  -2.130
  233    HD2  PRO  34           HD2      PRO  34  -3.602  -7.479  -1.011
  234    HD3  PRO  34           HD1      PRO  34  -5.023  -6.864  -0.154
  235    HA   PRO  35           HA       PRO  35  -3.603 -11.918  -4.586
  236    HB2  PRO  35           HB2      PRO  35  -4.540 -11.362  -7.168
  237    HB3  PRO  35           HB1      PRO  35  -5.020 -12.741  -6.181
  238    HG2  PRO  35           HG2      PRO  35  -6.428 -10.180  -6.671
  239    HG3  PRO  35           HG1      PRO  35  -7.093 -11.792  -6.382
  240    HD2  PRO  35           HD2      PRO  35  -7.101  -9.851  -4.498
  241    HD3  PRO  35           HD1      PRO  35  -6.972 -11.574  -4.104
  242    HA   PRO  36           HA       PRO  36  -0.326  -9.103  -5.308
  243    HB2  PRO  36           HB2      PRO  36   0.562 -10.101  -7.804
  244    HB3  PRO  36           HB1      PRO  36   1.173 -10.525  -6.206
  245    HG2  PRO  36           HG2      PRO  36  -0.813 -11.928  -7.910
  246    HG3  PRO  36           HG1      PRO  36   0.352 -12.600  -6.754
  247    HD2  PRO  36           HD2      PRO  36  -2.236 -12.496  -6.204
  248    HD3  PRO  36           HD1      PRO  36  -1.034 -12.148  -4.935
  249    H    TRP  37           H        TRP  37  -2.390  -9.559  -8.120
  250    HA   TRP  37           HA       TRP  37  -1.403  -7.244  -9.480
  251    HB2  TRP  37           HB2      TRP  37  -3.331  -7.653 -11.050
  252    HB3  TRP  37           HB1      TRP  37  -2.179  -8.971 -10.884
  253    HD1  TRP  37           HD       TRP  37  -5.786  -8.018  -9.783
  254    HE1  TRP  37           HE1      TRP  37  -7.089 -10.182  -9.407
  255    HE3  TRP  37          3HE       TRP  37  -1.972 -11.374 -10.373
  256    HZ2  TRP  37           HZ2      TRP  37  -6.580 -12.972  -9.350
  257    HZ3  TRP  37           HZ3      TRP  37  -2.467 -13.769 -10.126
  258    HH2  TRP  37           HH       TRP  37  -4.725 -14.546  -9.627
  259    H    GLU  38           H        GLU  38  -3.640  -7.623  -6.997
  260    HA   GLU  38           HA       GLU  38  -5.315  -5.398  -7.745
  261    HB2  GLU  38           HB2      GLU  38  -5.208  -7.156  -5.325
  262    HB3  GLU  38           HB1      GLU  38  -6.419  -5.903  -5.582
  263    HG2  GLU  38           HG2      GLU  38  -5.954  -8.160  -7.494
  264    HG3  GLU  38           HG1      GLU  38  -7.116  -8.266  -6.183
  265    H    CYS  39           H        CYS  39  -2.389  -5.813  -6.096
  266    HA   CYS  39           HA       CYS  39  -2.787  -3.409  -4.515
  267    HB2  CYS  39           HB2      CYS  39  -0.375  -5.210  -4.737
  268    HB3  CYS  39           HB1      CYS  39  -0.490  -3.787  -3.709
  269    H    TYR  40           H        TYR  40  -1.971  -1.509  -4.950
  270    HA   TYR  40           HA       TYR  40  -0.821  -1.066  -7.578
  271    HB2  TYR  40           HB2      TYR  40  -1.410   0.982  -5.430
  272    HB3  TYR  40           HB1      TYR  40  -1.287   1.237  -7.163
  273    HD1  TYR  40           HD1      TYR  40  -3.470   0.629  -4.428
  274    HD2  TYR  40           HD2      TYR  40  -3.129   0.191  -8.635
  275    HE1  TYR  40           HE1      TYR  40  -5.898   0.405  -4.585
  276    HE2  TYR  40           HE2      TYR  40  -5.566  -0.036  -8.813
  277    HH   TYR  40           HH       TYR  40  -7.454  -0.711  -7.375
  278    H    GLN  41           H        GLN  41   1.139   0.518  -7.490
  279    HA   GLN  41           HA       GLN  41   2.844  -0.253  -5.229
  280    HB2  GLN  41           HB2      GLN  41   3.665  -0.077  -8.132
  281    HB3  GLN  41           HB1      GLN  41   4.707  -0.513  -6.783
  282    HG2  GLN  41           HG2      GLN  41   3.390  -2.511  -6.387
  283    HG3  GLN  41           HG1      GLN  41   2.298  -2.070  -7.693
  284   HE21  GLN  41          1HE2      GLN  41   2.701  -3.905  -8.835
  285   HE22  GLN  41          2HE2      GLN  41   4.192  -4.205  -9.653
  286    H    CYS  42           H        CYS  42   4.266   1.327  -4.521
  287    HA   CYS  42           HA       CYS  42   3.779   3.995  -5.578
  288    HB2  CYS  42           HB2      CYS  42   5.041   3.080  -2.992
  289    HB3  CYS  42           HB1      CYS  42   4.954   4.763  -3.496
  Start of MODEL    4
    1    H    PCA   1           H        PGL   1 -10.899   2.828   1.864
    2    HA   PCA   1           HA       PGL   1 -10.597   5.314   1.430
    3    HB2  PCA   1           HB1      PGL   1 -11.718   6.573   2.971
    4    HB3  PCA   1           HB2      PGL   1 -10.493   6.104   4.180
    5    HG2  PCA   1           HG1      PGL   1 -13.243   5.179   3.962
    6    HG3  PCA   1           HG2      PGL   1 -12.011   4.768   5.202
    7    H    GLU   2           H        GLU   2  -9.390   3.041   3.672
    8    HA   GLU   2           HA       GLU   2  -6.895   4.468   4.128
    9    HB2  GLU   2           HB2      GLU   2  -7.831   1.784   5.151
   10    HB3  GLU   2           HB1      GLU   2  -6.375   2.627   5.651
   11    HG2  GLU   2           HG2      GLU   2  -9.215   3.495   6.118
   12    HG3  GLU   2           HG1      GLU   2  -8.070   2.902   7.322
   13    H    ALA   3           H        ALA   3  -5.015   3.923   3.146
   14    HA   ALA   3           HA       ALA   3  -5.137   1.829   1.147
   15    HB1  ALA   3           HB1      ALA   3  -2.913   2.671   0.484
   16    HB2  ALA   3           HB2      ALA   3  -2.940   3.799   1.835
   17    HB3  ALA   3           HB3      ALA   3  -4.100   3.971   0.519
   18    H    PHE   4           H        PHE   4  -4.574  -0.128   1.684
   19    HA   PHE   4           HA       PHE   4  -3.170  -0.611   4.168
   20    HB2  PHE   4           HB2      PHE   4  -4.313  -2.529   2.134
   21    HB3  PHE   4           HB1      PHE   4  -3.693  -2.983   3.712
   22    HD1  PHE   4           HD1      PHE   4  -4.853  -1.422   5.675
   23    HD2  PHE   4           HD2      PHE   4  -6.560  -2.507   1.940
   24    HE1  PHE   4           HE1      PHE   4  -7.102  -1.100   6.613
   25    HE2  PHE   4           HE2      PHE   4  -8.811  -2.183   2.868
   26    HZ   PHE   4           HZ       PHE   4  -9.090  -1.485   5.192
   27    H    CYS   5           H        CYS   5  -1.070  -0.795   4.195
   28    HA   CYS   5           HA       CYS   5   0.275  -0.948   1.629
   29    HB2  CYS   5           HB2      CYS   5   1.354  -0.108   4.303
   30    HB3  CYS   5           HB1      CYS   5   2.142   0.069   2.737
   31    H    TYR   6           H        TYR   6   1.382  -2.582   1.080
   32    HA   TYR   6           HA       TYR   6   2.258  -4.550   3.063
   33    HB2  TYR   6           HB2      TYR   6   1.608  -4.982   0.119
   34    HB3  TYR   6           HB1      TYR   6   2.065  -6.221   1.278
   35    HD1  TYR   6           HD1      TYR   6  -0.630  -4.023   0.138
   36    HD2  TYR   6           HD2      TYR   6   0.450  -7.045   2.925
   37    HE1  TYR   6           HE1      TYR   6  -2.970  -4.341   0.682
   38    HE2  TYR   6           HE2      TYR   6  -1.904  -7.379   3.483
   39    HH   TYR   6           HH       TYR   6  -4.439  -5.814   1.647
   40    H    SER   7           H        SER   7   4.382  -4.909   3.111
   41    HA   SER   7           HA       SER   7   6.031  -2.958   1.860
   42    HB2  SER   7           HB2      SER   7   7.807  -4.135   3.182
   43    HB3  SER   7           HB1      SER   7   6.399  -3.570   4.100
   44    HG   SER   7           HG       SER   7   7.157  -6.165   3.420
   45    H    ASP   8           H        ASP   8   4.824  -5.647   0.535
   46    HA   ASP   8           HA       ASP   8   7.067  -5.987  -1.273
   47    HB2  ASP   8           HB2      ASP   8   7.451  -7.734   0.334
   48    HB3  ASP   8           HB1      ASP   8   5.767  -8.218   0.303
   49    H    ARG   9           H        ARG   9   6.414  -6.875  -3.313
   50    HA   ARG   9           HA       ARG   9   3.985  -5.815  -4.224
   51    HB2  ARG   9           HB2      ARG   9   6.156  -7.396  -5.467
   52    HB3  ARG   9           HB1      ARG   9   4.610  -7.382  -6.284
   53    HG2  ARG   9           HG2      ARG   9   6.089  -5.706  -7.206
   54    HG3  ARG   9           HG1      ARG   9   4.699  -4.952  -6.446
   55    HD2  ARG   9           HD2      ARG   9   6.061  -4.315  -4.536
   56    HD3  ARG   9           HD1      ARG   9   7.448  -5.184  -5.206
   57    HE   ARG   9           HE       ARG   9   6.623  -3.457  -7.160
   58   HH11  ARG   9          HH11      ARG   9   7.791  -2.967  -3.834
   59   HH12  ARG   9          HH12      ARG   9   8.580  -1.505  -4.203
   60   HH21  ARG   9          HH21      ARG   9   7.764  -1.458  -7.623
   61   HH22  ARG   9          HH22      ARG   9   8.572  -0.637  -6.381
   62    H    PHE  10           H        PHE  10   4.611  -8.988  -2.931
   63    HA   PHE  10           HA       PHE  10   2.448 -10.152  -4.378
   64    HB2  PHE  10           HB2      PHE  10   4.161 -11.241  -2.162
   65    HB3  PHE  10           HB1      PHE  10   2.817 -12.142  -2.854
   66    HD1  PHE  10           HD1      PHE  10   6.159 -10.770  -3.469
   67    HD2  PHE  10           HD2      PHE  10   2.953 -13.064  -5.054
   68    HE1  PHE  10           HE1      PHE  10   7.629 -11.570  -5.270
   69    HE2  PHE  10           HE2      PHE  10   4.413 -13.867  -6.853
   70    HZ   PHE  10           HZ       PHE  10   6.756 -13.121  -6.967
   71    H    CYS  11           H        CYS  11   2.340  -8.047  -1.887
   72    HA   CYS  11           HA       CYS  11   0.575  -7.256  -0.603
   73    HB2  CYS  11           HB2      CYS  11  -1.088  -9.338  -2.041
   74    HB3  CYS  11           HB1      CYS  11  -1.679  -7.930  -1.170
   75    H    GLN  12           H        GLN  12   2.163  -9.697   0.160
   76    HA   GLN  12           HA       GLN  12   0.262 -10.956   2.014
   77    HB2  GLN  12           HB2      GLN  12   2.866 -12.026   0.899
   78    HB3  GLN  12           HB1      GLN  12   1.839 -12.845   2.065
   79    HG2  GLN  12           HG2      GLN  12   0.083 -13.089   0.482
   80    HG3  GLN  12           HG1      GLN  12   0.900 -12.035  -0.666
   81   HE21  GLN  12          1HE2      GLN  12   2.638 -14.464   1.162
   82   HE22  GLN  12          2HE2      GLN  12   2.938 -15.503  -0.179
   83    H    ASN  13           H        ASN  13   2.193  -8.467   2.174
   84    HA   ASN  13           HA       ASN  13   3.148  -9.190   4.855
   85    HB2  ASN  13           HB2      ASN  13   4.774  -7.665   2.793
   86    HB3  ASN  13           HB1      ASN  13   5.203  -7.775   4.491
   87   HD21  ASN  13          HD21      ASN  13   6.073  -9.706   5.266
   88   HD22  ASN  13          HD22      ASN  13   6.570 -10.984   4.224
   89    H    TYR  14           H        TYR  14   1.317  -8.164   5.644
   90    HA   TYR  14           HA       TYR  14   0.645  -5.484   4.918
   91    HB2  TYR  14           HB2      TYR  14  -1.041  -7.159   5.525
   92    HB3  TYR  14           HB1      TYR  14  -0.336  -7.293   7.124
   93    HD1  TYR  14           HD1      TYR  14  -1.120  -5.952   8.864
   94    HD2  TYR  14           HD2      TYR  14  -2.045  -4.895   4.854
   95    HE1  TYR  14           HE1      TYR  14  -2.684  -4.253   9.682
   96    HE2  TYR  14           HE2      TYR  14  -3.605  -3.189   5.664
   97    HH   TYR  14           HH       TYR  14  -4.990  -2.823   7.762
   98    H    ILE  15           H        ILE  15   1.569  -3.715   5.741
   99    HA   ILE  15           HA       ILE  15   2.931  -3.964   8.337
  100    HB   ILE  15           HB       ILE  15   4.228  -1.974   7.765
  101   HG12  ILE  15          HG12      ILE  15   2.799  -2.059   5.088
  102   HG13  ILE  15          HG11      ILE  15   2.546  -0.848   6.336
  103   HG21  ILE  15          HG21      ILE  15   5.590  -2.944   5.972
  104   HG22  ILE  15          HG22      ILE  15   4.284  -4.069   5.598
  105   HG23  ILE  15          HG23      ILE  15   5.102  -4.158   7.157
  106   HD11  ILE  15          HD11      ILE  15   3.956   0.000   4.550
  107   HD12  ILE  15          HD12      ILE  15   5.102  -1.314   4.812
  108   HD13  ILE  15          HD13      ILE  15   4.859  -0.094   6.062
  109    H    GLY  16           H        GLY  16   0.171  -2.820   6.964
  110    HA2  GLY  16           HA2      GLY  16  -1.412  -1.968   8.675
  111    HA3  GLY  16           HA1      GLY  16  -0.166  -0.774   9.044
  112    H    SER  17           H        SER  17  -1.833   0.773   8.525
  113    HA   SER  17           HA       SER  17  -1.976   1.255   5.641
  114    HB2  SER  17           HB2      SER  17  -4.147   2.413   6.184
  115    HB3  SER  17           HB1      SER  17  -4.196   0.670   6.454
  116    HG   SER  17           HG       SER  17  -3.472   2.430   8.509
  117    H    ILE  18           H        ILE  18  -1.129   3.215   5.117
  118    HA   ILE  18           HA       ILE  18  -0.798   5.191   7.202
  119    HB   ILE  18           HB       ILE  18   1.629   5.540   6.495
  120   HG12  ILE  18          HG12      ILE  18   1.193   2.816   5.260
  121   HG13  ILE  18          HG11      ILE  18   1.605   4.303   4.423
  122   HG21  ILE  18          HG21      ILE  18   2.542   3.798   7.957
  123   HG22  ILE  18          HG22      ILE  18   1.009   2.933   7.878
  124   HG23  ILE  18          HG23      ILE  18   1.082   4.513   8.647
  125   HD11  ILE  18          HD11      ILE  18   3.335   2.837   6.380
  126   HD12  ILE  18          HD12      ILE  18   3.791   4.301   5.491
  127   HD13  ILE  18          HD13      ILE  18   3.499   2.786   4.626
  128    HA   PRO  19           HA       PRO  19  -1.772   7.747   3.628
  129    HB2  PRO  19           HB2      PRO  19  -0.691  10.021   5.154
  130    HB3  PRO  19           HB1      PRO  19  -2.342   9.745   4.594
  131    HG2  PRO  19           HG2      PRO  19  -1.702   9.597   7.192
  132    HG3  PRO  19           HG1      PRO  19  -2.918   8.529   6.473
  133    HD2  PRO  19           HD2      PRO  19  -0.054   7.949   7.153
  134    HD3  PRO  19           HD1      PRO  19  -1.517   6.964   7.410
  135    H    ASP  20           H        ASP  20   1.271   7.450   5.081
  136    HA   ASP  20           HA       ASP  20   2.666   8.892   2.936
  137    HB2  ASP  20           HB2      ASP  20   3.744   7.711   5.509
  138    HB3  ASP  20           HB1      ASP  20   4.713   8.547   4.312
  139    H    CYS  21           H        CYS  21   1.302   6.339   2.607
  140    HA   CYS  21           HA       CYS  21   2.853   4.038   2.724
  141    HB2  CYS  21           HB2      CYS  21   0.347   4.389   2.183
  142    HB3  CYS  21           HB1      CYS  21   0.883   4.599   0.522
  143    H    CYS  22           H        CYS  22   2.581   6.463   0.189
  144    HA   CYS  22           HA       CYS  22   4.214   4.926  -1.586
  145    HB2  CYS  22           HB2      CYS  22   2.755   7.523  -1.936
  146    HB3  CYS  22           HB1      CYS  22   3.701   6.761  -3.205
  147    H    PHE  23           H        PHE  23   5.175   6.619   0.898
  148    HA   PHE  23           HA       PHE  23   7.292   8.029  -0.532
  149    HB2  PHE  23           HB2      PHE  23   6.436   8.144   2.364
  150    HB3  PHE  23           HB1      PHE  23   7.886   8.938   1.763
  151    HD1  PHE  23           HD1      PHE  23   4.226   8.919   1.675
  152    HD2  PHE  23           HD2      PHE  23   7.752  10.935   0.443
  153    HE1  PHE  23           HE1      PHE  23   2.871  10.873   1.026
  154    HE2  PHE  23           HE2      PHE  23   6.409  12.893  -0.216
  155    HZ   PHE  23           HZ       PHE  23   3.968  12.860   0.075
  156    H    GLY  24           H        GLY  24   6.790   5.035   0.319
  157    HA2  GLY  24           HA2      GLY  24   9.625   4.504   0.630
  158    HA3  GLY  24           HA1      GLY  24   8.531   3.845   1.847
  159    H    ARG  25           H        ARG  25   9.721   1.918   0.726
  160    HA   ARG  25           HA       ARG  25   8.587   1.036  -1.744
  161    HB2  ARG  25           HB2      ARG  25   9.648  -1.141  -1.295
  162    HB3  ARG  25           HB1      ARG  25  10.787   0.158  -0.992
  163    HG2  ARG  25           HG2      ARG  25  10.614  -0.112   1.360
  164    HG3  ARG  25           HG1      ARG  25   9.194  -1.138   1.204
  165    HD2  ARG  25           HD2      ARG  25  11.083  -2.517   1.742
  166    HD3  ARG  25           HD1      ARG  25  10.605  -2.834   0.081
  167    HE   ARG  25           HE       ARG  25  12.630  -0.888   0.123
  168   HH11  ARG  25          HH11      ARG  25  12.168  -4.365   0.661
  169   HH12  ARG  25          HH12      ARG  25  13.777  -4.791   0.349
  170   HH21  ARG  25          HH21      ARG  25  14.843  -1.451  -0.292
  171   HH22  ARG  25          HH22      ARG  25  15.368  -3.068  -0.205
  172    H    GLY  26           H        GLY  26   6.639   0.054  -2.075
  173    HA2  GLY  26           HA2      GLY  26   5.504  -1.771  -0.370
  174    HA3  GLY  26           HA1      GLY  26   4.875  -0.195   0.081
  175    H    SER  27           H        SER  27   3.400  -2.280  -0.832
  176    HA   SER  27           HA       SER  27   2.329  -1.259  -3.369
  177    HB2  SER  27           HB2      SER  27   1.873  -4.026  -2.242
  178    HB3  SER  27           HB1      SER  27   1.722  -3.468  -3.909
  179    HG   SER  27           HG       SER  27   3.811  -4.516  -2.631
  180    H    TYR  28           H        TYR  28   0.153  -0.666  -3.106
  181    HA   TYR  28           HA       TYR  28  -0.991  -1.256  -0.461
  182    HB2  TYR  28           HB2      TYR  28  -1.998   0.921  -0.299
  183    HB3  TYR  28           HB1      TYR  28  -0.281   1.130  -0.595
  184    HD1  TYR  28           HD1      TYR  28  -3.648   1.767  -1.820
  185    HD2  TYR  28           HD2      TYR  28   0.480   1.886  -2.855
  186    HE1  TYR  28           HE1      TYR  28  -4.168   3.221  -3.702
  187    HE2  TYR  28           HE2      TYR  28  -0.030   3.340  -4.737
  188    HH   TYR  28           HH       TYR  28  -1.882   3.909  -6.144
  189    H    SER  29           H        SER  29  -3.181  -1.540  -0.323
  190    HA   SER  29           HA       SER  29  -4.692  -1.524  -2.806
  191    HB2  SER  29           HB2      SER  29  -5.674  -3.723  -2.129
  192    HB3  SER  29           HB1      SER  29  -3.955  -3.816  -2.529
  193    HG   SER  29           HG       SER  29  -5.222  -4.338  -0.163
  194    H    PHE  30           H        PHE  30  -7.093  -1.751  -2.228
  195    HA   PHE  30           HA       PHE  30  -7.547  -0.262   0.249
  196    HB2  PHE  30           HB2      PHE  30  -9.354  -0.578  -2.165
  197    HB3  PHE  30           HB1      PHE  30  -9.693   0.418  -0.753
  198    HD1  PHE  30           HD1      PHE  30  -8.026   2.308  -0.227
  199    HD2  PHE  30           HD2      PHE  30  -8.214   0.309  -3.978
  200    HE1  PHE  30           HE1      PHE  30  -6.849   4.188  -1.286
  201    HE2  PHE  30           HE2      PHE  30  -7.039   2.187  -5.042
  202    HZ   PHE  30           HZ       PHE  30  -6.357   4.132  -3.698
  203    H    GLU  31           H        GLU  31  -7.343  -3.240  -0.565
  204    HA   GLU  31           HA       GLU  31  -9.522  -4.158   1.166
  205    HB2  GLU  31           HB2      GLU  31 -10.085  -4.662  -1.181
  206    HB3  GLU  31           HB1      GLU  31  -8.542  -5.470  -1.390
  207    HG2  GLU  31           HG2      GLU  31 -10.449  -7.011  -1.143
  208    HG3  GLU  31           HG1      GLU  31  -9.218  -7.222   0.102
  209    H    LEU  32           H        LEU  32  -8.991  -6.080   2.332
  210    HA   LEU  32           HA       LEU  32  -6.162  -6.203   2.965
  211    HB2  LEU  32           HB2      LEU  32  -8.593  -7.317   4.318
  212    HB3  LEU  32           HB1      LEU  32  -6.963  -7.684   4.840
  213    HG   LEU  32           HG       LEU  32  -8.169  -4.913   4.785
  214   HD11  LEU  32          HD11      LEU  32  -7.666  -6.824   7.055
  215   HD12  LEU  32          HD12      LEU  32  -9.247  -6.308   6.456
  216   HD13  LEU  32          HD13      LEU  32  -8.167  -5.145   7.228
  217   HD21  LEU  32          HD21      LEU  32  -5.577  -5.967   5.908
  218   HD22  LEU  32          HD22      LEU  32  -6.202  -4.334   6.120
  219   HD23  LEU  32          HD23      LEU  32  -5.750  -4.896   4.515
  220    H    GLN  33           H        GLN  33  -4.919  -7.872   2.706
  221    HA   GLN  33           HA       GLN  33  -4.026  -9.686   1.751
  222    HB2  GLN  33           HB2      GLN  33  -6.583 -11.003   2.660
  223    HB3  GLN  33           HB1      GLN  33  -5.091 -11.827   2.243
  224    HG2  GLN  33           HG2      GLN  33  -5.516  -9.936   4.544
  225    HG3  GLN  33           HG1      GLN  33  -5.343 -11.687   4.638
  226   HE21  GLN  33          1HE2      GLN  33  -3.315 -12.586   4.310
  227   HE22  GLN  33          2HE2      GLN  33  -1.863 -11.661   4.443
  228    HA   PRO  34           HA       PRO  34  -6.517  -9.872  -2.145
  229    HB2  PRO  34           HB2      PRO  34  -5.706  -7.778  -3.542
  230    HB3  PRO  34           HB1      PRO  34  -6.842  -7.538  -2.209
  231    HG2  PRO  34           HG2      PRO  34  -3.916  -6.980  -2.323
  232    HG3  PRO  34           HG1      PRO  34  -5.198  -6.082  -1.496
  233    HD2  PRO  34           HD2      PRO  34  -3.468  -8.004  -0.333
  234    HD3  PRO  34           HD1      PRO  34  -4.915  -7.295   0.399
  235    HA   PRO  35           HA       PRO  35  -2.975 -11.597  -4.312
  236    HB2  PRO  35           HB2      PRO  35  -3.759 -11.463  -6.927
  237    HB3  PRO  35           HB1      PRO  35  -4.401 -12.654  -5.793
  238    HG2  PRO  35           HG2      PRO  35  -5.613 -10.117  -6.768
  239    HG3  PRO  35           HG1      PRO  35  -6.385 -11.669  -6.419
  240    HD2  PRO  35           HD2      PRO  35  -6.460  -9.508  -4.742
  241    HD3  PRO  35           HD1      PRO  35  -6.621 -11.187  -4.200
  242    HA   PRO  36           HA       PRO  36   0.029  -8.524  -5.250
  243    HB2  PRO  36           HB2      PRO  36   0.857  -9.512  -7.795
  244    HB3  PRO  36           HB1      PRO  36   1.646  -9.739  -6.238
  245    HG2  PRO  36           HG2      PRO  36  -0.189 -11.535  -7.708
  246    HG3  PRO  36           HG1      PRO  36   1.062 -11.935  -6.522
  247    HD2  PRO  36           HD2      PRO  36  -1.542 -12.097  -5.939
  248    HD3  PRO  36           HD1      PRO  36  -0.356 -11.562  -4.722
  249    H    TRP  37           H        TRP  37  -1.902  -9.295  -8.114
  250    HA   TRP  37           HA       TRP  37  -1.278  -6.874  -9.444
  251    HB2  TRP  37           HB2      TRP  37  -3.178  -7.539 -10.998
  252    HB3  TRP  37           HB1      TRP  37  -1.832  -8.658 -10.857
  253    HD1  TRP  37           HD       TRP  37  -5.539  -8.303  -9.792
  254    HE1  TRP  37           HE1      TRP  37  -6.455 -10.642  -9.299
  255    HE3  TRP  37          3HE       TRP  37  -1.197 -10.982 -10.219
  256    HZ2  TRP  37           HZ2      TRP  37  -5.476 -13.298  -9.122
  257    HZ3  TRP  37           HZ3      TRP  37  -1.279 -13.417  -9.861
  258    HH2  TRP  37           HH       TRP  37  -3.374 -14.543  -9.329
  259    H    GLU  38           H        GLU  38  -3.435  -7.465  -6.912
  260    HA   GLU  38           HA       GLU  38  -5.155  -5.260  -7.665
  261    HB2  GLU  38           HB2      GLU  38  -5.252  -7.206  -5.385
  262    HB3  GLU  38           HB1      GLU  38  -6.408  -5.891  -5.583
  263    HG2  GLU  38           HG2      GLU  38  -5.928  -8.172  -7.484
  264    HG3  GLU  38           HG1      GLU  38  -7.334  -7.980  -6.439
  265    H    CYS  39           H        CYS  39  -2.255  -5.632  -6.163
  266    HA   CYS  39           HA       CYS  39  -2.689  -3.320  -4.446
  267    HB2  CYS  39           HB2      CYS  39  -0.268  -5.106  -4.749
  268    HB3  CYS  39           HB1      CYS  39  -0.358  -3.699  -3.697
  269    H    TYR  40           H        TYR  40  -1.753  -1.444  -4.858
  270    HA   TYR  40           HA       TYR  40  -0.777  -1.109  -7.587
  271    HB2  TYR  40           HB2      TYR  40  -1.719   1.022  -5.663
  272    HB3  TYR  40           HB1      TYR  40  -1.522   1.155  -7.410
  273    HD1  TYR  40           HD1      TYR  40  -3.021  -0.292  -8.883
  274    HD2  TYR  40           HD2      TYR  40  -3.781   0.359  -4.752
  275    HE1  TYR  40           HE1      TYR  40  -5.327  -1.014  -9.198
  276    HE2  TYR  40           HE2      TYR  40  -6.095  -0.358  -5.057
  277    HH   TYR  40           HH       TYR  40  -7.103  -2.000  -7.764
  278    H    GLN  41           H        GLN  41   1.165  -0.180  -7.948
  279    HA   GLN  41           HA       GLN  41   2.988  -0.165  -5.707
  280    HB2  GLN  41           HB2      GLN  41   3.447   0.212  -8.658
  281    HB3  GLN  41           HB1      GLN  41   4.724   0.242  -7.456
  282    HG2  GLN  41           HG2      GLN  41   4.164  -2.077  -6.842
  283    HG3  GLN  41           HG1      GLN  41   2.942  -2.092  -8.111
  284   HE21  GLN  41          1HE2      GLN  41   4.594  -0.510  -9.930
  285   HE22  GLN  41          2HE2      GLN  41   5.813  -1.566 -10.512
  286    H    CYS  42           H        CYS  42   4.090   1.577  -4.989
  287    HA   CYS  42           HA       CYS  42   2.964   4.165  -5.651
  288    HB2  CYS  42           HB2      CYS  42   4.678   3.166  -3.405
  289    HB3  CYS  42           HB1      CYS  42   4.323   4.869  -3.654
  Start of MODEL    5
    1    H    PCA   1           H        PGL   1 -10.748   1.788   3.316
    2    HA   PCA   1           HA       PGL   1 -11.094   3.993   2.122
    3    HB2  PCA   1           HB1      PGL   1 -12.171   5.554   3.369
    4    HB3  PCA   1           HB2      PGL   1 -10.810   5.585   4.526
    5    HG2  PCA   1           HG1      PGL   1 -13.411   4.249   4.783
    6    HG3  PCA   1           HG2      PGL   1 -12.114   4.466   6.009
    7    H    GLU   2           H        GLU   2  -9.152   3.006   4.787
    8    HA   GLU   2           HA       GLU   2  -6.921   4.703   4.227
    9    HB2  GLU   2           HB2      GLU   2  -6.873   2.049   5.696
   10    HB3  GLU   2           HB1      GLU   2  -5.649   3.299   5.724
   11    HG2  GLU   2           HG2      GLU   2  -6.736   3.436   7.787
   12    HG3  GLU   2           HG1      GLU   2  -7.369   4.771   6.828
   13    H    ALA   3           H        ALA   3  -5.031   4.164   3.092
   14    HA   ALA   3           HA       ALA   3  -5.294   1.981   1.234
   15    HB1  ALA   3           HB1      ALA   3  -3.007   3.920   1.686
   16    HB2  ALA   3           HB2      ALA   3  -4.298   4.124   0.503
   17    HB3  ALA   3           HB3      ALA   3  -3.154   2.795   0.335
   18    H    PHE   4           H        PHE   4  -4.677   0.047   1.737
   19    HA   PHE   4           HA       PHE   4  -3.291  -0.460   4.215
   20    HB2  PHE   4           HB2      PHE   4  -4.344  -2.375   2.134
   21    HB3  PHE   4           HB1      PHE   4  -3.823  -2.820   3.748
   22    HD1  PHE   4           HD1      PHE   4  -5.090  -1.270   5.644
   23    HD2  PHE   4           HD2      PHE   4  -6.576  -2.297   1.797
   24    HE1  PHE   4           HE1      PHE   4  -7.399  -0.919   6.439
   25    HE2  PHE   4           HE2      PHE   4  -8.875  -1.946   2.585
   26    HZ   PHE   4           HZ       PHE   4  -9.293  -1.264   4.887
   27    H    CYS   5           H        CYS   5  -1.200  -0.725   4.355
   28    HA   CYS   5           HA       CYS   5   0.316  -0.674   1.888
   29    HB2  CYS   5           HB2      CYS   5   1.183  -0.238   4.730
   30    HB3  CYS   5           HB1      CYS   5   2.130   0.079   3.280
   31    H    TYR   6           H        TYR   6   1.543  -2.257   1.253
   32    HA   TYR   6           HA       TYR   6   2.312  -4.392   3.123
   33    HB2  TYR   6           HB2      TYR   6   1.653  -4.955   0.184
   34    HB3  TYR   6           HB1      TYR   6   2.039  -6.069   1.443
   35    HD1  TYR   6           HD1      TYR   6  -0.643  -3.685   0.451
   36    HD2  TYR   6           HD2      TYR   6   0.393  -7.131   2.707
   37    HE1  TYR   6           HE1      TYR   6  -2.988  -4.044   0.950
   38    HE2  TYR   6           HE2      TYR   6  -1.938  -7.506   3.232
   39    HH   TYR   6           HH       TYR   6  -4.516  -5.664   1.691
   40    H    SER   7           H        SER   7   4.390  -4.607   3.199
   41    HA   SER   7           HA       SER   7   5.994  -2.884   1.613
   42    HB2  SER   7           HB2      SER   7   7.859  -3.999   2.900
   43    HB3  SER   7           HB1      SER   7   6.539  -3.320   3.875
   44    HG   SER   7           HG       SER   7   7.279  -5.936   3.470
   45    H    ASP   8           H        ASP   8   4.994  -6.119   1.475
   46    HA   ASP   8           HA       ASP   8   6.883  -6.875  -0.573
   47    HB2  ASP   8           HB2      ASP   8   6.183  -8.570   1.050
   48    HB3  ASP   8           HB1      ASP   8   4.505  -8.358   0.560
   49    H    ARG   9           H        ARG   9   6.460  -7.007  -2.707
   50    HA   ARG   9           HA       ARG   9   4.366  -5.345  -3.716
   51    HB2  ARG   9           HB2      ARG   9   6.568  -6.888  -5.063
   52    HB3  ARG   9           HB1      ARG   9   5.334  -6.057  -5.980
   53    HG2  ARG   9           HG2      ARG   9   7.361  -4.730  -5.875
   54    HG3  ARG   9           HG1      ARG   9   6.064  -3.915  -5.013
   55    HD2  ARG   9           HD2      ARG   9   7.005  -4.511  -2.900
   56    HD3  ARG   9           HD1      ARG   9   8.150  -5.612  -3.663
   57    HE   ARG   9           HE       ARG   9   8.704  -3.225  -4.784
   58   HH11  ARG   9          HH11      ARG   9   8.383  -4.095  -1.332
   59   HH12  ARG   9          HH12      ARG   9   9.775  -3.253  -0.878
   60   HH21  ARG   9          HH21      ARG   9  10.614  -2.094  -4.097
   61   HH22  ARG   9          HH22      ARG   9  11.100  -2.123  -2.468
   62    H    PHE  10           H        PHE  10   4.346  -8.590  -2.864
   63    HA   PHE  10           HA       PHE  10   2.347  -9.192  -4.902
   64    HB2  PHE  10           HB2      PHE  10   4.027 -11.058  -3.226
   65    HB3  PHE  10           HB1      PHE  10   2.860 -11.555  -4.444
   66    HD1  PHE  10           HD1      PHE  10   3.306 -11.109  -6.833
   67    HD2  PHE  10           HD2      PHE  10   6.206 -10.317  -3.820
   68    HE1  PHE  10           HE1      PHE  10   5.049 -10.974  -8.546
   69    HE2  PHE  10           HE2      PHE  10   7.955 -10.183  -5.538
   70    HZ   PHE  10           HZ       PHE  10   7.373 -10.512  -7.908
   71    H    CYS  11           H        CYS  11   2.311  -7.799  -2.192
   72    HA   CYS  11           HA       CYS  11   0.685  -7.371  -0.642
   73    HB2  CYS  11           HB2      CYS  11  -0.929  -9.663  -1.774
   74    HB3  CYS  11           HB1      CYS  11  -1.507  -8.250  -0.898
   75    H    GLN  12           H        GLN  12   2.760  -9.657  -0.391
   76    HA   GLN  12           HA       GLN  12   1.431 -11.440   1.418
   77    HB2  GLN  12           HB2      GLN  12   4.263 -11.303   0.459
   78    HB3  GLN  12           HB1      GLN  12   3.741 -12.446   1.685
   79    HG2  GLN  12           HG2      GLN  12   2.616 -12.245  -1.104
   80    HG3  GLN  12           HG1      GLN  12   3.807 -13.426  -0.562
   81   HE21  GLN  12          1HE2      GLN  12   2.544 -13.842   2.037
   82   HE22  GLN  12          2HE2      GLN  12   1.107 -14.736   1.733
   83    H    ASN  13           H        ASN  13   2.937  -8.425   1.927
   84    HA   ASN  13           HA       ASN  13   3.172  -9.177   4.763
   85    HB2  ASN  13           HB2      ASN  13   5.251  -7.624   3.232
   86    HB3  ASN  13           HB1      ASN  13   5.126  -7.550   4.980
   87   HD21  ASN  13          HD21      ASN  13   7.293  -8.478   3.334
   88   HD22  ASN  13          HD22      ASN  13   7.605 -10.097   3.807
   89    H    TYR  14           H        TYR  14   1.330  -8.242   5.372
   90    HA   TYR  14           HA       TYR  14   0.633  -5.582   4.681
   91    HB2  TYR  14           HB2      TYR  14  -1.082  -7.230   5.224
   92    HB3  TYR  14           HB1      TYR  14  -0.401  -7.450   6.827
   93    HD1  TYR  14           HD1      TYR  14  -1.512  -6.436   8.552
   94    HD2  TYR  14           HD2      TYR  14  -1.705  -4.636   4.705
   95    HE1  TYR  14           HE1      TYR  14  -2.983  -4.719   9.443
   96    HE2  TYR  14           HE2      TYR  14  -3.191  -2.896   5.598
   97    HH   TYR  14           HH       TYR  14  -4.797  -2.626   7.531
   98    H    ILE  15           H        ILE  15   1.485  -3.776   5.603
   99    HA   ILE  15           HA       ILE  15   2.858  -4.115   8.187
  100    HB   ILE  15           HB       ILE  15   4.308  -2.217   7.602
  101   HG12  ILE  15          HG12      ILE  15   2.964  -2.329   4.886
  102   HG13  ILE  15          HG11      ILE  15   2.743  -1.055   6.077
  103   HG21  ILE  15          HG21      ILE  15   5.651  -3.356   5.896
  104   HG22  ILE  15          HG22      ILE  15   4.284  -4.408   5.532
  105   HG23  ILE  15          HG23      ILE  15   5.053  -4.481   7.116
  106   HD11  ILE  15          HD11      ILE  15   4.268  -0.370   4.314
  107   HD12  ILE  15          HD12      ILE  15   5.323  -1.736   4.679
  108   HD13  ILE  15          HD13      ILE  15   5.101  -0.452   5.865
  109    H    GLY  16           H        GLY  16   0.069  -3.035   7.130
  110    HA2  GLY  16           HA2      GLY  16  -1.311  -1.961   8.852
  111    HA3  GLY  16           HA1      GLY  16   0.015  -0.820   9.077
  112    H    SER  17           H        SER  17  -1.634   0.831   8.617
  113    HA   SER  17           HA       SER  17  -1.679   1.313   5.769
  114    HB2  SER  17           HB2      SER  17  -4.089   2.099   6.024
  115    HB3  SER  17           HB1      SER  17  -3.834   0.358   6.051
  116    HG   SER  17           HG       SER  17  -3.721   0.676   8.425
  117    H    ILE  18           H        ILE  18  -1.204   3.369   5.306
  118    HA   ILE  18           HA       ILE  18  -1.420   5.415   7.337
  119    HB   ILE  18           HB       ILE  18   0.983   6.130   6.887
  120   HG12  ILE  18          HG12      ILE  18   1.228   3.296   5.843
  121   HG13  ILE  18          HG11      ILE  18   1.379   4.768   4.896
  122   HG21  ILE  18          HG21      ILE  18   1.986   4.609   8.534
  123   HG22  ILE  18          HG22      ILE  18   0.575   3.558   8.384
  124   HG23  ILE  18          HG23      ILE  18   0.392   5.192   9.017
  125   HD11  ILE  18          HD11      ILE  18   3.224   3.906   7.114
  126   HD12  ILE  18          HD12      ILE  18   3.391   5.364   6.131
  127   HD13  ILE  18          HD13      ILE  18   3.548   3.774   5.386
  128    HA   PRO  19           HA       PRO  19  -2.036   7.817   3.593
  129    HB2  PRO  19           HB2      PRO  19  -1.151  10.264   4.849
  130    HB3  PRO  19           HB1      PRO  19  -2.805   9.758   4.514
  131    HG2  PRO  19           HG2      PRO  19  -1.760   9.990   7.039
  132    HG3  PRO  19           HG1      PRO  19  -3.105   8.918   6.623
  133    HD2  PRO  19           HD2      PRO  19  -0.218   8.280   7.024
  134    HD3  PRO  19           HD1      PRO  19  -1.667   7.366   7.501
  135    H    ASP  20           H        ASP  20   0.865   7.463   5.107
  136    HA   ASP  20           HA       ASP  20   2.427   8.924   3.082
  137    HB2  ASP  20           HB2      ASP  20   3.358   7.664   5.681
  138    HB3  ASP  20           HB1      ASP  20   4.303   8.712   4.631
  139    H    CYS  21           H        CYS  21   0.991   6.434   2.724
  140    HA   CYS  21           HA       CYS  21   2.442   4.106   3.142
  141    HB2  CYS  21           HB2      CYS  21  -0.012   4.382   2.558
  142    HB3  CYS  21           HB1      CYS  21   0.512   4.511   0.881
  143    H    CYS  22           H        CYS  22   2.426   6.235   0.315
  144    HA   CYS  22           HA       CYS  22   4.334   4.451  -0.954
  145    HB2  CYS  22           HB2      CYS  22   2.746   6.746  -2.063
  146    HB3  CYS  22           HB1      CYS  22   3.968   5.858  -2.970
  147    H    PHE  23           H        PHE  23   4.918   6.421   1.281
  148    HA   PHE  23           HA       PHE  23   6.985   7.977  -0.032
  149    HB2  PHE  23           HB2      PHE  23   6.034   7.808   2.827
  150    HB3  PHE  23           HB1      PHE  23   7.523   8.638   2.396
  151    HD1  PHE  23           HD1      PHE  23   3.885   8.593   1.556
  152    HD2  PHE  23           HD2      PHE  23   7.445  10.882   1.888
  153    HE1  PHE  23           HE1      PHE  23   2.596  10.650   1.131
  154    HE2  PHE  23           HE2      PHE  23   6.173  12.937   1.458
  155    HZ   PHE  23           HZ       PHE  23   3.744  12.824   1.080
  156    H    GLY  24           H        GLY  24   6.615   4.927   0.642
  157    HA2  GLY  24           HA2      GLY  24   9.462   4.445   0.920
  158    HA3  GLY  24           HA1      GLY  24   8.339   3.579   1.975
  159    H    ARG  25           H        ARG  25   9.864   2.140   0.204
  160    HA   ARG  25           HA       ARG  25   8.347   1.693  -2.200
  161    HB2  ARG  25           HB2      ARG  25  10.540  -0.012  -1.004
  162    HB3  ARG  25           HB1      ARG  25   9.916  -0.130  -2.637
  163    HG2  ARG  25           HG2      ARG  25  11.514   2.151  -1.473
  164    HG3  ARG  25           HG1      ARG  25  12.049   0.973  -2.665
  165    HD2  ARG  25           HD2      ARG  25   9.897   3.051  -3.041
  166    HD3  ARG  25           HD1      ARG  25  11.531   3.115  -3.689
  167    HE   ARG  25           HE       ARG  25  10.388   0.757  -4.597
  168   HH11  ARG  25          HH11      ARG  25   9.807   4.215  -4.979
  169   HH12  ARG  25          HH12      ARG  25   9.129   4.069  -6.534
  170   HH21  ARG  25          HH21      ARG  25   9.510   0.550  -6.693
  171   HH22  ARG  25          HH22      ARG  25   8.957   1.911  -7.561
  172    H    GLY  26           H        GLY  26   6.857   0.097  -2.580
  173    HA2  GLY  26           HA2      GLY  26   6.388  -2.232  -1.394
  174    HA3  GLY  26           HA1      GLY  26   5.690  -1.097  -0.243
  175    H    SER  27           H        SER  27   3.664  -2.060  -0.704
  176    HA   SER  27           HA       SER  27   2.446  -1.090  -3.188
  177    HB2  SER  27           HB2      SER  27   1.731  -3.663  -1.777
  178    HB3  SER  27           HB1      SER  27   1.231  -3.119  -3.379
  179    HG   SER  27           HG       SER  27   3.559  -4.273  -2.511
  180    H    TYR  28           H        TYR  28   0.061  -0.922  -2.901
  181    HA   TYR  28           HA       TYR  28  -0.928  -0.854  -0.193
  182    HB2  TYR  28           HB2      TYR  28  -1.877   1.381  -0.399
  183    HB3  TYR  28           HB1      TYR  28  -0.137   1.473  -0.598
  184    HD1  TYR  28           HD1      TYR  28   0.750   1.627  -3.003
  185    HD2  TYR  28           HD2      TYR  28  -3.319   2.335  -2.002
  186    HE1  TYR  28           HE1      TYR  28   0.464   2.843  -5.086
  187    HE2  TYR  28           HE2      TYR  28  -3.622   3.566  -4.103
  188    HH   TYR  28           HH       TYR  28  -1.429   3.386  -6.623
  189    H    SER  29           H        SER  29  -3.159  -1.125  -0.132
  190    HA   SER  29           HA       SER  29  -4.562  -1.304  -2.671
  191    HB2  SER  29           HB2      SER  29  -5.526  -3.495  -2.003
  192    HB3  SER  29           HB1      SER  29  -3.778  -3.584  -2.226
  193    HG   SER  29           HG       SER  29  -5.217  -4.169  -0.059
  194    H    PHE  30           H        PHE  30  -6.960  -1.634  -2.166
  195    HA   PHE  30           HA       PHE  30  -7.585  -0.105   0.251
  196    HB2  PHE  30           HB2      PHE  30  -9.094  -0.259  -2.370
  197    HB3  PHE  30           HB1      PHE  30  -9.636   0.635  -0.953
  198    HD1  PHE  30           HD1      PHE  30  -7.998   2.457  -0.070
  199    HD2  PHE  30           HD2      PHE  30  -7.827   0.797  -3.989
  200    HE1  PHE  30           HE1      PHE  30  -6.734   4.413  -0.842
  201    HE2  PHE  30           HE2      PHE  30  -6.558   2.754  -4.766
  202    HZ   PHE  30           HZ       PHE  30  -6.010   4.566  -3.192
  203    H    GLU  31           H        GLU  31  -7.247  -3.000  -0.487
  204    HA   GLU  31           HA       GLU  31  -9.617  -3.990   0.891
  205    HB2  GLU  31           HB2      GLU  31  -9.940  -4.424  -1.506
  206    HB3  GLU  31           HB1      GLU  31  -8.353  -5.166  -1.591
  207    HG2  GLU  31           HG2      GLU  31  -9.111  -6.988  -0.172
  208    HG3  GLU  31           HG1      GLU  31 -10.700  -6.238  -0.035
  209    H    LEU  32           H        LEU  32  -9.136  -5.633   2.312
  210    HA   LEU  32           HA       LEU  32  -6.347  -6.004   2.941
  211    HB2  LEU  32           HB2      LEU  32  -8.861  -6.985   4.265
  212    HB3  LEU  32           HB1      LEU  32  -7.250  -7.333   4.859
  213    HG   LEU  32           HG       LEU  32  -8.386  -4.545   4.591
  214   HD11  LEU  32          HD11      LEU  32  -8.076  -6.310   6.993
  215   HD12  LEU  32          HD12      LEU  32  -9.609  -5.862   6.237
  216   HD13  LEU  32          HD13      LEU  32  -8.605  -4.627   7.012
  217   HD21  LEU  32          HD21      LEU  32  -6.503  -3.932   6.001
  218   HD22  LEU  32          HD22      LEU  32  -5.941  -4.661   4.501
  219   HD23  LEU  32          HD23      LEU  32  -5.937  -5.598   5.998
  220    H    GLN  33           H        GLN  33  -5.183  -7.703   2.601
  221    HA   GLN  33           HA       GLN  33  -4.379  -9.505   1.562
  222    HB2  GLN  33           HB2      GLN  33  -6.935 -10.799   2.535
  223    HB3  GLN  33           HB1      GLN  33  -5.512 -11.662   1.976
  224    HG2  GLN  33           HG2      GLN  33  -5.693  -9.897   4.413
  225    HG3  GLN  33           HG1      GLN  33  -5.624 -11.656   4.394
  226   HE21  GLN  33          1HE2      GLN  33  -3.669 -12.665   3.943
  227   HE22  GLN  33          2HE2      GLN  33  -2.171 -11.829   3.980
  228    HA   PRO  34           HA       PRO  34  -6.869  -9.337  -2.274
  229    HB2  PRO  34           HB2      PRO  34  -5.303  -7.433  -3.561
  230    HB3  PRO  34           HB1      PRO  34  -6.797  -7.095  -2.685
  231    HG2  PRO  34           HG2      PRO  34  -4.169  -6.259  -1.988
  232    HG3  PRO  34           HG1      PRO  34  -5.649  -6.051  -1.043
  233    HD2  PRO  34           HD2      PRO  34  -3.525  -8.118  -0.807
  234    HD3  PRO  34           HD1      PRO  34  -4.576  -7.425   0.449
  235    HA   PRO  35           HA       PRO  35  -4.028 -11.913  -4.653
  236    HB2  PRO  35           HB2      PRO  35  -4.915 -10.412  -7.060
  237    HB3  PRO  35           HB1      PRO  35  -4.963 -12.148  -6.755
  238    HG2  PRO  35           HG2      PRO  35  -7.169 -10.624  -6.722
  239    HG3  PRO  35           HG1      PRO  35  -6.986 -12.031  -5.655
  240    HD2  PRO  35           HD2      PRO  35  -6.821  -9.128  -5.032
  241    HD3  PRO  35           HD1      PRO  35  -7.357 -10.479  -4.017
  242    HA   PRO  36           HA       PRO  36  -0.321  -9.518  -4.912
  243    HB2  PRO  36           HB2      PRO  36   0.832 -10.694  -7.188
  244    HB3  PRO  36           HB1      PRO  36   1.028 -11.231  -5.518
  245    HG2  PRO  36           HG2      PRO  36  -0.813 -12.243  -7.630
  246    HG3  PRO  36           HG1      PRO  36   0.032 -13.135  -6.355
  247    HD2  PRO  36           HD2      PRO  36  -2.578 -12.612  -6.182
  248    HD3  PRO  36           HD1      PRO  36  -1.542 -12.556  -4.742
  249    H    TRP  37           H        TRP  37  -1.992  -9.951  -7.971
  250    HA   TRP  37           HA       TRP  37  -0.730  -7.692  -9.208
  251    HB2  TRP  37           HB2      TRP  37  -2.390  -8.132 -11.059
  252    HB3  TRP  37           HB1      TRP  37  -1.303  -9.459 -10.674
  253    HD1  TRP  37           HD       TRP  37  -5.033  -8.429 -10.181
  254    HE1  TRP  37           HE1      TRP  37  -6.395 -10.559  -9.873
  255    HE3  TRP  37          3HE       TRP  37  -1.210 -11.843 -10.012
  256    HZ2  TRP  37           HZ2      TRP  37  -5.945 -13.331  -9.577
  257    HZ3  TRP  37           HZ3      TRP  37  -1.775 -14.214  -9.705
  258    HH2  TRP  37           HH       TRP  37  -4.098 -14.937  -9.492
  259    H    GLU  38           H        GLU  38  -3.312  -7.982  -7.060
  260    HA   GLU  38           HA       GLU  38  -4.806  -5.792  -8.172
  261    HB2  GLU  38           HB2      GLU  38  -5.239  -7.573  -5.814
  262    HB3  GLU  38           HB1      GLU  38  -6.244  -6.156  -6.112
  263    HG2  GLU  38           HG2      GLU  38  -5.813  -8.391  -8.062
  264    HG3  GLU  38           HG1      GLU  38  -7.215  -8.269  -7.012
  265    H    CYS  39           H        CYS  39  -2.426  -6.269  -5.723
  266    HA   CYS  39           HA       CYS  39  -2.939  -3.802  -4.408
  267    HB2  CYS  39           HB2      CYS  39  -0.394  -5.433  -4.513
  268    HB3  CYS  39           HB1      CYS  39  -0.658  -4.038  -3.475
  269    H    TYR  40           H        TYR  40  -2.244  -1.849  -4.829
  270    HA   TYR  40           HA       TYR  40  -1.122  -1.287  -7.432
  271    HB2  TYR  40           HB2      TYR  40  -1.853   0.606  -5.175
  272    HB3  TYR  40           HB1      TYR  40  -1.673   1.002  -6.874
  273    HD1  TYR  40           HD1      TYR  40  -3.838  -0.580  -4.382
  274    HD2  TYR  40           HD2      TYR  40  -3.486   0.656  -8.414
  275    HE1  TYR  40           HE1      TYR  40  -6.257  -0.904  -4.675
  276    HE2  TYR  40           HE2      TYR  40  -5.887   0.346  -8.729
  277    HH   TYR  40           HH       TYR  40  -7.670  -1.004  -7.722
  278    H    GLN  41           H        GLN  41   1.036  -0.490  -7.619
  279    HA   GLN  41           HA       GLN  41   2.563  -0.937  -5.182
  280    HB2  GLN  41           HB2      GLN  41   3.554  -0.699  -8.024
  281    HB3  GLN  41           HB1      GLN  41   4.533  -1.099  -6.621
  282    HG2  GLN  41           HG2      GLN  41   3.197  -3.147  -6.298
  283    HG3  GLN  41           HG1      GLN  41   2.284  -2.755  -7.753
  284   HE21  GLN  41          1HE2      GLN  41   3.892  -5.092  -7.214
  285   HE22  GLN  41          2HE2      GLN  41   5.119  -5.126  -8.428
  286    H    CYS  42           H        CYS  42   4.115   0.520  -4.468
  287    HA   CYS  42           HA       CYS  42   3.606   3.279  -5.238
  288    HB2  CYS  42           HB2      CYS  42   5.133   2.105  -2.890
  289    HB3  CYS  42           HB1      CYS  42   4.878   3.820  -3.173
  Start of MODEL    6
    1    H    PCA   1           H        PGL   1 -10.709   4.770   1.500
    2    HA   PCA   1           HA       PGL   1  -9.181   6.771   1.481
    3    HB2  PCA   1           HB1      PGL   1  -9.856   8.307   3.036
    4    HB3  PCA   1           HB2      PGL   1  -9.155   7.265   4.303
    5    HG2  PCA   1           HG1      PGL   1 -11.974   7.656   3.602
    6    HG3  PCA   1           HG2      PGL   1 -11.262   6.777   5.000
    7    H    GLU   2           H        GLU   2  -9.512   4.069   3.530
    8    HA   GLU   2           HA       GLU   2  -6.913   4.020   4.670
    9    HB2  GLU   2           HB2      GLU   2  -9.027   1.886   4.362
   10    HB3  GLU   2           HB1      GLU   2  -7.529   1.669   5.250
   11    HG2  GLU   2           HG2      GLU   2  -9.582   3.765   5.897
   12    HG3  GLU   2           HG1      GLU   2  -9.506   2.177   6.660
   13    H    ALA   3           H        ALA   3  -5.186   3.800   3.420
   14    HA   ALA   3           HA       ALA   3  -5.253   1.817   1.282
   15    HB1  ALA   3           HB1      ALA   3  -3.126   2.833   0.553
   16    HB2  ALA   3           HB2      ALA   3  -3.194   3.948   1.915
   17    HB3  ALA   3           HB3      ALA   3  -4.408   4.042   0.639
   18    H    PHE   4           H        PHE   4  -4.491  -0.068   1.769
   19    HA   PHE   4           HA       PHE   4  -3.079  -0.459   4.267
   20    HB2  PHE   4           HB2      PHE   4  -4.197  -2.455   2.295
   21    HB3  PHE   4           HB1      PHE   4  -3.605  -2.832   3.906
   22    HD1  PHE   4           HD1      PHE   4  -4.815  -1.514   5.863
   23    HD2  PHE   4           HD2      PHE   4  -6.432  -2.105   1.977
   24    HE1  PHE   4           HE1      PHE   4  -7.072  -1.106   6.746
   25    HE2  PHE   4           HE2      PHE   4  -8.693  -1.699   2.851
   26    HZ   PHE   4           HZ       PHE   4  -9.019  -1.201   5.226
   27    H    CYS   5           H        CYS   5  -0.994  -0.799   4.322
   28    HA   CYS   5           HA       CYS   5   0.427  -0.819   1.789
   29    HB2  CYS   5           HB2      CYS   5   1.394  -0.195   4.568
   30    HB3  CYS   5           HB1      CYS   5   2.263   0.099   3.069
   31    H    TYR   6           H        TYR   6   1.595  -2.488   1.224
   32    HA   TYR   6           HA       TYR   6   2.349  -4.547   3.196
   33    HB2  TYR   6           HB2      TYR   6   1.690  -5.124   0.268
   34    HB3  TYR   6           HB1      TYR   6   1.994  -6.255   1.557
   35    HD1  TYR   6           HD1      TYR   6  -0.496  -3.889   0.220
   36    HD2  TYR   6           HD2      TYR   6   0.255  -6.994   3.022
   37    HE1  TYR   6           HE1      TYR   6  -2.879  -4.066   0.642
   38    HE2  TYR   6           HE2      TYR   6  -2.142  -7.177   3.468
   39    HH   TYR   6           HH       TYR   6  -4.490  -5.509   1.503
   40    H    SER   7           H        SER   7   4.425  -4.993   3.209
   41    HA   SER   7           HA       SER   7   6.193  -3.347   1.713
   42    HB2  SER   7           HB2      SER   7   7.855  -4.801   2.994
   43    HB3  SER   7           HB1      SER   7   6.666  -3.876   3.940
   44    HG   SER   7           HG       SER   7   6.954  -6.174   4.496
   45    H    ASP   8           H        ASP   8   5.018  -6.535   1.657
   46    HA   ASP   8           HA       ASP   8   6.747  -7.581  -0.370
   47    HB2  ASP   8           HB2      ASP   8   5.770  -9.047   1.272
   48    HB3  ASP   8           HB1      ASP   8   4.150  -8.549   0.804
   49    H    ARG   9           H        ARG   9   6.341  -7.759  -2.537
   50    HA   ARG   9           HA       ARG   9   4.526  -5.810  -3.600
   51    HB2  ARG   9           HB2      ARG   9   6.466  -7.645  -4.970
   52    HB3  ARG   9           HB1      ARG   9   5.546  -6.366  -5.758
   53    HG2  ARG   9           HG2      ARG   9   6.589  -4.731  -4.240
   54    HG3  ARG   9           HG1      ARG   9   7.582  -6.028  -3.578
   55    HD2  ARG   9           HD2      ARG   9   8.488  -6.437  -5.809
   56    HD3  ARG   9           HD1      ARG   9   7.504  -5.089  -6.411
   57    HE   ARG   9           HE       ARG   9   8.967  -4.136  -4.284
   58   HH11  ARG   9          HH11      ARG   9   9.661  -5.263  -7.569
   59   HH12  ARG   9          HH12      ARG   9  11.142  -4.438  -7.693
   60   HH21  ARG   9          HH21      ARG   9  11.000  -2.990  -4.449
   61   HH22  ARG   9          HH22      ARG   9  11.911  -3.107  -5.870
   62    H    PHE  10           H        PHE  10   4.116  -8.987  -2.743
   63    HA   PHE  10           HA       PHE  10   2.168  -9.418  -4.864
   64    HB2  PHE  10           HB2      PHE  10   3.445 -11.483  -3.047
   65    HB3  PHE  10           HB1      PHE  10   2.436 -11.799  -4.458
   66    HD1  PHE  10           HD1      PHE  10   3.322 -10.980  -6.742
   67    HD2  PHE  10           HD2      PHE  10   5.752 -11.317  -3.280
   68    HE1  PHE  10           HE1      PHE  10   5.323 -10.955  -8.144
   69    HE2  PHE  10           HE2      PHE  10   7.757 -11.315  -4.695
   70    HZ   PHE  10           HZ       PHE  10   7.539 -11.128  -7.128
   71    H    CYS  11           H        CYS  11   2.251  -7.992  -2.157
   72    HA   CYS  11           HA       CYS  11   0.645  -7.261  -0.693
   73    HB2  CYS  11           HB2      CYS  11  -1.244  -9.322  -1.836
   74    HB3  CYS  11           HB1      CYS  11  -1.627  -7.831  -0.986
   75    H    GLN  12           H        GLN  12   2.328  -9.892  -0.327
   76    HA   GLN  12           HA       GLN  12   0.531 -11.306   1.453
   77    HB2  GLN  12           HB2      GLN  12   3.313 -12.013   0.570
   78    HB3  GLN  12           HB1      GLN  12   2.296 -13.009   1.604
   79    HG2  GLN  12           HG2      GLN  12   0.639 -13.175  -0.193
   80    HG3  GLN  12           HG1      GLN  12   1.670 -12.192  -1.227
   81   HE21  GLN  12          1HE2      GLN  12   2.856 -14.681   0.964
   82   HE22  GLN  12          2HE2      GLN  12   3.386 -15.741  -0.287
   83    H    ASN  13           H        ASN  13   2.528  -8.731   1.959
   84    HA   ASN  13           HA       ASN  13   2.781  -9.568   4.749
   85    HB2  ASN  13           HB2      ASN  13   5.061  -8.310   3.196
   86    HB3  ASN  13           HB1      ASN  13   5.034  -8.466   4.944
   87   HD21  ASN  13          HD21      ASN  13   5.243 -10.541   5.861
   88   HD22  ASN  13          HD22      ASN  13   5.845 -11.871   4.969
   89    H    TYR  14           H        TYR  14   1.271  -8.374   5.533
   90    HA   TYR  14           HA       TYR  14   0.735  -5.675   4.785
   91    HB2  TYR  14           HB2      TYR  14  -1.050  -7.182   5.472
   92    HB3  TYR  14           HB1      TYR  14  -0.286  -7.419   7.032
   93    HD1  TYR  14           HD1      TYR  14  -0.728  -5.947   8.832
   94    HD2  TYR  14           HD2      TYR  14  -2.007  -4.912   4.910
   95    HE1  TYR  14           HE1      TYR  14  -2.044  -4.110   9.756
   96    HE2  TYR  14           HE2      TYR  14  -3.324  -3.066   5.832
   97    HH   TYR  14           HH       TYR  14  -4.408  -2.544   8.046
   98    H    ILE  15           H        ILE  15   1.680  -3.885   5.635
   99    HA   ILE  15           HA       ILE  15   3.118  -4.232   8.171
  100    HB   ILE  15           HB       ILE  15   4.560  -2.323   7.536
  101   HG12  ILE  15          HG12      ILE  15   3.245  -2.601   4.815
  102   HG13  ILE  15          HG11      ILE  15   3.023  -1.252   5.918
  103   HG21  ILE  15          HG21      ILE  15   5.931  -3.568   5.934
  104   HG22  ILE  15          HG22      ILE  15   4.576  -4.657   5.635
  105   HG23  ILE  15          HG23      ILE  15   5.323  -4.595   7.232
  106   HD11  ILE  15          HD11      ILE  15   4.561  -0.694   4.123
  107   HD12  ILE  15          HD12      ILE  15   5.607  -2.037   4.583
  108   HD13  ILE  15          HD13      ILE  15   5.384  -0.675   5.682
  109    H    GLY  16           H        GLY  16   0.402  -2.831   6.937
  110    HA2  GLY  16           HA2      GLY  16  -0.847  -1.807   8.890
  111    HA3  GLY  16           HA1      GLY  16   0.492  -0.662   8.915
  112    H    SER  17           H        SER  17  -1.502   0.756   8.618
  113    HA   SER  17           HA       SER  17  -1.786   1.245   5.752
  114    HB2  SER  17           HB2      SER  17  -4.142   2.027   6.366
  115    HB3  SER  17           HB1      SER  17  -3.875   0.285   6.423
  116    HG   SER  17           HG       SER  17  -3.465   1.833   8.726
  117    H    ILE  18           H        ILE  18  -1.295   3.329   5.253
  118    HA   ILE  18           HA       ILE  18  -1.342   5.378   7.301
  119    HB   ILE  18           HB       ILE  18   1.019   6.096   6.686
  120   HG12  ILE  18          HG12      ILE  18   1.196   3.257   5.647
  121   HG13  ILE  18          HG11      ILE  18   1.323   4.728   4.692
  122   HG21  ILE  18          HG21      ILE  18   0.576   5.204   8.854
  123   HG22  ILE  18          HG22      ILE  18   2.124   4.584   8.274
  124   HG23  ILE  18          HG23      ILE  18   0.693   3.555   8.244
  125   HD11  ILE  18          HD11      ILE  18   3.253   3.825   6.820
  126   HD12  ILE  18          HD12      ILE  18   3.396   5.300   5.862
  127   HD13  ILE  18          HD13      ILE  18   3.505   3.722   5.078
  128    HA   PRO  19           HA       PRO  19  -2.277   7.773   3.678
  129    HB2  PRO  19           HB2      PRO  19  -2.000  10.268   4.633
  130    HB3  PRO  19           HB1      PRO  19  -3.309   9.203   5.157
  131    HG2  PRO  19           HG2      PRO  19  -0.772   9.907   6.554
  132    HG3  PRO  19           HG1      PRO  19  -2.392   9.676   7.225
  133    HD2  PRO  19           HD2      PRO  19  -0.370   7.784   7.289
  134    HD3  PRO  19           HD1      PRO  19  -2.101   7.427   7.439
  135    H    ASP  20           H        ASP  20   0.789   7.614   4.995
  136    HA   ASP  20           HA       ASP  20   1.937   9.163   2.779
  137    HB2  ASP  20           HB2      ASP  20   3.984   9.358   4.100
  138    HB3  ASP  20           HB1      ASP  20   2.624   9.944   5.042
  139    H    CYS  21           H        CYS  21   0.839   6.542   2.649
  140    HA   CYS  21           HA       CYS  21   2.575   4.398   2.961
  141    HB2  CYS  21           HB2      CYS  21   0.069   4.393   2.487
  142    HB3  CYS  21           HB1      CYS  21   0.495   4.598   0.794
  143    H    CYS  22           H        CYS  22   2.293   6.647   0.244
  144    HA   CYS  22           HA       CYS  22   4.149   5.054  -1.290
  145    HB2  CYS  22           HB2      CYS  22   2.526   7.471  -2.025
  146    HB3  CYS  22           HB1      CYS  22   3.721   6.750  -3.102
  147    H    PHE  23           H        PHE  23   4.707   7.011   1.101
  148    HA   PHE  23           HA       PHE  23   6.933   8.370  -0.179
  149    HB2  PHE  23           HB2      PHE  23   5.787   8.567   2.605
  150    HB3  PHE  23           HB1      PHE  23   7.309   9.334   2.154
  151    HD1  PHE  23           HD1      PHE  23   7.363  11.199   0.625
  152    HD2  PHE  23           HD2      PHE  23   3.687   9.396   1.737
  153    HE1  PHE  23           HE1      PHE  23   6.150  13.125  -0.283
  154    HE2  PHE  23           HE2      PHE  23   2.466  11.327   0.835
  155    HZ   PHE  23           HZ       PHE  23   3.697  13.195  -0.180
  156    H    GLY  24           H        GLY  24   6.479   5.461   0.433
  157    HA2  GLY  24           HA2      GLY  24   9.239   4.877   0.905
  158    HA3  GLY  24           HA1      GLY  24   8.077   4.136   2.022
  159    H    ARG  25           H        ARG  25   9.596   2.614   0.155
  160    HA   ARG  25           HA       ARG  25   7.869   2.120  -2.079
  161    HB2  ARG  25           HB2      ARG  25  10.309   0.652  -1.096
  162    HB3  ARG  25           HB1      ARG  25   9.387   0.160  -2.505
  163    HG2  ARG  25           HG2      ARG  25   9.882   2.347  -3.545
  164    HG3  ARG  25           HG1      ARG  25  10.885   2.748  -2.145
  165    HD2  ARG  25           HD2      ARG  25  12.311   0.838  -2.588
  166    HD3  ARG  25           HD1      ARG  25  11.279   0.357  -3.932
  167    HE   ARG  25           HE       ARG  25  12.349   3.000  -4.185
  168   HH11  ARG  25          HH11      ARG  25  13.024  -0.425  -4.752
  169   HH12  ARG  25          HH12      ARG  25  14.112  -0.150  -6.037
  170   HH21  ARG  25          HH21      ARG  25  13.845   3.377  -5.911
  171   HH22  ARG  25          HH22      ARG  25  14.583   2.055  -6.731
  172    H    GLY  26           H        GLY  26   6.489   0.448  -2.399
  173    HA2  GLY  26           HA2      GLY  26   6.222  -1.876  -1.114
  174    HA3  GLY  26           HA1      GLY  26   5.423  -0.732  -0.040
  175    H    SER  27           H        SER  27   3.790  -2.433  -0.817
  176    HA   SER  27           HA       SER  27   2.431  -1.555  -3.261
  177    HB2  SER  27           HB2      SER  27   1.915  -4.017  -1.589
  178    HB3  SER  27           HB1      SER  27   1.443  -3.715  -3.260
  179    HG   SER  27           HG       SER  27   3.658  -4.816  -2.312
  180    H    TYR  28           H        TYR  28   0.205  -0.942  -3.024
  181    HA   TYR  28           HA       TYR  28  -0.897  -1.082  -0.340
  182    HB2  TYR  28           HB2      TYR  28  -1.768   1.176  -0.392
  183    HB3  TYR  28           HB1      TYR  28  -0.034   1.251  -0.645
  184    HD1  TYR  28           HD1      TYR  28   0.854   1.914  -2.831
  185    HD2  TYR  28           HD2      TYR  28  -3.333   1.858  -2.122
  186    HE1  TYR  28           HE1      TYR  28   0.512   3.263  -4.825
  187    HE2  TYR  28           HE2      TYR  28  -3.697   3.211  -4.128
  188    HH   TYR  28           HH       TYR  28  -1.192   3.755  -6.419
  189    H    SER  29           H        SER  29  -3.077  -1.284  -0.272
  190    HA   SER  29           HA       SER  29  -4.567  -1.195  -2.747
  191    HB2  SER  29           HB2      SER  29  -5.626  -3.386  -2.165
  192    HB3  SER  29           HB1      SER  29  -3.919  -3.543  -2.595
  193    HG   SER  29           HG       SER  29  -5.169  -4.234  -0.331
  194    H    PHE  30           H        PHE  30  -6.935  -1.258  -2.198
  195    HA   PHE  30           HA       PHE  30  -7.330   0.092   0.357
  196    HB2  PHE  30           HB2      PHE  30  -9.116  -0.010  -2.086
  197    HB3  PHE  30           HB1      PHE  30  -9.411   0.948  -0.638
  198    HD1  PHE  30           HD1      PHE  30  -7.899   0.890  -3.854
  199    HD2  PHE  30           HD2      PHE  30  -7.629   2.692  -0.010
  200    HE1  PHE  30           HE1      PHE  30  -6.571   2.724  -4.813
  201    HE2  PHE  30           HE2      PHE  30  -6.308   4.530  -0.962
  202    HZ   PHE  30           HZ       PHE  30  -5.774   4.553  -3.361
  203    H    GLU  31           H        GLU  31  -7.235  -2.851  -0.564
  204    HA   GLU  31           HA       GLU  31  -9.460  -3.702   1.112
  205    HB2  GLU  31           HB2      GLU  31 -10.057  -3.995  -1.294
  206    HB3  GLU  31           HB1      GLU  31  -8.642  -5.016  -1.490
  207    HG2  GLU  31           HG2      GLU  31  -9.569  -6.640   0.040
  208    HG3  GLU  31           HG1      GLU  31 -10.963  -5.602   0.332
  209    H    LEU  32           H        LEU  32  -8.936  -5.380   2.431
  210    HA   LEU  32           HA       LEU  32  -6.162  -5.865   2.882
  211    HB2  LEU  32           HB2      LEU  32  -8.644  -6.855   4.236
  212    HB3  LEU  32           HB1      LEU  32  -7.042  -7.386   4.699
  213    HG   LEU  32           HG       LEU  32  -7.930  -4.503   4.742
  214   HD11  LEU  32          HD11      LEU  32  -7.703  -6.509   6.978
  215   HD12  LEU  32          HD12      LEU  32  -9.212  -5.866   6.326
  216   HD13  LEU  32          HD13      LEU  32  -8.081  -4.796   7.154
  217   HD21  LEU  32          HD21      LEU  32  -5.533  -5.929   5.891
  218   HD22  LEU  32          HD22      LEU  32  -5.927  -4.224   6.109
  219   HD23  LEU  32          HD23      LEU  32  -5.519  -4.829   4.512
  220    H    GLN  33           H        GLN  33  -5.000  -7.559   2.640
  221    HA   GLN  33           HA       GLN  33  -4.112  -9.316   1.595
  222    HB2  GLN  33           HB2      GLN  33  -6.498 -10.610   2.900
  223    HB3  GLN  33           HB1      GLN  33  -5.212 -11.520   2.140
  224    HG2  GLN  33           HG2      GLN  33  -4.921 -11.476   4.536
  225    HG3  GLN  33           HG1      GLN  33  -3.611 -10.611   3.749
  226   HE21  GLN  33          1HE2      GLN  33  -6.516 -10.283   5.636
  227   HE22  GLN  33          2HE2      GLN  33  -6.181  -8.703   6.243
  228    HA   PRO  34           HA       PRO  34  -6.647  -9.830  -2.164
  229    HB2  PRO  34           HB2      PRO  34  -5.796  -7.848  -3.717
  230    HB3  PRO  34           HB1      PRO  34  -6.954  -7.524  -2.427
  231    HG2  PRO  34           HG2      PRO  34  -4.054  -6.898  -2.555
  232    HG3  PRO  34           HG1      PRO  34  -5.358  -6.029  -1.730
  233    HD2  PRO  34           HD2      PRO  34  -3.536  -7.914  -0.590
  234    HD3  PRO  34           HD1      PRO  34  -4.917  -7.134   0.201
  235    HA   PRO  35           HA       PRO  35  -3.256 -11.887  -4.273
  236    HB2  PRO  35           HB2      PRO  35  -4.027 -11.756  -6.905
  237    HB3  PRO  35           HB1      PRO  35  -4.726 -12.887  -5.743
  238    HG2  PRO  35           HG2      PRO  35  -5.781 -10.271  -6.713
  239    HG3  PRO  35           HG1      PRO  35  -6.652 -11.784  -6.415
  240    HD2  PRO  35           HD2      PRO  35  -6.691  -9.714  -4.675
  241    HD3  PRO  35           HD1      PRO  35  -6.780 -11.403  -4.143
  242    HA   PRO  36           HA       PRO  36   0.063  -9.185  -5.329
  243    HB2  PRO  36           HB2      PRO  36   0.604 -10.284  -7.924
  244    HB3  PRO  36           HB1      PRO  36   1.459 -10.553  -6.405
  245    HG2  PRO  36           HG2      PRO  36  -0.652 -12.181  -7.690
  246    HG3  PRO  36           HG1      PRO  36   0.638 -12.682  -6.586
  247    HD2  PRO  36           HD2      PRO  36  -1.891 -12.579  -5.780
  248    HD3  PRO  36           HD1      PRO  36  -0.579 -12.054  -4.699
  249    H    TRP  37           H        TRP  37  -1.912  -9.717  -8.237
  250    HA   TRP  37           HA       TRP  37  -1.138  -7.295  -9.508
  251    HB2  TRP  37           HB2      TRP  37  -3.020  -7.820 -11.090
  252    HB3  TRP  37           HB1      TRP  37  -1.823  -9.093 -10.902
  253    HD1  TRP  37           HD       TRP  37  -5.488  -8.273  -9.959
  254    HE1  TRP  37           HE1      TRP  37  -6.686 -10.475  -9.421
  255    HE3  TRP  37          3HE       TRP  37  -1.486 -11.458 -10.137
  256    HZ2  TRP  37           HZ2      TRP  37  -6.036 -13.192  -9.109
  257    HZ3  TRP  37           HZ3      TRP  37  -1.870 -13.841  -9.704
  258    HH2  TRP  37           HH       TRP  37  -4.097 -14.689  -9.201
  259    H    GLU  38           H        GLU  38  -3.298  -7.816  -7.000
  260    HA   GLU  38           HA       GLU  38  -5.081  -5.670  -7.751
  261    HB2  GLU  38           HB2      GLU  38  -5.057  -7.690  -5.566
  262    HB3  GLU  38           HB1      GLU  38  -6.178  -6.327  -5.543
  263    HG2  GLU  38           HG2      GLU  38  -5.938  -8.288  -7.800
  264    HG3  GLU  38           HG1      GLU  38  -7.114  -8.447  -6.501
  265    H    CYS  39           H        CYS  39  -2.158  -5.890  -6.186
  266    HA   CYS  39           HA       CYS  39  -2.775  -3.540  -4.580
  267    HB2  CYS  39           HB2      CYS  39  -0.264  -5.214  -4.668
  268    HB3  CYS  39           HB1      CYS  39  -0.479  -3.744  -3.719
  269    H    TYR  40           H        TYR  40  -1.981  -1.615  -4.985
  270    HA   TYR  40           HA       TYR  40  -0.702  -1.197  -7.576
  271    HB2  TYR  40           HB2      TYR  40  -1.769   0.854  -5.605
  272    HB3  TYR  40           HB1      TYR  40  -1.391   1.107  -7.302
  273    HD1  TYR  40           HD1      TYR  40  -2.916   0.203  -9.043
  274    HD2  TYR  40           HD2      TYR  40  -3.885  -0.018  -4.912
  275    HE1  TYR  40           HE1      TYR  40  -5.246  -0.264  -9.623
  276    HE2  TYR  40           HE2      TYR  40  -6.220  -0.494  -5.475
  277    HH   TYR  40           HH       TYR  40  -7.177  -1.458  -8.488
  278    H    GLN  41           H        GLN  41   1.450  -0.537  -7.535
  279    HA   GLN  41           HA       GLN  41   2.562  -0.364  -4.855
  280    HB2  GLN  41           HB2      GLN  41   3.953  -0.899  -7.476
  281    HB3  GLN  41           HB1      GLN  41   4.745  -0.828  -5.906
  282    HG2  GLN  41           HG2      GLN  41   3.370  -2.709  -5.136
  283    HG3  GLN  41           HG1      GLN  41   2.616  -2.792  -6.724
  284   HE21  GLN  41          1HE2      GLN  41   3.297  -4.843  -7.082
  285   HE22  GLN  41          2HE2      GLN  41   4.920  -5.262  -7.440
  286    H    CYS  42           H        CYS  42   3.919   1.225  -4.240
  287    HA   CYS  42           HA       CYS  42   3.305   3.763  -5.434
  288    HB2  CYS  42           HB2      CYS  42   4.987   3.026  -3.033
  289    HB3  CYS  42           HB1      CYS  42   4.588   4.670  -3.517
  Start of MODEL    7
    1    H    PCA   1           H        PGL   1  -9.730   6.206   1.979
    2    HA   PCA   1           HA       PGL   1  -7.851   7.703   1.110
    3    HB2  PCA   1           HB1      PGL   1  -7.514   9.585   2.359
    4    HB3  PCA   1           HB2      PGL   1  -7.113   8.590   3.786
    5    HG2  PCA   1           HG1      PGL   1  -9.668   9.896   3.083
    6    HG3  PCA   1           HG2      PGL   1  -9.121   9.217   4.654
    7    H    GLU   2           H        GLU   2  -8.335   5.607   3.777
    8    HA   GLU   2           HA       GLU   2  -5.667   5.036   4.479
    9    HB2  GLU   2           HB2      GLU   2  -8.121   3.293   4.755
   10    HB3  GLU   2           HB1      GLU   2  -6.585   3.033   5.559
   11    HG2  GLU   2           HG2      GLU   2  -8.413   5.387   5.963
   12    HG3  GLU   2           HG1      GLU   2  -8.225   4.017   7.055
   13    H    ALA   3           H        ALA   3  -4.213   4.175   3.202
   14    HA   ALA   3           HA       ALA   3  -5.022   2.166   1.256
   15    HB1  ALA   3           HB1      ALA   3  -2.821   2.613   0.232
   16    HB2  ALA   3           HB2      ALA   3  -2.497   3.814   1.483
   17    HB3  ALA   3           HB3      ALA   3  -3.803   4.073   0.328
   18    H    PHE   4           H        PHE   4  -4.313   0.131   1.543
   19    HA   PHE   4           HA       PHE   4  -2.990  -0.458   4.058
   20    HB2  PHE   4           HB2      PHE   4  -4.122  -2.304   1.934
   21    HB3  PHE   4           HB1      PHE   4  -3.555  -2.806   3.522
   22    HD1  PHE   4           HD1      PHE   4  -4.852  -2.180   5.543
   23    HD2  PHE   4           HD2      PHE   4  -6.256  -1.307   1.634
   24    HE1  PHE   4           HE1      PHE   4  -7.109  -1.783   6.440
   25    HE2  PHE   4           HE2      PHE   4  -8.512  -0.912   2.530
   26    HZ   PHE   4           HZ       PHE   4  -8.932  -1.147   4.937
   27    H    CYS   5           H        CYS   5  -0.865  -0.883   4.180
   28    HA   CYS   5           HA       CYS   5   0.572  -0.828   1.639
   29    HB2  CYS   5           HB2      CYS   5   1.568  -0.201   4.416
   30    HB3  CYS   5           HB1      CYS   5   2.480  -0.025   2.924
   31    H    TYR   6           H        TYR   6   1.727  -2.452   0.994
   32    HA   TYR   6           HA       TYR   6   2.546  -4.580   2.870
   33    HB2  TYR   6           HB2      TYR   6   1.640  -5.102   0.009
   34    HB3  TYR   6           HB1      TYR   6   2.095  -6.262   1.213
   35    HD1  TYR   6           HD1      TYR   6  -0.533  -3.792   0.371
   36    HD2  TYR   6           HD2      TYR   6   0.508  -7.177   2.723
   37    HE1  TYR   6           HE1      TYR   6  -2.833  -4.014   1.049
   38    HE2  TYR   6           HE2      TYR   6  -1.812  -7.408   3.426
   39    HH   TYR   6           HH       TYR   6  -4.380  -5.490   1.982
   40    H    SER   7           H        SER   7   4.602  -4.903   2.812
   41    HA   SER   7           HA       SER   7   6.290  -3.459   1.022
   42    HB2  SER   7           HB2      SER   7   6.804  -5.660   2.979
   43    HB3  SER   7           HB1      SER   7   8.089  -4.694   2.222
   44    HG   SER   7           HG       SER   7   7.252  -2.902   3.224
   45    H    ASP   8           H        ASP   8   4.814  -6.492   1.016
   46    HA   ASP   8           HA       ASP   8   6.639  -7.688  -0.886
   47    HB2  ASP   8           HB2      ASP   8   5.867  -9.068   0.937
   48    HB3  ASP   8           HB1      ASP   8   4.193  -8.739   0.520
   49    H    ARG   9           H        ARG   9   6.062  -8.256  -2.956
   50    HA   ARG   9           HA       ARG   9   4.179  -6.467  -4.163
   51    HB2  ARG   9           HB2      ARG   9   6.131  -8.415  -5.364
   52    HB3  ARG   9           HB1      ARG   9   4.993  -7.493  -6.327
   53    HG2  ARG   9           HG2      ARG   9   7.127  -6.416  -6.412
   54    HG3  ARG   9           HG1      ARG   9   6.030  -5.406  -5.479
   55    HD2  ARG   9           HD2      ARG   9   7.034  -6.221  -3.411
   56    HD3  ARG   9           HD1      ARG   9   8.095  -7.284  -4.333
   57    HE   ARG   9           HE       ARG   9   8.441  -4.712  -5.281
   58   HH11  ARG   9          HH11      ARG   9   9.076  -6.503  -2.293
   59   HH12  ARG   9          HH12      ARG   9  10.409  -5.542  -1.850
   60   HH21  ARG   9          HH21      ARG   9  10.280  -3.411  -4.664
   61   HH22  ARG   9          HH22      ARG   9  11.104  -3.787  -3.211
   62    H    PHE  10           H        PHE  10   3.851  -9.559  -2.921
   63    HA   PHE  10           HA       PHE  10   1.696 -10.167  -4.792
   64    HB2  PHE  10           HB2      PHE  10   3.119 -11.971  -2.820
   65    HB3  PHE  10           HB1      PHE  10   1.851 -12.469  -3.928
   66    HD1  PHE  10           HD1      PHE  10   2.313 -12.382  -6.401
   67    HD2  PHE  10           HD2      PHE  10   5.341 -11.885  -3.468
   68    HE1  PHE  10           HE1      PHE  10   4.010 -12.886  -8.084
   69    HE2  PHE  10           HE2      PHE  10   7.053 -12.389  -5.147
   70    HZ   PHE  10           HZ       PHE  10   6.394 -12.887  -7.465
   71    H    CYS  11           H        CYS  11   2.042  -8.340  -2.348
   72    HA   CYS  11           HA       CYS  11   0.653  -7.450  -0.773
   73    HB2  CYS  11           HB2      CYS  11  -1.357  -9.615  -1.435
   74    HB3  CYS  11           HB1      CYS  11  -1.647  -8.043  -0.702
   75    H    GLN  12           H        GLN  12   2.410  -9.981  -0.374
   76    HA   GLN  12           HA       GLN  12   0.999 -11.429   1.689
   77    HB2  GLN  12           HB2      GLN  12   3.758 -11.712   0.550
   78    HB3  GLN  12           HB1      GLN  12   3.078 -12.785   1.761
   79    HG2  GLN  12           HG2      GLN  12   1.466 -13.635   0.264
   80    HG3  GLN  12           HG1      GLN  12   1.741 -12.334  -0.891
   81   HE21  GLN  12          1HE2      GLN  12   4.580 -12.421  -0.817
   82   HE22  GLN  12          2HE2      GLN  12   5.093 -13.871  -1.574
   83    H    ASN  13           H        ASN  13   2.750  -8.575   1.827
   84    HA   ASN  13           HA       ASN  13   3.555  -9.229   4.594
   85    HB2  ASN  13           HB2      ASN  13   5.192  -7.643   2.612
   86    HB3  ASN  13           HB1      ASN  13   5.447  -7.514   4.340
   87   HD21  ASN  13          HD21      ASN  13   7.524  -8.290   4.182
   88   HD22  ASN  13          HD22      ASN  13   7.889  -9.935   3.839
   89    H    TYR  14           H        TYR  14   1.710  -8.349   5.407
   90    HA   TYR  14           HA       TYR  14   0.922  -5.685   4.755
   91    HB2  TYR  14           HB2      TYR  14  -0.687  -7.432   5.457
   92    HB3  TYR  14           HB1      TYR  14   0.075  -7.479   7.040
   93    HD1  TYR  14           HD1      TYR  14  -0.633  -6.019   8.742
   94    HD2  TYR  14           HD2      TYR  14  -1.774  -5.261   4.721
   95    HE1  TYR  14           HE1      TYR  14  -2.153  -4.266   9.505
   96    HE2  TYR  14           HE2      TYR  14  -3.282  -3.513   5.463
   97    HH   TYR  14           HH       TYR  14  -4.573  -3.053   7.722
   98    H    ILE  15           H        ILE  15   1.870  -3.888   5.567
   99    HA   ILE  15           HA       ILE  15   3.271  -4.166   8.140
  100    HB   ILE  15           HB       ILE  15   4.643  -2.198   7.506
  101   HG12  ILE  15          HG12      ILE  15   3.386  -2.553   4.769
  102   HG13  ILE  15          HG11      ILE  15   3.096  -1.203   5.857
  103   HG21  ILE  15          HG21      ILE  15   5.531  -4.420   7.235
  104   HG22  ILE  15          HG22      ILE  15   6.090  -3.388   5.919
  105   HG23  ILE  15          HG23      ILE  15   4.795  -4.550   5.639
  106   HD11  ILE  15          HD11      ILE  15   4.640  -0.595   4.084
  107   HD12  ILE  15          HD12      ILE  15   5.724  -1.901   4.561
  108   HD13  ILE  15          HD13      ILE  15   5.445  -0.545   5.654
  109    H    GLY  16           H        GLY  16   0.482  -3.149   7.034
  110    HA2  GLY  16           HA2      GLY  16  -0.847  -2.104   8.844
  111    HA3  GLY  16           HA1      GLY  16   0.385  -0.848   8.869
  112    H    SER  17           H        SER  17  -1.637   0.459   8.494
  113    HA   SER  17           HA       SER  17  -1.926   0.846   5.647
  114    HB2  SER  17           HB2      SER  17  -4.388   1.259   6.076
  115    HB3  SER  17           HB1      SER  17  -3.873  -0.424   6.182
  116    HG   SER  17           HG       SER  17  -5.006  -0.190   7.963
  117    H    ILE  18           H        ILE  18  -2.039   2.943   5.103
  118    HA   ILE  18           HA       ILE  18  -2.418   4.994   7.091
  119    HB   ILE  18           HB       ILE  18  -0.337   6.192   6.234
  120   HG12  ILE  18          HG12      ILE  18   0.366   3.400   5.315
  121   HG13  ILE  18          HG11      ILE  18   0.204   4.839   4.319
  122   HG21  ILE  18          HG21      ILE  18   0.060   3.778   7.976
  123   HG22  ILE  18          HG22      ILE  18  -0.411   5.398   8.492
  124   HG23  ILE  18          HG23      ILE  18   1.198   5.116   7.826
  125   HD11  ILE  18          HD11      ILE  18   2.182   5.794   5.382
  126   HD12  ILE  18          HD12      ILE  18   2.533   4.221   4.657
  127   HD13  ILE  18          HD13      ILE  18   2.320   4.361   6.402
  128    HA   PRO  19           HA       PRO  19  -4.352   6.854   3.610
  129    HB2  PRO  19           HB2      PRO  19  -3.854   9.526   4.074
  130    HB3  PRO  19           HB1      PRO  19  -5.113   8.599   4.895
  131    HG2  PRO  19           HG2      PRO  19  -2.381   9.336   5.835
  132    HG3  PRO  19           HG1      PRO  19  -3.902   9.299   6.741
  133    HD2  PRO  19           HD2      PRO  19  -2.059   7.334   6.950
  134    HD3  PRO  19           HD1      PRO  19  -3.792   7.000   7.063
  135    H    ASP  20           H        ASP  20  -1.124   8.090   4.359
  136    HA   ASP  20           HA       ASP  20  -0.679   8.481   1.479
  137    HB2  ASP  20           HB2      ASP  20   0.889   9.641   3.813
  138    HB3  ASP  20           HB1      ASP  20   1.206   9.950   2.112
  139    H    CYS  21           H        CYS  21  -0.039   6.514   0.805
  140    HA   CYS  21           HA       CYS  21   1.789   4.988   2.501
  141    HB2  CYS  21           HB2      CYS  21  -0.328   3.930   1.736
  142    HB3  CYS  21           HB1      CYS  21   0.250   4.033   0.079
  143    H    CYS  22           H        CYS  22   1.889   6.777  -0.480
  144    HA   CYS  22           HA       CYS  22   4.082   5.171  -1.438
  145    HB2  CYS  22           HB2      CYS  22   2.762   7.575  -2.657
  146    HB3  CYS  22           HB1      CYS  22   4.078   6.685  -3.412
  147    H    PHE  23           H        PHE  23   4.115   7.302   0.892
  148    HA   PHE  23           HA       PHE  23   6.498   8.725   0.031
  149    HB2  PHE  23           HB2      PHE  23   4.921   8.847   2.609
  150    HB3  PHE  23           HB1      PHE  23   6.413   9.744   2.344
  151    HD1  PHE  23           HD1      PHE  23   2.911   9.403   1.351
  152    HD2  PHE  23           HD2      PHE  23   6.469  11.675   0.931
  153    HE1  PHE  23           HE1      PHE  23   1.623  11.219   0.289
  154    HE2  PHE  23           HE2      PHE  23   5.194  13.491  -0.128
  155    HZ   PHE  23           HZ       PHE  23   2.769  13.263  -0.449
  156    H    GLY  24           H        GLY  24   5.819   5.797   1.092
  157    HA2  GLY  24           HA2      GLY  24   8.536   5.390   2.051
  158    HA3  GLY  24           HA1      GLY  24   7.164   4.596   2.841
  159    H    ARG  25           H        ARG  25   9.035   2.999   1.769
  160    HA   ARG  25           HA       ARG  25   8.378   2.296  -0.933
  161    HB2  ARG  25           HB2      ARG  25   9.940   0.738   1.122
  162    HB3  ARG  25           HB1      ARG  25   9.846   0.357  -0.586
  163    HG2  ARG  25           HG2      ARG  25  10.927   2.536  -1.073
  164    HG3  ARG  25           HG1      ARG  25  11.125   2.774   0.667
  165    HD2  ARG  25           HD2      ARG  25  13.173   1.852  -0.199
  166    HD3  ARG  25           HD1      ARG  25  12.353   0.617   0.752
  167    HE   ARG  25           HE       ARG  25  11.826   0.616  -2.084
  168   HH11  ARG  25          HH11      ARG  25  13.606  -0.903   0.595
  169   HH12  ARG  25          HH12      ARG  25  14.165  -2.204  -0.368
  170   HH21  ARG  25          HH21      ARG  25  12.600  -1.178  -3.359
  171   HH22  ARG  25          HH22      ARG  25  13.579  -2.369  -2.613
  172    H    GLY  26           H        GLY  26   6.872   0.814  -1.613
  173    HA2  GLY  26           HA2      GLY  26   6.193  -1.531  -0.493
  174    HA3  GLY  26           HA1      GLY  26   5.213  -0.389   0.405
  175    H    SER  27           H        SER  27   3.874  -2.182  -0.776
  176    HA   SER  27           HA       SER  27   2.763  -1.123  -3.264
  177    HB2  SER  27           HB2      SER  27   2.059  -3.693  -1.838
  178    HB3  SER  27           HB1      SER  27   1.816  -3.282  -3.532
  179    HG   SER  27           HG       SER  27   3.526  -4.771  -2.908
  180    H    TYR  28           H        TYR  28   0.434  -0.781  -3.187
  181    HA   TYR  28           HA       TYR  28  -0.702  -0.828  -0.500
  182    HB2  TYR  28           HB2      TYR  28  -1.795   1.308  -0.829
  183    HB3  TYR  28           HB1      TYR  28  -0.059   1.516  -1.007
  184    HD1  TYR  28           HD1      TYR  28  -3.317   1.709  -2.661
  185    HD2  TYR  28           HD2      TYR  28   0.893   1.973  -3.254
  186    HE1  TYR  28           HE1      TYR  28  -3.693   2.762  -4.822
  187    HE2  TYR  28           HE2      TYR  28   0.523   3.033  -5.421
  188    HH   TYR  28           HH       TYR  28  -2.560   4.160  -6.394
  189    H    SER  29           H        SER  29  -2.874  -1.201  -0.407
  190    HA   SER  29           HA       SER  29  -4.299  -1.602  -2.909
  191    HB2  SER  29           HB2      SER  29  -5.227  -3.721  -2.023
  192    HB3  SER  29           HB1      SER  29  -3.475  -3.812  -2.215
  193    HG   SER  29           HG       SER  29  -4.951  -4.124   0.023
  194    H    PHE  30           H        PHE  30  -6.681  -1.836  -2.372
  195    HA   PHE  30           HA       PHE  30  -7.313  -0.003  -0.189
  196    HB2  PHE  30           HB2      PHE  30  -8.966  -0.795  -2.595
  197    HB3  PHE  30           HB1      PHE  30  -9.412   0.408  -1.388
  198    HD1  PHE  30           HD1      PHE  30  -7.793   2.387  -1.085
  199    HD2  PHE  30           HD2      PHE  30  -7.810  -0.146  -4.499
  200    HE1  PHE  30           HE1      PHE  30  -6.625   4.125  -2.377
  201    HE2  PHE  30           HE2      PHE  30  -6.643   1.589  -5.793
  202    HZ   PHE  30           HZ       PHE  30  -6.054   3.724  -4.728
  203    H    GLU  31           H        GLU  31  -6.976  -3.113  -0.495
  204    HA   GLU  31           HA       GLU  31  -9.179  -3.729   1.319
  205    HB2  GLU  31           HB2      GLU  31  -8.396  -5.418  -1.051
  206    HB3  GLU  31           HB1      GLU  31  -9.483  -5.927   0.229
  207    HG2  GLU  31           HG2      GLU  31 -11.027  -4.131  -0.383
  208    HG3  GLU  31           HG1      GLU  31  -9.931  -3.648  -1.677
  209    H    LEU  32           H        LEU  32  -8.779  -5.515   2.688
  210    HA   LEU  32           HA       LEU  32  -6.020  -5.929   3.372
  211    HB2  LEU  32           HB2      LEU  32  -8.595  -6.958   4.512
  212    HB3  LEU  32           HB1      LEU  32  -7.036  -7.495   5.093
  213    HG   LEU  32           HG       LEU  32  -7.978  -4.626   5.164
  214   HD11  LEU  32          HD11      LEU  32  -9.312  -6.077   6.612
  215   HD12  LEU  32          HD12      LEU  32  -8.240  -5.026   7.549
  216   HD13  LEU  32          HD13      LEU  32  -7.824  -6.726   7.309
  217   HD21  LEU  32          HD21      LEU  32  -5.549  -4.876   5.086
  218   HD22  LEU  32          HD22      LEU  32  -5.622  -6.033   6.414
  219   HD23  LEU  32          HD23      LEU  32  -6.081  -4.353   6.681
  220    H    GLN  33           H        GLN  33  -4.797  -7.411   2.669
  221    HA   GLN  33           HA       GLN  33  -3.956  -9.133   1.555
  222    HB2  GLN  33           HB2      GLN  33  -6.140 -10.651   2.972
  223    HB3  GLN  33           HB1      GLN  33  -4.710 -11.370   2.248
  224    HG2  GLN  33           HG2      GLN  33  -3.315 -10.037   3.824
  225    HG3  GLN  33           HG1      GLN  33  -4.796  -9.466   4.576
  226   HE21  GLN  33          1HE2      GLN  33  -6.135 -12.078   4.245
  227   HE22  GLN  33          2HE2      GLN  33  -5.423 -13.082   5.456
  228    HA   PRO  34           HA       PRO  34  -6.876  -9.566  -1.919
  229    HB2  PRO  34           HB2      PRO  34  -5.666  -7.595  -3.497
  230    HB3  PRO  34           HB1      PRO  34  -7.119  -7.368  -2.524
  231    HG2  PRO  34           HG2      PRO  34  -4.595  -6.148  -2.125
  232    HG3  PRO  34           HG1      PRO  34  -5.989  -6.087  -1.040
  233    HD2  PRO  34           HD2      PRO  34  -3.580  -7.832  -0.936
  234    HD3  PRO  34           HD1      PRO  34  -4.565  -7.182   0.392
  235    HA   PRO  35           HA       PRO  35  -3.880 -11.797  -4.426
  236    HB2  PRO  35           HB2      PRO  35  -4.734 -11.341  -6.989
  237    HB3  PRO  35           HB1      PRO  35  -5.504 -12.489  -5.892
  238    HG2  PRO  35           HG2      PRO  35  -6.314  -9.713  -6.601
  239    HG3  PRO  35           HG1      PRO  35  -7.320 -11.148  -6.352
  240    HD2  PRO  35           HD2      PRO  35  -7.038  -9.209  -4.487
  241    HD3  PRO  35           HD1      PRO  35  -7.313 -10.911  -4.070
  242    HA   PRO  36           HA       PRO  36  -0.340  -9.305  -5.300
  243    HB2  PRO  36           HB2      PRO  36  -0.295 -10.715  -7.916
  244    HB3  PRO  36           HB1      PRO  36   1.015 -10.461  -6.763
  245    HG2  PRO  36           HG2      PRO  36  -0.326 -12.796  -6.977
  246    HG3  PRO  36           HG1      PRO  36   0.369 -12.229  -5.453
  247    HD2  PRO  36           HD2      PRO  36  -2.429 -12.504  -6.231
  248    HD3  PRO  36           HD1      PRO  36  -1.729 -12.255  -4.622
  249    H    TRP  37           H        TRP  37  -2.451  -9.664  -8.118
  250    HA   TRP  37           HA       TRP  37  -1.371  -7.326  -9.377
  251    HB2  TRP  37           HB2      TRP  37  -3.034  -7.817 -11.177
  252    HB3  TRP  37           HB1      TRP  37  -1.931  -9.138 -10.814
  253    HD1  TRP  37           HD       TRP  37  -5.610  -8.203 -10.729
  254    HE1  TRP  37           HE1      TRP  37  -6.996 -10.297 -10.185
  255    HE3  TRP  37          3HE       TRP  37  -1.813 -11.415  -9.496
  256    HZ2  TRP  37           HZ2      TRP  37  -6.541 -12.952  -9.352
  257    HZ3  TRP  37           HZ3      TRP  37  -2.384 -13.707  -8.844
  258    HH2  TRP  37           HH       TRP  37  -4.700 -14.456  -8.773
  259    H    GLU  38           H        GLU  38  -3.707  -7.697  -7.021
  260    HA   GLU  38           HA       GLU  38  -5.083  -5.321  -7.934
  261    HB2  GLU  38           HB2      GLU  38  -5.798  -7.328  -5.807
  262    HB3  GLU  38           HB1      GLU  38  -6.639  -5.793  -5.994
  263    HG2  GLU  38           HG2      GLU  38  -7.206  -6.415  -8.317
  264    HG3  GLU  38           HG1      GLU  38  -6.438  -7.978  -8.064
  265    H    CYS  39           H        CYS  39  -2.470  -6.081  -6.164
  266    HA   CYS  39           HA       CYS  39  -2.681  -3.671  -4.532
  267    HB2  CYS  39           HB2      CYS  39  -0.573  -5.831  -4.665
  268    HB3  CYS  39           HB1      CYS  39  -0.423  -4.384  -3.667
  269    H    TYR  40           H        TYR  40  -1.361  -1.930  -4.942
  270    HA   TYR  40           HA       TYR  40  -0.126  -1.917  -7.624
  271    HB2  TYR  40           HB2      TYR  40  -1.113   0.484  -6.089
  272    HB3  TYR  40           HB1      TYR  40  -0.802   0.348  -7.811
  273    HD1  TYR  40           HD1      TYR  40  -3.202  -0.135  -5.145
  274    HD2  TYR  40           HD2      TYR  40  -2.449  -0.852  -9.267
  275    HE1  TYR  40           HE1      TYR  40  -5.577  -0.600  -5.483
  276    HE2  TYR  40           HE2      TYR  40  -4.828  -1.319  -9.617
  277    HH   TYR  40           HH       TYR  40  -6.781  -2.064  -8.245
  278    H    GLN  41           H        GLN  41   2.032  -1.302  -7.670
  279    HA   GLN  41           HA       GLN  41   3.246  -0.779  -5.092
  280    HB2  GLN  41           HB2      GLN  41   4.515  -1.254  -7.799
  281    HB3  GLN  41           HB1      GLN  41   5.428  -0.852  -6.360
  282    HG2  GLN  41           HG2      GLN  41   5.626  -3.183  -6.647
  283    HG3  GLN  41           HG1      GLN  41   4.494  -2.957  -5.322
  284   HE21  GLN  41          1HE2      GLN  41   4.896  -3.950  -8.600
  285   HE22  GLN  41          2HE2      GLN  41   3.380  -4.726  -8.795
  286    H    CYS  42           H        CYS  42   4.177   1.105  -4.485
  287    HA   CYS  42           HA       CYS  42   3.540   3.428  -6.034
  288    HB2  CYS  42           HB2      CYS  42   5.156   3.101  -3.486
  289    HB3  CYS  42           HB1      CYS  42   4.718   4.647  -4.197
  Start of MODEL    8
    1    H    PCA   1           H        PGL   1  -9.066   6.024   2.960
    2    HA   PCA   1           HA       PGL   1  -7.917   8.065   1.924
    3    HB2  PCA   1           HB1      PGL   1  -7.913   9.907   3.270
    4    HB3  PCA   1           HB2      PGL   1  -6.980   9.014   4.503
    5    HG2  PCA   1           HG1      PGL   1  -9.841   9.621   4.477
    6    HG3  PCA   1           HG2      PGL   1  -8.861   8.846   5.768
    7    H    GLU   2           H        GLU   2  -7.267   5.940   4.587
    8    HA   GLU   2           HA       GLU   2  -4.437   5.900   3.907
    9    HB2  GLU   2           HB2      GLU   2  -5.888   4.531   6.191
   10    HB3  GLU   2           HB1      GLU   2  -4.148   4.635   5.969
   11    HG2  GLU   2           HG2      GLU   2  -4.305   7.094   6.162
   12    HG3  GLU   2           HG1      GLU   2  -6.021   6.924   6.512
   13    H    ALA   3           H        ALA   3  -3.523   4.138   2.975
   14    HA   ALA   3           HA       ALA   3  -5.427   2.122   2.035
   15    HB1  ALA   3           HB1      ALA   3  -2.765   2.935   0.876
   16    HB2  ALA   3           HB2      ALA   3  -4.345   3.451   0.286
   17    HB3  ALA   3           HB3      ALA   3  -3.884   1.752   0.196
   18    H    PHE   4           H        PHE   4  -4.699  -0.068   1.933
   19    HA   PHE   4           HA       PHE   4  -3.227  -0.822   4.283
   20    HB2  PHE   4           HB2      PHE   4  -4.365  -2.522   2.046
   21    HB3  PHE   4           HB1      PHE   4  -3.773  -3.128   3.582
   22    HD1  PHE   4           HD1      PHE   4  -5.030  -2.454   5.703
   23    HD2  PHE   4           HD2      PHE   4  -6.556  -1.808   1.790
   24    HE1  PHE   4           HE1      PHE   4  -7.271  -2.238   6.625
   25    HE2  PHE   4           HE2      PHE   4  -8.829  -1.586   2.718
   26    HZ   PHE   4           HZ       PHE   4  -9.187  -1.803   5.135
   27    H    CYS   5           H        CYS   5  -1.091  -1.058   4.310
   28    HA   CYS   5           HA       CYS   5   0.283  -1.078   1.755
   29    HB2  CYS   5           HB2      CYS   5   1.270  -0.379   4.500
   30    HB3  CYS   5           HB1      CYS   5   2.227  -0.320   3.023
   31    H    TYR   6           H        TYR   6   1.315  -2.681   1.081
   32    HA   TYR   6           HA       TYR   6   2.314  -4.752   2.908
   33    HB2  TYR   6           HB2      TYR   6   1.555  -5.141   0.008
   34    HB3  TYR   6           HB1      TYR   6   1.943  -6.372   1.192
   35    HD1  TYR   6           HD1      TYR   6  -0.672  -4.092   0.027
   36    HD2  TYR   6           HD2      TYR   6   0.318  -7.109   2.846
   37    HE1  TYR   6           HE1      TYR   6  -3.015  -4.304   0.601
   38    HE2  TYR   6           HE2      TYR   6  -2.046  -7.335   3.435
   39    HH   TYR   6           HH       TYR   6  -4.536  -5.725   1.601
   40    H    SER   7           H        SER   7   4.346  -4.623   3.001
   41    HA   SER   7           HA       SER   7   5.973  -2.838   1.678
   42    HB2  SER   7           HB2      SER   7   6.669  -5.442   2.952
   43    HB3  SER   7           HB1      SER   7   7.757  -4.044   2.785
   44    HG   SER   7           HG       SER   7   6.951  -3.462   4.606
   45    H    ASP   8           H        ASP   8   5.137  -6.091   0.843
   46    HA   ASP   8           HA       ASP   8   7.059  -6.084  -1.350
   47    HB2  ASP   8           HB2      ASP   8   7.597  -7.817   0.159
   48    HB3  ASP   8           HB1      ASP   8   5.928  -8.307   0.336
   49    H    ARG   9           H        ARG   9   6.371  -6.965  -3.362
   50    HA   ARG   9           HA       ARG   9   3.871  -5.982  -4.202
   51    HB2  ARG   9           HB2      ARG   9   6.071  -7.425  -5.558
   52    HB3  ARG   9           HB1      ARG   9   4.514  -7.397  -6.356
   53    HG2  ARG   9           HG2      ARG   9   5.990  -5.613  -7.160
   54    HG3  ARG   9           HG1      ARG   9   4.541  -4.966  -6.410
   55    HD2  ARG   9           HD2      ARG   9   5.816  -4.479  -4.376
   56    HD3  ARG   9           HD1      ARG   9   7.250  -5.180  -5.123
   57    HE   ARG   9           HE       ARG   9   7.258  -3.421  -6.705
   58   HH11  ARG   9          HH11      ARG   9   4.983  -2.887  -4.044
   59   HH12  ARG   9          HH12      ARG   9   5.087  -1.197  -4.088
   60   HH21  ARG   9          HH21      ARG   9   7.373  -1.049  -6.810
   61   HH22  ARG   9          HH22      ARG   9   6.506  -0.089  -5.736
   62    H    PHE  10           H        PHE  10   4.600  -9.133  -2.951
   63    HA   PHE  10           HA       PHE  10   2.481 -10.398  -4.368
   64    HB2  PHE  10           HB2      PHE  10   4.111 -11.334  -2.019
   65    HB3  PHE  10           HB1      PHE  10   2.791 -12.283  -2.692
   66    HD1  PHE  10           HD1      PHE  10   2.972 -13.268  -4.904
   67    HD2  PHE  10           HD2      PHE  10   6.173 -11.057  -3.199
   68    HE1  PHE  10           HE1      PHE  10   4.496 -14.186  -6.594
   69    HE2  PHE  10           HE2      PHE  10   7.702 -11.963  -4.867
   70    HZ   PHE  10           HZ       PHE  10   6.878 -13.534  -6.586
   71    H    CYS  11           H        CYS  11   2.335  -8.171  -2.011
   72    HA   CYS  11           HA       CYS  11   0.585  -7.269  -0.860
   73    HB2  CYS  11           HB2      CYS  11  -1.029  -9.288  -2.426
   74    HB3  CYS  11           HB1      CYS  11  -1.688  -7.937  -1.511
   75    H    GLN  12           H        GLN  12   2.006  -9.709   0.126
   76    HA   GLN  12           HA       GLN  12  -0.048 -10.824   1.912
   77    HB2  GLN  12           HB2      GLN  12   2.753 -11.776   1.354
   78    HB3  GLN  12           HB1      GLN  12   1.633 -12.528   2.470
   79    HG2  GLN  12           HG2      GLN  12   0.135 -13.037   0.626
   80    HG3  GLN  12           HG1      GLN  12   1.260 -12.264  -0.495
   81   HE21  GLN  12          1HE2      GLN  12   3.215 -13.267  -0.941
   82   HE22  GLN  12          2HE2      GLN  12   3.485 -14.930  -0.611
   83    H    ASN  13           H        ASN  13   2.579  -8.627   1.891
   84    HA   ASN  13           HA       ASN  13   3.173  -9.183   4.710
   85    HB2  ASN  13           HB2      ASN  13   4.624  -7.366   2.761
   86    HB3  ASN  13           HB1      ASN  13   5.064  -7.561   4.448
   87   HD21  ASN  13          HD21      ASN  13   7.096  -8.310   3.941
   88   HD22  ASN  13          HD22      ASN  13   7.381  -9.870   3.258
   89    H    TYR  14           H        TYR  14   1.232  -8.385   5.547
   90    HA   TYR  14           HA       TYR  14   0.564  -5.650   5.021
   91    HB2  TYR  14           HB2      TYR  14  -1.214  -7.333   5.347
   92    HB3  TYR  14           HB1      TYR  14  -0.664  -7.570   7.001
   93    HD1  TYR  14           HD1      TYR  14  -1.927  -6.529   8.624
   94    HD2  TYR  14           HD2      TYR  14  -1.579  -4.684   4.807
   95    HE1  TYR  14           HE1      TYR  14  -3.371  -4.709   9.378
   96    HE2  TYR  14           HE2      TYR  14  -3.016  -2.862   5.550
   97    HH   TYR  14           HH       TYR  14  -3.933  -2.411   8.829
   98    H    ILE  15           H        ILE  15   1.627  -4.107   5.927
   99    HA   ILE  15           HA       ILE  15   2.712  -4.518   8.596
  100    HB   ILE  15           HB       ILE  15   3.950  -2.363   8.225
  101   HG12  ILE  15          HG12      ILE  15   2.878  -2.645   5.397
  102   HG13  ILE  15          HG11      ILE  15   2.464  -1.367   6.530
  103   HG21  ILE  15          HG21      ILE  15   5.019  -4.508   7.879
  104   HG22  ILE  15          HG22      ILE  15   5.601  -3.340   6.693
  105   HG23  ILE  15          HG23      ILE  15   4.421  -4.562   6.221
  106   HD11  ILE  15          HD11      ILE  15   4.789  -0.604   6.488
  107   HD12  ILE  15          HD12      ILE  15   4.049  -0.581   4.886
  108   HD13  ILE  15          HD13      ILE  15   5.173  -1.870   5.323
  109    H    GLY  16           H        GLY  16   0.447  -2.517   6.841
  110    HA2  GLY  16           HA2      GLY  16  -1.320  -2.096   8.802
  111    HA3  GLY  16           HA1      GLY  16  -0.114  -0.834   9.064
  112    H    SER  17           H        SER  17  -2.056   0.500   8.523
  113    HA   SER  17           HA       SER  17  -2.175   0.867   5.636
  114    HB2  SER  17           HB2      SER  17  -4.581   1.613   6.077
  115    HB3  SER  17           HB1      SER  17  -4.273  -0.119   6.216
  116    HG   SER  17           HG       SER  17  -4.092   1.549   8.479
  117    H    ILE  18           H        ILE  18  -1.733   2.912   5.028
  118    HA   ILE  18           HA       ILE  18  -1.915   5.112   6.917
  119    HB   ILE  18           HB       ILE  18   0.441   5.850   6.325
  120   HG12  ILE  18          HG12      ILE  18   0.676   2.989   5.368
  121   HG13  ILE  18          HG11      ILE  18   0.835   4.441   4.391
  122   HG21  ILE  18          HG21      ILE  18   1.567   4.411   7.984
  123   HG22  ILE  18          HG22      ILE  18   0.144   3.367   7.979
  124   HG23  ILE  18          HG23      ILE  18   0.009   5.038   8.523
  125   HD11  ILE  18          HD11      ILE  18   2.995   3.443   4.859
  126   HD12  ILE  18          HD12      ILE  18   2.674   3.560   6.590
  127   HD13  ILE  18          HD13      ILE  18   2.864   5.031   5.627
  128    HA   PRO  19           HA       PRO  19  -2.669   7.108   2.993
  129    HB2  PRO  19           HB2      PRO  19  -2.727   9.669   3.726
  130    HB3  PRO  19           HB1      PRO  19  -3.911   8.516   4.350
  131    HG2  PRO  19           HG2      PRO  19  -1.589   9.758   5.714
  132    HG3  PRO  19           HG1      PRO  19  -3.110   9.172   6.399
  133    HD2  PRO  19           HD2      PRO  19  -0.588   7.819   6.322
  134    HD3  PRO  19           HD1      PRO  19  -2.132   7.195   6.933
  135    H    ASP  20           H        ASP  20   0.323   7.048   4.215
  136    HA   ASP  20           HA       ASP  20   1.450   8.718   2.074
  137    HB2  ASP  20           HB2      ASP  20   3.288   9.350   3.561
  138    HB3  ASP  20           HB1      ASP  20   1.755   9.775   4.302
  139    H    CYS  21           H        CYS  21   0.749   6.074   1.900
  140    HA   CYS  21           HA       CYS  21   2.635   4.135   2.613
  141    HB2  CYS  21           HB2      CYS  21   0.208   3.892   1.800
  142    HB3  CYS  21           HB1      CYS  21   0.888   3.943   0.177
  143    H    CYS  22           H        CYS  22   2.517   6.300  -0.154
  144    HA   CYS  22           HA       CYS  22   4.545   4.754  -1.519
  145    HB2  CYS  22           HB2      CYS  22   2.979   7.149  -2.452
  146    HB3  CYS  22           HB1      CYS  22   4.179   6.298  -3.417
  147    H    PHE  23           H        PHE  23   4.832   6.841   0.872
  148    HA   PHE  23           HA       PHE  23   7.055   8.338  -0.256
  149    HB2  PHE  23           HB2      PHE  23   5.826   8.291   2.500
  150    HB3  PHE  23           HB1      PHE  23   7.326   9.147   2.163
  151    HD1  PHE  23           HD1      PHE  23   7.342  11.185   0.913
  152    HD2  PHE  23           HD2      PHE  23   3.716   9.050   1.512
  153    HE1  PHE  23           HE1      PHE  23   6.070  13.137   0.142
  154    HE2  PHE  23           HE2      PHE  23   2.436  11.000   0.746
  155    HZ   PHE  23           HZ       PHE  23   3.614  13.050   0.058
  156    H    GLY  24           H        GLY  24   6.753   5.374   0.282
  157    HA2  GLY  24           HA2      GLY  24   9.531   4.885   0.704
  158    HA3  GLY  24           HA1      GLY  24   8.449   4.156   1.906
  159    H    ARG  25           H        ARG  25   9.638   2.291   0.471
  160    HA   ARG  25           HA       ARG  25   8.180   1.733  -1.946
  161    HB2  ARG  25           HB2      ARG  25  10.509   0.905  -1.572
  162    HB3  ARG  25           HB1      ARG  25   9.897  -0.140  -0.300
  163    HG2  ARG  25           HG2      ARG  25   8.482  -1.288  -1.954
  164    HG3  ARG  25           HG1      ARG  25   9.163  -0.266  -3.218
  165    HD2  ARG  25           HD2      ARG  25  10.676  -2.191  -1.469
  166    HD3  ARG  25           HD1      ARG  25  10.262  -2.434  -3.164
  167    HE   ARG  25           HE       ARG  25  11.711  -0.047  -2.873
  168   HH11  ARG  25          HH11      ARG  25  12.164  -3.552  -2.805
  169   HH12  ARG  25          HH12      ARG  25  13.815  -3.499  -3.172
  170   HH21  ARG  25          HH21      ARG  25  14.011   0.037  -3.394
  171   HH22  ARG  25          HH22      ARG  25  14.888  -1.405  -3.495
  172    H    GLY  26           H        GLY  26   6.346   0.551  -2.145
  173    HA2  GLY  26           HA2      GLY  26   5.558  -1.438  -0.364
  174    HA3  GLY  26           HA1      GLY  26   4.749   0.065   0.069
  175    H    SER  27           H        SER  27   3.425  -2.176  -0.770
  176    HA   SER  27           HA       SER  27   2.296  -1.325  -3.331
  177    HB2  SER  27           HB2      SER  27   1.995  -3.998  -1.925
  178    HB3  SER  27           HB1      SER  27   1.638  -3.618  -3.609
  179    HG   SER  27           HG       SER  27   3.804  -4.604  -2.614
  180    H    TYR  28           H        TYR  28   0.117  -0.755  -3.125
  181    HA   TYR  28           HA       TYR  28  -1.017  -1.112  -0.450
  182    HB2  TYR  28           HB2      TYR  28  -1.924   1.130  -0.403
  183    HB3  TYR  28           HB1      TYR  28  -0.196   1.218  -0.672
  184    HD1  TYR  28           HD1      TYR  28   0.677   1.986  -2.912
  185    HD2  TYR  28           HD2      TYR  28  -3.500   1.923  -2.031
  186    HE1  TYR  28           HE1      TYR  28   0.250   3.448  -4.809
  187    HE2  TYR  28           HE2      TYR  28  -3.923   3.387  -3.938
  188    HH   TYR  28           HH       TYR  28  -2.727   5.000  -5.292
  189    H    SER  29           H        SER  29  -3.187  -1.439  -0.305
  190    HA   SER  29           HA       SER  29  -4.720  -1.445  -2.780
  191    HB2  SER  29           HB2      SER  29  -5.650  -3.674  -2.235
  192    HB3  SER  29           HB1      SER  29  -3.909  -3.751  -2.507
  193    HG   SER  29           HG       SER  29  -5.231  -4.565  -0.382
  194    H    PHE  30           H        PHE  30  -7.124  -1.877  -2.174
  195    HA   PHE  30           HA       PHE  30  -7.628  -0.416   0.306
  196    HB2  PHE  30           HB2      PHE  30  -9.279  -0.523  -2.235
  197    HB3  PHE  30           HB1      PHE  30  -9.748   0.320  -0.759
  198    HD1  PHE  30           HD1      PHE  30  -8.131   0.649  -3.876
  199    HD2  PHE  30           HD2      PHE  30  -8.037   2.073   0.128
  200    HE1  PHE  30           HE1      PHE  30  -6.881   2.632  -4.615
  201    HE2  PHE  30           HE2      PHE  30  -6.792   4.064  -0.602
  202    HZ   PHE  30           HZ       PHE  30  -6.210   4.350  -2.975
  203    H    GLU  31           H        GLU  31  -7.228  -3.284  -0.213
  204    HA   GLU  31           HA       GLU  31  -9.451  -4.229   1.350
  205    HB2  GLU  31           HB2      GLU  31 -10.166  -4.551  -1.017
  206    HB3  GLU  31           HB1      GLU  31  -8.731  -5.521  -1.299
  207    HG2  GLU  31           HG2      GLU  31  -9.513  -7.209   0.210
  208    HG3  GLU  31           HG1      GLU  31 -10.886  -6.209   0.683
  209    H    LEU  32           H        LEU  32  -8.828  -5.908   2.679
  210    HA   LEU  32           HA       LEU  32  -6.039  -6.284   3.071
  211    HB2  LEU  32           HB2      LEU  32  -8.445  -7.427   4.435
  212    HB3  LEU  32           HB1      LEU  32  -6.837  -8.008   4.791
  213    HG   LEU  32           HG       LEU  32  -7.751  -5.152   5.165
  214   HD11  LEU  32          HD11      LEU  32  -7.270  -7.364   7.163
  215   HD12  LEU  32          HD12      LEU  32  -8.845  -6.703   6.725
  216   HD13  LEU  32          HD13      LEU  32  -7.659  -5.689   7.550
  217   HD21  LEU  32          HD21      LEU  32  -5.647  -4.948   6.411
  218   HD22  LEU  32          HD22      LEU  32  -5.367  -5.319   4.717
  219   HD23  LEU  32          HD23      LEU  32  -5.211  -6.588   5.936
  220    H    GLN  33           H        GLN  33  -4.745  -7.787   2.618
  221    HA   GLN  33           HA       GLN  33  -3.757  -9.456   1.518
  222    HB2  GLN  33           HB2      GLN  33  -6.031 -11.024   2.720
  223    HB3  GLN  33           HB1      GLN  33  -4.599 -11.747   2.006
  224    HG2  GLN  33           HG2      GLN  33  -4.622  -9.892   4.375
  225    HG3  GLN  33           HG1      GLN  33  -4.498 -11.646   4.454
  226   HE21  GLN  33          1HE2      GLN  33  -2.686  -9.607   5.394
  227   HE22  GLN  33          2HE2      GLN  33  -1.160  -9.920   4.636
  228    HA   PRO  34           HA       PRO  34  -6.417  -9.721  -2.197
  229    HB2  PRO  34           HB2      PRO  34  -5.469  -7.722  -3.653
  230    HB3  PRO  34           HB1      PRO  34  -6.530  -7.371  -2.285
  231    HG2  PRO  34           HG2      PRO  34  -3.561  -7.140  -2.478
  232    HG3  PRO  34           HG1      PRO  34  -4.722  -6.048  -1.704
  233    HD2  PRO  34           HD2      PRO  34  -3.233  -8.020  -0.374
  234    HD3  PRO  34           HD1      PRO  34  -4.685  -7.223   0.238
  235    HA   PRO  35           HA       PRO  35  -3.268 -11.916  -4.595
  236    HB2  PRO  35           HB2      PRO  35  -4.275 -10.711  -7.089
  237    HB3  PRO  35           HB1      PRO  35  -4.233 -12.408  -6.618
  238    HG2  PRO  35           HG2      PRO  35  -6.508 -10.951  -6.749
  239    HG3  PRO  35           HG1      PRO  35  -6.299 -12.318  -5.636
  240    HD2  PRO  35           HD2      PRO  35  -6.276  -9.396  -5.098
  241    HD3  PRO  35           HD1      PRO  35  -6.772 -10.738  -4.056
  242    HA   PRO  36           HA       PRO  36   0.213  -9.201  -5.233
  243    HB2  PRO  36           HB2      PRO  36   1.160 -10.252  -7.670
  244    HB3  PRO  36           HB1      PRO  36   1.647 -10.770  -6.061
  245    HG2  PRO  36           HG2      PRO  36  -0.358 -11.956  -7.911
  246    HG3  PRO  36           HG1      PRO  36   0.726 -12.759  -6.763
  247    HD2  PRO  36           HD2      PRO  36  -1.868 -12.512  -6.246
  248    HD3  PRO  36           HD1      PRO  36  -0.666 -12.306  -4.951
  249    H    TRP  37           H        TRP  37  -1.933  -9.647  -7.953
  250    HA   TRP  37           HA       TRP  37  -0.903  -7.294  -9.295
  251    HB2  TRP  37           HB2      TRP  37  -2.636  -7.887 -11.030
  252    HB3  TRP  37           HB1      TRP  37  -1.355  -9.071 -10.779
  253    HD1  TRP  37           HD       TRP  37  -5.094  -8.512  -9.946
  254    HE1  TRP  37           HE1      TRP  37  -6.193 -10.812  -9.631
  255    HE3  TRP  37          3HE       TRP  37  -0.933 -11.454 -10.310
  256    HZ2  TRP  37           HZ2      TRP  37  -5.406 -13.522  -9.549
  257    HZ3  TRP  37           HZ3      TRP  37  -1.192 -13.894 -10.099
  258    HH2  TRP  37           HH       TRP  37  -3.387 -14.902  -9.727
  259    H    GLU  38           H        GLU  38  -3.042  -7.725  -6.832
  260    HA   GLU  38           HA       GLU  38  -4.882  -5.735  -7.845
  261    HB2  GLU  38           HB2      GLU  38  -5.046  -7.623  -5.557
  262    HB3  GLU  38           HB1      GLU  38  -6.205  -6.300  -5.748
  263    HG2  GLU  38           HG2      GLU  38  -5.647  -8.494  -7.729
  264    HG3  GLU  38           HG1      GLU  38  -7.062  -8.384  -6.687
  265    H    CYS  39           H        CYS  39  -2.120  -5.762  -6.071
  266    HA   CYS  39           HA       CYS  39  -2.896  -3.424  -4.529
  267    HB2  CYS  39           HB2      CYS  39  -0.216  -4.792  -4.824
  268    HB3  CYS  39           HB1      CYS  39  -0.552  -3.426  -3.764
  269    H    TYR  40           H        TYR  40  -1.966  -1.405  -4.903
  270    HA   TYR  40           HA       TYR  40  -1.049  -0.961  -7.638
  271    HB2  TYR  40           HB2      TYR  40  -1.613   1.046  -5.436
  272    HB3  TYR  40           HB1      TYR  40  -1.403   1.386  -7.145
  273    HD1  TYR  40           HD1      TYR  40  -3.241   1.032  -8.710
  274    HD2  TYR  40           HD2      TYR  40  -3.679   0.124  -4.584
  275    HE1  TYR  40           HE1      TYR  40  -5.671   0.923  -8.992
  276    HE2  TYR  40           HE2      TYR  40  -6.107   0.007  -4.855
  277    HH   TYR  40           HH       TYR  40  -7.588  -0.114  -7.871
  278    H    GLN  41           H        GLN  41   1.047  -0.050  -7.912
  279    HA   GLN  41           HA       GLN  41   2.665  -0.584  -5.558
  280    HB2  GLN  41           HB2      GLN  41   4.555  -0.989  -7.129
  281    HB3  GLN  41           HB1      GLN  41   3.239  -2.140  -7.242
  282    HG2  GLN  41           HG2      GLN  41   2.411  -0.918  -9.229
  283    HG3  GLN  41           HG1      GLN  41   3.830   0.123  -9.125
  284   HE21  GLN  41          1HE2      GLN  41   2.683  -3.068  -9.775
  285   HE22  GLN  41          2HE2      GLN  41   4.083  -3.651 -10.581
  286    H    CYS  42           H        CYS  42   3.661   0.938  -4.588
  287    HA   CYS  42           HA       CYS  42   3.774   3.558  -5.644
  288    HB2  CYS  42           HB2      CYS  42   5.119   2.350  -3.210
  289    HB3  CYS  42           HB1      CYS  42   4.997   4.069  -3.567
  Start of MODEL    9
    1    H    PCA   1           H        PGL   1 -10.676   0.429   3.367
    2    HA   PCA   1           HA       PGL   1 -12.012   2.597   3.218
    3    HB2  PCA   1           HB1      PGL   1 -12.961   3.220   5.188
    4    HB3  PCA   1           HB2      PGL   1 -11.341   3.435   5.907
    5    HG2  PCA   1           HG1      PGL   1 -13.217   1.212   6.255
    6    HG3  PCA   1           HG2      PGL   1 -11.671   1.535   7.109
    7    H    GLU   2           H        GLU   2  -9.045   1.688   4.692
    8    HA   GLU   2           HA       GLU   2  -7.787   4.212   3.854
    9    HB2  GLU   2           HB2      GLU   2  -6.850   2.136   5.848
   10    HB3  GLU   2           HB1      GLU   2  -5.979   3.601   5.421
   11    HG2  GLU   2           HG2      GLU   2  -7.723   4.964   6.370
   12    HG3  GLU   2           HG1      GLU   2  -8.702   3.535   6.692
   13    H    ALA   3           H        ALA   3  -5.617   3.927   2.867
   14    HA   ALA   3           HA       ALA   3  -5.588   1.620   1.144
   15    HB1  ALA   3           HB1      ALA   3  -3.603   3.896   1.425
   16    HB2  ALA   3           HB2      ALA   3  -4.921   3.820   0.257
   17    HB3  ALA   3           HB3      ALA   3  -3.587   2.673   0.156
   18    H    PHE   4           H        PHE   4  -4.682  -0.169   1.692
   19    HA   PHE   4           HA       PHE   4  -3.172  -0.345   4.150
   20    HB2  PHE   4           HB2      PHE   4  -4.133  -2.491   2.271
   21    HB3  PHE   4           HB1      PHE   4  -3.502  -2.757   3.886
   22    HD1  PHE   4           HD1      PHE   4  -4.839  -1.233   5.735
   23    HD2  PHE   4           HD2      PHE   4  -6.380  -2.590   2.014
   24    HE1  PHE   4           HE1      PHE   4  -7.134  -0.998   6.599
   25    HE2  PHE   4           HE2      PHE   4  -8.672  -2.355   2.870
   26    HZ   PHE   4           HZ       PHE   4  -9.057  -1.565   5.150
   27    H    CYS   5           H        CYS   5  -1.059  -0.835   4.262
   28    HA   CYS   5           HA       CYS   5   0.353  -0.758   1.712
   29    HB2  CYS   5           HB2      CYS   5   1.311  -0.047   4.482
   30    HB3  CYS   5           HB1      CYS   5   2.269   0.057   3.010
   31    H    TYR   6           H        TYR   6   1.279  -2.470   1.064
   32    HA   TYR   6           HA       TYR   6   2.203  -4.517   2.974
   33    HB2  TYR   6           HB2      TYR   6   1.384  -4.956   0.102
   34    HB3  TYR   6           HB1      TYR   6   1.781  -6.181   1.281
   35    HD1  TYR   6           HD1      TYR   6  -0.815  -3.814   0.209
   36    HD2  TYR   6           HD2      TYR   6   0.164  -6.924   2.933
   37    HE1  TYR   6           HE1      TYR   6  -3.150  -3.987   0.832
   38    HE2  TYR   6           HE2      TYR   6  -2.188  -7.104   3.575
   39    HH   TYR   6           HH       TYR   6  -4.721  -5.412   1.874
   40    H    SER   7           H        SER   7   4.252  -4.553   3.045
   41    HA   SER   7           HA       SER   7   5.861  -2.998   1.317
   42    HB2  SER   7           HB2      SER   7   7.718  -4.085   2.651
   43    HB3  SER   7           HB1      SER   7   6.422  -3.309   3.586
   44    HG   SER   7           HG       SER   7   7.251  -5.688   3.910
   45    H    ASP   8           H        ASP   8   4.980  -6.280   1.523
   46    HA   ASP   8           HA       ASP   8   6.759  -7.226  -0.493
   47    HB2  ASP   8           HB2      ASP   8   6.114  -8.794   1.149
   48    HB3  ASP   8           HB1      ASP   8   4.405  -8.451   0.904
   49    H    ARG   9           H        ARG   9   6.300  -7.811  -2.548
   50    HA   ARG   9           HA       ARG   9   4.446  -6.083  -3.894
   51    HB2  ARG   9           HB2      ARG   9   6.488  -8.060  -4.876
   52    HB3  ARG   9           HB1      ARG   9   5.380  -7.258  -5.972
   53    HG2  ARG   9           HG2      ARG   9   7.518  -6.148  -5.984
   54    HG3  ARG   9           HG1      ARG   9   6.305  -5.080  -5.294
   55    HD2  ARG   9           HD2      ARG   9   8.398  -4.954  -4.041
   56    HD3  ARG   9           HD1      ARG   9   7.118  -5.641  -3.041
   57    HE   ARG   9           HE       ARG   9   8.724  -7.585  -4.412
   58   HH11  ARG   9          HH11      ARG   9   8.376  -5.704  -1.408
   59   HH12  ARG   9          HH12      ARG   9   9.423  -6.687  -0.520
   60   HH21  ARG   9          HH21      ARG   9  10.156  -8.928  -3.185
   61   HH22  ARG   9          HH22      ARG   9  10.485  -8.578  -1.566
   62    H    PHE  10           H        PHE  10   4.240  -9.224  -2.651
   63    HA   PHE  10           HA       PHE  10   2.220 -10.034  -4.581
   64    HB2  PHE  10           HB2      PHE  10   3.615 -11.579  -2.388
   65    HB3  PHE  10           HB1      PHE  10   2.410 -12.247  -3.478
   66    HD1  PHE  10           HD1      PHE  10   5.838 -11.037  -3.161
   67    HD2  PHE  10           HD2      PHE  10   2.939 -12.733  -5.765
   68    HE1  PHE  10           HE1      PHE  10   7.602 -11.572  -4.773
   69    HE2  PHE  10           HE2      PHE  10   4.699 -13.273  -7.383
   70    HZ   PHE  10           HZ       PHE  10   7.038 -12.695  -6.892
   71    H    CYS  11           H        CYS  11   2.235  -8.103  -2.092
   72    HA   CYS  11           HA       CYS  11   0.619  -7.262  -0.703
   73    HB2  CYS  11           HB2      CYS  11  -1.167  -9.445  -1.796
   74    HB3  CYS  11           HB1      CYS  11  -1.668  -8.012  -0.913
   75    H    GLN  12           H        GLN  12   2.347  -9.788  -0.053
   76    HA   GLN  12           HA       GLN  12   0.578 -11.056   1.857
   77    HB2  GLN  12           HB2      GLN  12   3.379 -11.773   1.018
   78    HB3  GLN  12           HB1      GLN  12   2.405 -12.693   2.155
   79    HG2  GLN  12           HG2      GLN  12   1.713 -12.177  -0.732
   80    HG3  GLN  12           HG1      GLN  12   2.375 -13.674  -0.084
   81   HE21  GLN  12          1HE2      GLN  12   0.765 -13.622   2.340
   82   HE22  GLN  12          2HE2      GLN  12  -0.845 -14.003   1.840
   83    H    ASN  13           H        ASN  13   2.529  -8.387   2.040
   84    HA   ASN  13           HA       ASN  13   3.081  -9.038   4.858
   85    HB2  ASN  13           HB2      ASN  13   4.933  -7.508   3.026
   86    HB3  ASN  13           HB1      ASN  13   5.060  -7.437   4.772
   87   HD21  ASN  13          HD21      ASN  13   7.081  -8.318   4.824
   88   HD22  ASN  13          HD22      ASN  13   7.387  -9.980   4.477
   89    H    TYR  14           H        TYR  14   1.261  -8.111   5.573
   90    HA   TYR  14           HA       TYR  14   0.551  -5.423   4.933
   91    HB2  TYR  14           HB2      TYR  14  -1.144  -7.101   5.562
   92    HB3  TYR  14           HB1      TYR  14  -0.413  -7.249   7.153
   93    HD1  TYR  14           HD1      TYR  14  -2.230  -4.919   4.913
   94    HD2  TYR  14           HD2      TYR  14  -1.014  -5.753   8.902
   95    HE1  TYR  14           HE1      TYR  14  -3.699  -3.145   5.734
   96    HE2  TYR  14           HE2      TYR  14  -2.491  -3.974   9.727
   97    HH   TYR  14           HH       TYR  14  -4.877  -2.572   7.815
   98    H    ILE  15           H        ILE  15   1.725  -3.750   5.665
   99    HA   ILE  15           HA       ILE  15   3.003  -4.024   8.300
  100    HB   ILE  15           HB       ILE  15   4.468  -2.132   7.672
  101   HG12  ILE  15          HG12      ILE  15   3.155  -2.345   4.944
  102   HG13  ILE  15          HG11      ILE  15   2.919  -1.025   6.080
  103   HG21  ILE  15          HG21      ILE  15   4.473  -4.421   5.711
  104   HG22  ILE  15          HG22      ILE  15   5.242  -4.394   7.299
  105   HG23  ILE  15          HG23      ILE  15   5.829  -3.336   6.016
  106   HD11  ILE  15          HD11      ILE  15   5.516  -1.763   4.747
  107   HD12  ILE  15          HD12      ILE  15   5.274  -0.426   5.869
  108   HD13  ILE  15          HD13      ILE  15   4.464  -0.421   4.304
  109    H    GLY  16           H        GLY  16   0.266  -2.881   7.099
  110    HA2  GLY  16           HA2      GLY  16  -1.146  -1.738   8.756
  111    HA3  GLY  16           HA1      GLY  16   0.196  -0.613   8.972
  112    H    SER  17           H        SER  17  -1.082   1.150   8.357
  113    HA   SER  17           HA       SER  17  -1.290   1.426   5.483
  114    HB2  SER  17           HB2      SER  17  -3.561   2.469   5.804
  115    HB3  SER  17           HB1      SER  17  -3.522   0.730   6.100
  116    HG   SER  17           HG       SER  17  -3.052   2.459   8.233
  117    H    ILE  18           H        ILE  18  -0.482   3.381   4.953
  118    HA   ILE  18           HA       ILE  18  -0.499   5.478   6.953
  119    HB   ILE  18           HB       ILE  18   1.853   6.091   6.210
  120   HG12  ILE  18          HG12      ILE  18   1.790   3.253   5.159
  121   HG13  ILE  18          HG11      ILE  18   1.999   4.724   4.222
  122   HG21  ILE  18          HG21      ILE  18   2.954   4.538   7.777
  123   HG22  ILE  18          HG22      ILE  18   1.488   3.557   7.801
  124   HG23  ILE  18          HG23      ILE  18   1.453   5.208   8.418
  125   HD11  ILE  18          HD11      ILE  18   4.160   5.093   5.278
  126   HD12  ILE  18          HD12      ILE  18   4.087   3.500   4.518
  127   HD13  ILE  18          HD13      ILE  18   3.915   3.652   6.267
  128    HA   PRO  19           HA       PRO  19  -2.057   7.977   3.644
  129    HB2  PRO  19           HB2      PRO  19  -0.288  10.041   4.881
  130    HB3  PRO  19           HB1      PRO  19  -1.989  10.161   4.412
  131    HG2  PRO  19           HG2      PRO  19  -1.379   9.869   6.953
  132    HG3  PRO  19           HG1      PRO  19  -2.716   8.933   6.259
  133    HD2  PRO  19           HD2      PRO  19   0.053   8.040   6.952
  134    HD3  PRO  19           HD1      PRO  19  -1.490   7.187   7.133
  135    H    ASP  20           H        ASP  20   1.405   8.389   4.386
  136    HA   ASP  20           HA       ASP  20   1.896   8.946   1.555
  137    HB2  ASP  20           HB2      ASP  20   3.803   9.046   3.909
  138    HB3  ASP  20           HB1      ASP  20   4.229   9.470   2.262
  139    H    CYS  21           H        CYS  21   1.094   6.599   1.485
  140    HA   CYS  21           HA       CYS  21   2.759   4.471   2.376
  141    HB2  CYS  21           HB2      CYS  21   0.271   4.365   1.830
  142    HB3  CYS  21           HB1      CYS  21   0.738   4.327   0.135
  143    H    CYS  22           H        CYS  22   2.605   6.323  -0.598
  144    HA   CYS  22           HA       CYS  22   4.406   4.480  -1.894
  145    HB2  CYS  22           HB2      CYS  22   3.067   6.971  -2.901
  146    HB3  CYS  22           HB1      CYS  22   4.223   6.045  -3.855
  147    H    PHE  23           H        PHE  23   4.979   6.716   0.299
  148    HA   PHE  23           HA       PHE  23   7.446   7.617  -0.973
  149    HB2  PHE  23           HB2      PHE  23   5.991   8.580   1.487
  150    HB3  PHE  23           HB1      PHE  23   7.632   9.094   1.105
  151    HD1  PHE  23           HD1      PHE  23   8.083  10.512  -0.813
  152    HD2  PHE  23           HD2      PHE  23   4.095   9.387   0.182
  153    HE1  PHE  23           HE1      PHE  23   7.218  12.274  -2.288
  154    HE2  PHE  23           HE2      PHE  23   3.234  11.143  -1.289
  155    HZ   PHE  23           HZ       PHE  23   4.791  12.591  -2.528
  156    H    GLY  24           H        GLY  24   6.772   4.971  -0.029
  157    HA2  GLY  24           HA2      GLY  24   9.259   4.365   1.227
  158    HA3  GLY  24           HA1      GLY  24   7.802   3.883   2.113
  159    H    ARG  25           H        ARG  25   9.445   1.928   1.109
  160    HA   ARG  25           HA       ARG  25   8.492   1.062  -1.457
  161    HB2  ARG  25           HB2      ARG  25  10.185  -0.249   0.662
  162    HB3  ARG  25           HB1      ARG  25   9.719  -1.069  -0.818
  163    HG2  ARG  25           HG2      ARG  25  11.220   1.534  -0.768
  164    HG3  ARG  25           HG1      ARG  25  12.000  -0.047  -0.846
  165    HD2  ARG  25           HD2      ARG  25  10.009   1.038  -2.847
  166    HD3  ARG  25           HD1      ARG  25  11.755   0.949  -3.072
  167    HE   ARG  25           HE       ARG  25  11.142  -1.582  -2.498
  168   HH11  ARG  25          HH11      ARG  25   9.680   0.654  -4.817
  169   HH12  ARG  25          HH12      ARG  25   9.303  -0.544  -5.962
  170   HH21  ARG  25          HH21      ARG  25  10.598  -3.267  -4.092
  171   HH22  ARG  25          HH22      ARG  25   9.841  -2.810  -5.542
  172    H    GLY  26           H        GLY  26   6.496   0.369  -1.693
  173    HA2  GLY  26           HA2      GLY  26   5.554  -1.894  -0.380
  174    HA3  GLY  26           HA1      GLY  26   4.843  -0.472   0.377
  175    H    SER  27           H        SER  27   3.325  -2.305  -0.776
  176    HA   SER  27           HA       SER  27   2.335  -1.100  -3.260
  177    HB2  SER  27           HB2      SER  27   1.670  -3.817  -2.101
  178    HB3  SER  27           HB1      SER  27   1.453  -3.255  -3.759
  179    HG   SER  27           HG       SER  27   3.540  -4.464  -2.615
  180    H    TYR  28           H        TYR  28   0.056  -0.630  -3.187
  181    HA   TYR  28           HA       TYR  28  -1.132  -0.883  -0.524
  182    HB2  TYR  28           HB2      TYR  28  -2.071   1.331  -0.555
  183    HB3  TYR  28           HB1      TYR  28  -0.345   1.453  -0.812
  184    HD1  TYR  28           HD1      TYR  28  -3.647   2.122  -2.176
  185    HD2  TYR  28           HD2      TYR  28   0.511   2.078  -3.092
  186    HE1  TYR  28           HE1      TYR  28  -4.069   3.546  -4.125
  187    HE2  TYR  28           HE2      TYR  28   0.104   3.495  -5.033
  188    HH   TYR  28           HH       TYR  28  -2.802   5.152  -5.526
  189    H    SER  29           H        SER  29  -3.293  -1.170  -0.388
  190    HA   SER  29           HA       SER  29  -4.875  -1.217  -2.807
  191    HB2  SER  29           HB2      SER  29  -5.704  -3.497  -2.276
  192    HB3  SER  29           HB1      SER  29  -3.992  -3.488  -2.700
  193    HG   SER  29           HG       SER  29  -5.162  -4.280  -0.380
  194    H    PHE  30           H        PHE  30  -7.226  -1.743  -2.097
  195    HA   PHE  30           HA       PHE  30  -7.646  -0.396   0.463
  196    HB2  PHE  30           HB2      PHE  30  -9.451  -0.529  -1.968
  197    HB3  PHE  30           HB1      PHE  30  -9.806   0.337  -0.474
  198    HD1  PHE  30           HD1      PHE  30  -8.362   2.263   0.195
  199    HD2  PHE  30           HD2      PHE  30  -8.072   0.446  -3.642
  200    HE1  PHE  30           HE1      PHE  30  -7.161   4.236  -0.647
  201    HE2  PHE  30           HE2      PHE  30  -6.868   2.417  -4.487
  202    HZ   PHE  30           HZ       PHE  30  -6.412   4.314  -2.991
  203    H    GLU  31           H        GLU  31  -7.261  -3.256  -0.357
  204    HA   GLU  31           HA       GLU  31  -9.477  -4.350   1.203
  205    HB2  GLU  31           HB2      GLU  31  -9.931  -4.852  -1.173
  206    HB3  GLU  31           HB1      GLU  31  -8.338  -5.564  -1.340
  207    HG2  GLU  31           HG2      GLU  31 -10.057  -7.277  -1.163
  208    HG3  GLU  31           HG1      GLU  31  -8.959  -7.337   0.212
  209    H    LEU  32           H        LEU  32  -8.918  -6.229   2.374
  210    HA   LEU  32           HA       LEU  32  -6.151  -6.233   3.228
  211    HB2  LEU  32           HB2      LEU  32  -8.538  -7.754   4.263
  212    HB3  LEU  32           HB1      LEU  32  -6.942  -7.792   4.980
  213    HG   LEU  32           HG       LEU  32  -8.727  -5.365   4.790
  214   HD11  LEU  32          HD11      LEU  32  -7.914  -7.041   7.151
  215   HD12  LEU  32          HD12      LEU  32  -9.506  -7.035   6.394
  216   HD13  LEU  32          HD13      LEU  32  -8.906  -5.585   7.203
  217   HD21  LEU  32          HD21      LEU  32  -6.361  -4.768   4.661
  218   HD22  LEU  32          HD22      LEU  32  -6.035  -5.721   6.109
  219   HD23  LEU  32          HD23      LEU  32  -7.060  -4.290   6.203
  220    H    GLN  33           H        GLN  33  -4.724  -7.463   2.478
  221    HA   GLN  33           HA       GLN  33  -3.636  -8.925   1.222
  222    HB2  GLN  33           HB2      GLN  33  -5.417 -10.895   2.665
  223    HB3  GLN  33           HB1      GLN  33  -4.019 -11.350   1.716
  224    HG2  GLN  33           HG2      GLN  33  -3.346 -11.419   3.974
  225    HG3  GLN  33           HG1      GLN  33  -2.635  -9.957   3.305
  226   HE21  GLN  33          1HE2      GLN  33  -5.063 -11.252   5.413
  227   HE22  GLN  33          2HE2      GLN  33  -5.378  -9.807   6.289
  228    HA   PRO  34           HA       PRO  34  -6.503  -9.694  -2.242
  229    HB2  PRO  34           HB2      PRO  34  -5.297  -7.583  -3.721
  230    HB3  PRO  34           HB1      PRO  34  -6.925  -7.586  -3.035
  231    HG2  PRO  34           HG2      PRO  34  -4.863  -5.920  -2.233
  232    HG3  PRO  34           HG1      PRO  34  -6.279  -6.321  -1.249
  233    HD2  PRO  34           HD2      PRO  34  -3.524  -7.477  -1.164
  234    HD3  PRO  34           HD1      PRO  34  -4.624  -7.076   0.172
  235    HA   PRO  35           HA       PRO  35  -3.211 -11.652  -4.571
  236    HB2  PRO  35           HB2      PRO  35  -4.083 -11.303  -7.187
  237    HB3  PRO  35           HB1      PRO  35  -4.613 -12.604  -6.123
  238    HG2  PRO  35           HG2      PRO  35  -5.979 -10.068  -6.844
  239    HG3  PRO  35           HG1      PRO  35  -6.670 -11.660  -6.501
  240    HD2  PRO  35           HD2      PRO  35  -6.720  -9.593  -4.729
  241    HD3  PRO  35           HD1      PRO  35  -6.702 -11.297  -4.240
  242    HA   PRO  36           HA       PRO  36   0.040  -8.780  -5.240
  243    HB2  PRO  36           HB2      PRO  36   0.563  -9.804  -7.922
  244    HB3  PRO  36           HB1      PRO  36   1.587  -9.863  -6.494
  245    HG2  PRO  36           HG2      PRO  36  -0.134 -11.914  -7.583
  246    HG3  PRO  36           HG1      PRO  36   0.993 -12.033  -6.228
  247    HD2  PRO  36           HD2      PRO  36  -1.727 -12.191  -6.005
  248    HD3  PRO  36           HD1      PRO  36  -0.660 -11.670  -4.681
  249    H    TRP  37           H        TRP  37  -1.700  -9.228  -8.268
  250    HA   TRP  37           HA       TRP  37  -0.937  -6.767  -9.414
  251    HB2  TRP  37           HB2      TRP  37  -2.770  -7.312 -11.092
  252    HB3  TRP  37           HB1      TRP  37  -1.457  -8.473 -10.924
  253    HD1  TRP  37           HD       TRP  37  -5.193  -8.054 -10.034
  254    HE1  TRP  37           HE1      TRP  37  -6.177 -10.382  -9.621
  255    HE3  TRP  37          3HE       TRP  37  -0.898 -10.816 -10.287
  256    HZ2  TRP  37           HZ2      TRP  37  -5.272 -13.045  -9.434
  257    HZ3  TRP  37           HZ3      TRP  37  -1.051 -13.251  -9.966
  258    HH2  TRP  37           HH       TRP  37  -3.193 -14.338  -9.552
  259    H    GLU  38           H        GLU  38  -3.399  -7.441  -7.141
  260    HA   GLU  38           HA       GLU  38  -5.062  -5.210  -7.929
  261    HB2  GLU  38           HB2      GLU  38  -5.188  -7.113  -5.606
  262    HB3  GLU  38           HB1      GLU  38  -6.399  -5.873  -5.928
  263    HG2  GLU  38           HG2      GLU  38  -5.678  -8.124  -7.790
  264    HG3  GLU  38           HG1      GLU  38  -7.051  -8.151  -6.693
  265    H    CYS  39           H        CYS  39  -2.340  -5.754  -5.973
  266    HA   CYS  39           HA       CYS  39  -2.787  -3.357  -4.386
  267    HB2  CYS  39           HB2      CYS  39  -0.406  -5.228  -4.509
  268    HB3  CYS  39           HB1      CYS  39  -0.561  -3.849  -3.433
  269    H    TYR  40           H        TYR  40  -2.023  -1.466  -4.983
  270    HA   TYR  40           HA       TYR  40  -0.681  -1.233  -7.515
  271    HB2  TYR  40           HB2      TYR  40  -1.444   0.903  -5.512
  272    HB3  TYR  40           HB1      TYR  40  -0.972   1.168  -7.182
  273    HD1  TYR  40           HD1      TYR  40  -2.490   0.235  -9.008
  274    HD2  TYR  40           HD2      TYR  40  -3.672   0.541  -4.941
  275    HE1  TYR  40           HE1      TYR  40  -4.839   0.097  -9.688
  276    HE2  TYR  40           HE2      TYR  40  -6.018   0.402  -5.597
  277    HH   TYR  40           HH       TYR  40  -7.403   0.850  -7.634
  278    H    GLN  41           H        GLN  41   1.392  -1.567  -7.532
  279    HA   GLN  41           HA       GLN  41   3.053  -1.352  -5.208
  280    HB2  GLN  41           HB2      GLN  41   3.788  -1.822  -8.103
  281    HB3  GLN  41           HB1      GLN  41   4.844  -2.065  -6.718
  282    HG2  GLN  41           HG2      GLN  41   3.464  -3.863  -5.918
  283    HG3  GLN  41           HG1      GLN  41   2.277  -3.564  -7.183
  284   HE21  GLN  41          1HE2      GLN  41   3.695  -6.002  -6.622
  285   HE22  GLN  41          2HE2      GLN  41   4.621  -6.395  -8.027
  286    H    CYS  42           H        CYS  42   3.740   0.552  -4.504
  287    HA   CYS  42           HA       CYS  42   3.673   2.901  -6.019
  288    HB2  CYS  42           HB2      CYS  42   5.115   2.299  -3.434
  289    HB3  CYS  42           HB1      CYS  42   4.866   3.909  -4.103
  Start of MODEL   10
    1    H    PCA   1           H        PGL   1 -11.086   2.340   1.058
    2    HA   PCA   1           HA       PGL   1 -11.086   4.847   0.874
    3    HB2  PCA   1           HB1      PGL   1 -12.524   5.680   2.423
    4    HB3  PCA   1           HB2      PGL   1 -11.172   5.560   3.586
    5    HG2  PCA   1           HG1      PGL   1 -13.597   4.041   3.603
    6    HG3  PCA   1           HG2      PGL   1 -12.140   3.781   4.623
    7    H    GLU   2           H        GLU   2  -9.639   2.679   3.091
    8    HA   GLU   2           HA       GLU   2  -7.365   4.432   3.568
    9    HB2  GLU   2           HB2      GLU   2  -8.168   1.797   4.793
   10    HB3  GLU   2           HB1      GLU   2  -6.735   2.716   5.230
   11    HG2  GLU   2           HG2      GLU   2  -9.570   3.680   5.516
   12    HG3  GLU   2           HG1      GLU   2  -8.578   3.023   6.818
   13    H    ALA   3           H        ALA   3  -5.373   3.946   2.825
   14    HA   ALA   3           HA       ALA   3  -5.173   1.778   0.916
   15    HB1  ALA   3           HB1      ALA   3  -3.212   3.949   1.689
   16    HB2  ALA   3           HB2      ALA   3  -4.292   3.981   0.296
   17    HB3  ALA   3           HB3      ALA   3  -2.993   2.795   0.375
   18    H    PHE   4           H        PHE   4  -4.498  -0.107   1.589
   19    HA   PHE   4           HA       PHE   4  -3.203  -0.348   4.176
   20    HB2  PHE   4           HB2      PHE   4  -4.128  -2.506   2.262
   21    HB3  PHE   4           HB1      PHE   4  -3.643  -2.745   3.934
   22    HD1  PHE   4           HD1      PHE   4  -5.065  -1.380   5.708
   23    HD2  PHE   4           HD2      PHE   4  -6.343  -2.277   1.761
   24    HE1  PHE   4           HE1      PHE   4  -7.406  -1.046   6.387
   25    HE2  PHE   4           HE2      PHE   4  -8.680  -1.947   2.440
   26    HZ   PHE   4           HZ       PHE   4  -9.216  -1.333   4.740
   27    H    CYS   5           H        CYS   5  -1.086  -0.681   4.372
   28    HA   CYS   5           HA       CYS   5   0.456  -0.659   1.915
   29    HB2  CYS   5           HB2      CYS   5   1.283  -0.135   4.754
   30    HB3  CYS   5           HB1      CYS   5   2.281   0.083   3.320
   31    H    TYR   6           H        TYR   6   1.614  -2.252   1.285
   32    HA   TYR   6           HA       TYR   6   2.376  -4.368   3.164
   33    HB2  TYR   6           HB2      TYR   6   1.812  -4.813   0.192
   34    HB3  TYR   6           HB1      TYR   6   2.161  -6.001   1.419
   35    HD1  TYR   6           HD1      TYR   6  -0.395  -3.591   0.311
   36    HD2  TYR   6           HD2      TYR   6   0.455  -6.947   2.764
   37    HE1  TYR   6           HE1      TYR   6  -2.753  -3.842   0.766
   38    HE2  TYR   6           HE2      TYR   6  -1.936  -7.207   3.233
   39    HH   TYR   6           HH       TYR   6  -4.322  -5.354   1.521
   40    H    SER   7           H        SER   7   4.440  -4.891   3.168
   41    HA   SER   7           HA       SER   7   6.279  -3.172   1.753
   42    HB2  SER   7           HB2      SER   7   7.890  -4.448   3.223
   43    HB3  SER   7           HB1      SER   7   6.601  -3.574   4.068
   44    HG   SER   7           HG       SER   7   6.707  -5.636   4.927
   45    H    ASP   8           H        ASP   8   4.612  -5.682   0.941
   46    HA   ASP   8           HA       ASP   8   6.674  -7.082  -0.592
   47    HB2  ASP   8           HB2      ASP   8   5.844  -8.501   1.165
   48    HB3  ASP   8           HB1      ASP   8   4.183  -8.097   0.758
   49    H    ARG   9           H        ARG   9   6.226  -7.332  -2.746
   50    HA   ARG   9           HA       ARG   9   4.064  -5.737  -3.742
   51    HB2  ARG   9           HB2      ARG   9   6.391  -7.032  -5.077
   52    HB3  ARG   9           HB1      ARG   9   5.087  -6.277  -5.993
   53    HG2  ARG   9           HG2      ARG   9   5.462  -4.199  -4.729
   54    HG3  ARG   9           HG1      ARG   9   6.853  -4.956  -3.950
   55    HD2  ARG   9           HD2      ARG   9   7.921  -5.217  -6.103
   56    HD3  ARG   9           HD1      ARG   9   6.486  -4.546  -6.893
   57    HE   ARG   9           HE       ARG   9   7.303  -2.700  -5.026
   58   HH11  ARG   9          HH11      ARG   9   8.603  -4.067  -8.021
   59   HH12  ARG   9          HH12      ARG   9   9.570  -2.711  -8.397
   60   HH21  ARG   9          HH21      ARG   9   8.584  -0.816  -5.581
   61   HH22  ARG   9          HH22      ARG   9   9.559  -0.831  -6.977
   62    H    PHE  10           H        PHE  10   4.126  -8.865  -2.790
   63    HA   PHE  10           HA       PHE  10   2.259  -9.626  -4.866
   64    HB2  PHE  10           HB2      PHE  10   3.544 -11.276  -2.679
   65    HB3  PHE  10           HB1      PHE  10   2.386 -11.891  -3.847
   66    HD1  PHE  10           HD1      PHE  10   3.022 -11.982  -6.263
   67    HD2  PHE  10           HD2      PHE  10   5.819 -11.073  -3.188
   68    HE1  PHE  10           HE1      PHE  10   4.861 -12.544  -7.780
   69    HE2  PHE  10           HE2      PHE  10   7.669 -11.633  -4.707
   70    HZ   PHE  10           HZ       PHE  10   7.189 -12.374  -7.010
   71    H    CYS  11           H        CYS  11   2.246  -7.879  -2.247
   72    HA   CYS  11           HA       CYS  11   0.618  -7.051  -0.871
   73    HB2  CYS  11           HB2      CYS  11  -1.250  -9.084  -2.123
   74    HB3  CYS  11           HB1      CYS  11  -1.672  -7.632  -1.221
   75    H    GLN  12           H        GLN  12   2.282  -9.538  -0.319
   76    HA   GLN  12           HA       GLN  12   0.521 -11.080   1.361
   77    HB2  GLN  12           HB2      GLN  12   3.418 -11.398   0.657
   78    HB3  GLN  12           HB1      GLN  12   2.532 -12.485   1.721
   79    HG2  GLN  12           HG2      GLN  12   1.022 -13.069  -0.067
   80    HG3  GLN  12           HG1      GLN  12   1.790 -11.900  -1.134
   81   HE21  GLN  12          1HE2      GLN  12   3.660 -13.864   1.040
   82   HE22  GLN  12          2HE2      GLN  12   4.363 -14.863  -0.157
   83    H    ASN  13           H        ASN  13   2.680  -8.418   1.895
   84    HA   ASN  13           HA       ASN  13   2.785  -9.257   4.724
   85    HB2  ASN  13           HB2      ASN  13   4.897  -7.625   3.299
   86    HB3  ASN  13           HB1      ASN  13   4.899  -8.004   5.010
   87   HD21  ASN  13          HD21      ASN  13   6.915  -8.587   3.131
   88   HD22  ASN  13          HD22      ASN  13   7.104 -10.298   3.070
   89    H    TYR  14           H        TYR  14   1.055  -8.193   5.458
   90    HA   TYR  14           HA       TYR  14   0.549  -5.440   4.855
   91    HB2  TYR  14           HB2      TYR  14  -1.328  -6.917   5.333
   92    HB3  TYR  14           HB1      TYR  14  -0.651  -7.329   6.902
   93    HD1  TYR  14           HD1      TYR  14  -1.031  -5.954   8.797
   94    HD2  TYR  14           HD2      TYR  14  -2.231  -4.602   4.949
   95    HE1  TYR  14           HE1      TYR  14  -2.262  -4.124   9.837
   96    HE2  TYR  14           HE2      TYR  14  -3.472  -2.759   5.990
   97    HH   TYR  14           HH       TYR  14  -4.501  -2.220   8.210
   98    H    ILE  15           H        ILE  15   1.561  -3.795   5.758
   99    HA   ILE  15           HA       ILE  15   2.864  -4.261   8.346
  100    HB   ILE  15           HB       ILE  15   4.317  -2.304   7.843
  101   HG12  ILE  15          HG12      ILE  15   3.047  -2.457   5.094
  102   HG13  ILE  15          HG11      ILE  15   2.820  -1.155   6.253
  103   HG21  ILE  15          HG21      ILE  15   4.387  -4.536   5.825
  104   HG22  ILE  15          HG22      ILE  15   5.090  -4.560   7.440
  105   HG23  ILE  15          HG23      ILE  15   5.732  -3.463   6.218
  106   HD11  ILE  15          HD11      ILE  15   4.387  -0.536   4.505
  107   HD12  ILE  15          HD12      ILE  15   5.416  -1.905   4.926
  108   HD13  ILE  15          HD13      ILE  15   5.184  -0.588   6.077
  109    H    GLY  16           H        GLY  16   0.332  -2.526   6.901
  110    HA2  GLY  16           HA2      GLY  16  -1.047  -1.686   8.948
  111    HA3  GLY  16           HA1      GLY  16   0.271  -0.514   9.007
  112    H    SER  17           H        SER  17  -1.858   0.814   8.643
  113    HA   SER  17           HA       SER  17  -1.939   1.310   5.771
  114    HB2  SER  17           HB2      SER  17  -4.364   2.060   6.205
  115    HB3  SER  17           HB1      SER  17  -4.056   0.326   6.215
  116    HG   SER  17           HG       SER  17  -4.756   2.044   8.290
  117    H    ILE  18           H        ILE  18  -1.516   3.372   5.226
  118    HA   ILE  18           HA       ILE  18  -1.733   5.507   7.153
  119    HB   ILE  18           HB       ILE  18   0.663   6.241   6.657
  120   HG12  ILE  18          HG12      ILE  18   0.945   3.351   5.799
  121   HG13  ILE  18          HG11      ILE  18   1.129   4.768   4.777
  122   HG21  ILE  18          HG21      ILE  18   1.692   4.886   8.423
  123   HG22  ILE  18          HG22      ILE  18   0.313   3.789   8.360
  124   HG23  ILE  18          HG23      ILE  18   0.083   5.465   8.854
  125   HD11  ILE  18          HD11      ILE  18   3.280   3.804   5.363
  126   HD12  ILE  18          HD12      ILE  18   2.909   3.996   7.077
  127   HD13  ILE  18          HD13      ILE  18   3.111   5.420   6.052
  128    HA   PRO  19           HA       PRO  19  -2.357   7.583   3.246
  129    HB2  PRO  19           HB2      PRO  19  -2.545  10.107   4.062
  130    HB3  PRO  19           HB1      PRO  19  -3.736   8.908   4.583
  131    HG2  PRO  19           HG2      PRO  19  -1.424  10.056   6.078
  132    HG3  PRO  19           HG1      PRO  19  -3.043   9.650   6.669
  133    HD2  PRO  19           HD2      PRO  19  -0.754   8.068   6.938
  134    HD3  PRO  19           HD1      PRO  19  -2.426   7.507   7.134
  135    H    ASP  20           H        ASP  20   0.411   7.378   4.646
  136    HA   ASP  20           HA       ASP  20   1.890   9.101   2.783
  137    HB2  ASP  20           HB2      ASP  20   3.631   9.346   4.569
  138    HB3  ASP  20           HB1      ASP  20   2.099  10.077   5.014
  139    H    CYS  21           H        CYS  21   1.009   6.613   2.287
  140    HA   CYS  21           HA       CYS  21   2.694   4.474   3.119
  141    HB2  CYS  21           HB2      CYS  21   0.249   4.387   2.418
  142    HB3  CYS  21           HB1      CYS  21   0.823   4.508   0.762
  143    H    CYS  22           H        CYS  22   2.951   6.831   0.606
  144    HA   CYS  22           HA       CYS  22   4.469   5.080  -1.137
  145    HB2  CYS  22           HB2      CYS  22   3.560   7.920  -1.497
  146    HB3  CYS  22           HB1      CYS  22   4.456   7.008  -2.699
  147    H    PHE  23           H        PHE  23   5.509   6.338   1.507
  148    HA   PHE  23           HA       PHE  23   7.893   7.516   0.326
  149    HB2  PHE  23           HB2      PHE  23   7.004   7.431   3.221
  150    HB3  PHE  23           HB1      PHE  23   8.537   8.103   2.687
  151    HD1  PHE  23           HD1      PHE  23   8.615  10.211   1.485
  152    HD2  PHE  23           HD2      PHE  23   4.915   8.587   2.814
  153    HE1  PHE  23           HE1      PHE  23   7.529  12.386   1.107
  154    HE2  PHE  23           HE2      PHE  23   3.820  10.759   2.435
  155    HZ   PHE  23           HZ       PHE  23   5.123  12.659   1.582
  156    H    GLY  24           H        GLY  24   8.435   5.450  -0.578
  157    HA2  GLY  24           HA2      GLY  24  10.543   4.172  -0.057
  158    HA3  GLY  24           HA1      GLY  24   9.659   3.606   1.360
  159    H    ARG  25           H        ARG  25  10.185   1.471   0.265
  160    HA   ARG  25           HA       ARG  25   8.648   0.789  -2.051
  161    HB2  ARG  25           HB2      ARG  25  10.689  -0.472  -1.567
  162    HB3  ARG  25           HB1      ARG  25  10.050  -0.946  -0.000
  163    HG2  ARG  25           HG2      ARG  25   8.311  -2.271  -1.090
  164    HG3  ARG  25           HG1      ARG  25   8.919  -1.779  -2.669
  165    HD2  ARG  25           HD2      ARG  25  10.532  -3.284  -0.617
  166    HD3  ARG  25           HD1      ARG  25   9.657  -4.053  -1.938
  167    HE   ARG  25           HE       ARG  25  11.208  -2.186  -3.145
  168   HH11  ARG  25          HH11      ARG  25  11.987  -4.838  -0.916
  169   HH12  ARG  25          HH12      ARG  25  13.475  -5.211  -1.643
  170   HH21  ARG  25          HH21      ARG  25  13.265  -2.726  -4.162
  171   HH22  ARG  25          HH22      ARG  25  14.223  -3.981  -3.520
  172    H    GLY  26           H        GLY  26   6.494   0.710  -1.969
  173    HA2  GLY  26           HA2      GLY  26   5.243  -0.782   0.143
  174    HA3  GLY  26           HA1      GLY  26   4.866   0.935   0.106
  175    H    SER  27           H        SER  27   3.667  -1.855  -0.647
  176    HA   SER  27           HA       SER  27   2.369  -1.021  -3.136
  177    HB2  SER  27           HB2      SER  27   2.122  -3.634  -1.625
  178    HB3  SER  27           HB1      SER  27   1.671  -3.311  -3.299
  179    HG   SER  27           HG       SER  27   3.839  -4.333  -2.515
  180    H    TYR  28           H        TYR  28   0.106  -0.659  -3.027
  181    HA   TYR  28           HA       TYR  28  -1.056  -0.986  -0.387
  182    HB2  TYR  28           HB2      TYR  28  -2.080   1.191  -0.371
  183    HB3  TYR  28           HB1      TYR  28  -0.346   1.377  -0.542
  184    HD1  TYR  28           HD1      TYR  28   0.594   2.139  -2.777
  185    HD2  TYR  28           HD2      TYR  28  -3.602   2.004  -2.009
  186    HE1  TYR  28           HE1      TYR  28   0.195   3.617  -4.675
  187    HE2  TYR  28           HE2      TYR  28  -4.002   3.476  -3.916
  188    HH   TYR  28           HH       TYR  28  -1.648   4.152  -6.232
  189    H    SER  29           H        SER  29  -3.142  -1.504  -0.320
  190    HA   SER  29           HA       SER  29  -4.617  -1.589  -2.835
  191    HB2  SER  29           HB2      SER  29  -5.445  -3.853  -2.209
  192    HB3  SER  29           HB1      SER  29  -3.702  -3.840  -2.481
  193    HG   SER  29           HG       SER  29  -5.131  -4.341  -0.178
  194    H    PHE  30           H        PHE  30  -6.992  -2.043  -2.288
  195    HA   PHE  30           HA       PHE  30  -7.620  -0.593   0.164
  196    HB2  PHE  30           HB2      PHE  30  -9.283  -0.950  -2.340
  197    HB3  PHE  30           HB1      PHE  30  -9.770  -0.030  -0.916
  198    HD1  PHE  30           HD1      PHE  30  -8.213   1.890  -0.184
  199    HD2  PHE  30           HD2      PHE  30  -8.110   0.110  -4.045
  200    HE1  PHE  30           HE1      PHE  30  -7.064   3.872  -1.061
  201    HE2  PHE  30           HE2      PHE  30  -6.954   2.100  -4.931
  202    HZ   PHE  30           HZ       PHE  30  -6.431   3.980  -3.436
  203    H    GLU  31           H        GLU  31  -7.211  -3.545  -0.641
  204    HA   GLU  31           HA       GLU  31  -9.351  -4.539   1.109
  205    HB2  GLU  31           HB2      GLU  31  -8.143  -5.910  -1.298
  206    HB3  GLU  31           HB1      GLU  31  -9.108  -6.746  -0.095
  207    HG2  GLU  31           HG2      GLU  31 -11.018  -5.329  -0.655
  208    HG3  GLU  31           HG1      GLU  31 -10.036  -4.496  -1.862
  209    H    LEU  32           H        LEU  32  -8.720  -6.184   2.535
  210    HA   LEU  32           HA       LEU  32  -5.949  -6.082   3.309
  211    HB2  LEU  32           HB2      LEU  32  -8.324  -7.500   4.507
  212    HB3  LEU  32           HB1      LEU  32  -6.702  -7.668   5.132
  213    HG   LEU  32           HG       LEU  32  -7.866  -6.190   6.535
  214   HD11  LEU  32          HD11      LEU  32  -6.035  -4.574   4.808
  215   HD12  LEU  32          HD12      LEU  32  -5.590  -5.596   6.173
  216   HD13  LEU  32          HD13      LEU  32  -6.568  -4.153   6.434
  217   HD21  LEU  32          HD21      LEU  32  -8.598  -4.560   4.105
  218   HD22  LEU  32          HD22      LEU  32  -8.911  -4.093   5.776
  219   HD23  LEU  32          HD23      LEU  32  -9.697  -5.519   5.098
  220    H    GLN  33           H        GLN  33  -4.556  -7.258   2.426
  221    HA   GLN  33           HA       GLN  33  -3.468  -8.805   1.289
  222    HB2  GLN  33           HB2      GLN  33  -4.982 -10.642   3.128
  223    HB3  GLN  33           HB1      GLN  33  -3.620 -11.142   2.139
  224    HG2  GLN  33           HG2      GLN  33  -2.181  -9.558   3.291
  225    HG3  GLN  33           HG1      GLN  33  -3.547  -9.017   4.267
  226   HE21  GLN  33          1HE2      GLN  33  -1.276 -11.567   3.686
  227   HE22  GLN  33          2HE2      GLN  33  -1.606 -12.433   5.138
  228    HA   PRO  34           HA       PRO  34  -6.426 -10.217  -1.821
  229    HB2  PRO  34           HB2      PRO  34  -6.186  -8.281  -3.638
  230    HB3  PRO  34           HB1      PRO  34  -7.163  -8.010  -2.192
  231    HG2  PRO  34           HG2      PRO  34  -4.438  -7.008  -2.847
  232    HG3  PRO  34           HG1      PRO  34  -5.737  -6.219  -1.939
  233    HD2  PRO  34           HD2      PRO  34  -3.529  -7.622  -0.857
  234    HD3  PRO  34           HD1      PRO  34  -4.953  -7.046   0.020
  235    HA   PRO  35           HA       PRO  35  -3.211 -11.975  -4.482
  236    HB2  PRO  35           HB2      PRO  35  -4.167 -11.408  -7.040
  237    HB3  PRO  35           HB1      PRO  35  -4.635 -12.808  -6.073
  238    HG2  PRO  35           HG2      PRO  35  -6.040 -10.206  -6.447
  239    HG3  PRO  35           HG1      PRO  35  -6.720 -11.836  -6.347
  240    HD2  PRO  35           HD2      PRO  35  -6.854 -10.164  -4.277
  241    HD3  PRO  35           HD1      PRO  35  -6.554 -11.895  -4.033
  242    HA   PRO  36           HA       PRO  36  -0.082  -8.991  -5.322
  243    HB2  PRO  36           HB2      PRO  36   0.763  -9.830  -7.871
  244    HB3  PRO  36           HB1      PRO  36   1.403 -10.394  -6.336
  245    HG2  PRO  36           HG2      PRO  36  -0.663 -11.622  -8.086
  246    HG3  PRO  36           HG1      PRO  36   0.588 -12.402  -7.102
  247    HD2  PRO  36           HD2      PRO  36  -1.931 -12.416  -6.310
  248    HD3  PRO  36           HD1      PRO  36  -0.632 -12.123  -5.127
  249    H    TRP  37           H        TRP  37  -2.180  -9.545  -8.091
  250    HA   TRP  37           HA       TRP  37  -1.409  -7.151  -9.409
  251    HB2  TRP  37           HB2      TRP  37  -3.300  -7.654 -10.965
  252    HB3  TRP  37           HB1      TRP  37  -2.112  -8.936 -10.797
  253    HD1  TRP  37           HD       TRP  37  -5.745  -8.079  -9.662
  254    HE1  TRP  37           HE1      TRP  37  -6.990 -10.301  -9.322
  255    HE3  TRP  37          3HE       TRP  37  -1.871 -11.381 -10.344
  256    HZ2  TRP  37           HZ2      TRP  37  -6.458 -13.028  -9.324
  257    HZ3  TRP  37           HZ3      TRP  37  -2.361 -13.791 -10.148
  258    HH2  TRP  37           HH       TRP  37  -4.602 -14.583  -9.648
  259    H    GLU  38           H        GLU  38  -3.499  -7.649  -6.827
  260    HA   GLU  38           HA       GLU  38  -5.339  -5.557  -7.576
  261    HB2  GLU  38           HB2      GLU  38  -5.155  -7.387  -5.223
  262    HB3  GLU  38           HB1      GLU  38  -6.371  -6.119  -5.350
  263    HG2  GLU  38           HG2      GLU  38  -5.966  -8.269  -7.399
  264    HG3  GLU  38           HG1      GLU  38  -7.141  -8.397  -6.098
  265    H    CYS  39           H        CYS  39  -2.348  -5.582  -6.193
  266    HA   CYS  39           HA       CYS  39  -2.934  -3.237  -4.560
  267    HB2  CYS  39           HB2      CYS  39  -0.379  -4.818  -4.838
  268    HB3  CYS  39           HB1      CYS  39  -0.572  -3.386  -3.836
  269    H    TYR  40           H        TYR  40  -2.134  -1.295  -4.989
  270    HA   TYR  40           HA       TYR  40  -0.971  -0.847  -7.628
  271    HB2  TYR  40           HB2      TYR  40  -1.935   1.162  -5.558
  272    HB3  TYR  40           HB1      TYR  40  -1.570   1.476  -7.248
  273    HD1  TYR  40           HD1      TYR  40  -3.154   0.812  -9.008
  274    HD2  TYR  40           HD2      TYR  40  -4.031   0.181  -4.893
  275    HE1  TYR  40           HE1      TYR  40  -5.510   0.440  -9.570
  276    HE2  TYR  40           HE2      TYR  40  -6.381  -0.199  -5.442
  277    HH   TYR  40           HH       TYR  40  -7.469  -0.751  -8.561
  278    H    GLN  41           H        GLN  41   1.004   0.579  -7.569
  279    HA   GLN  41           HA       GLN  41   2.359   0.217  -5.014
  280    HB2  GLN  41           HB2      GLN  41   4.446  -0.280  -6.232
  281    HB3  GLN  41           HB1      GLN  41   3.200  -1.488  -6.490
  282    HG2  GLN  41           HG2      GLN  41   2.688  -0.406  -8.661
  283    HG3  GLN  41           HG1      GLN  41   4.058   0.672  -8.394
  284   HE21  GLN  41          1HE2      GLN  41   6.126  -0.187  -8.412
  285   HE22  GLN  41          2HE2      GLN  41   6.489  -1.702  -9.151
  286    H    CYS  42           H        CYS  42   3.735   1.805  -4.381
  287    HA   CYS  42           HA       CYS  42   3.188   4.332  -5.595
  288    HB2  CYS  42           HB2      CYS  42   4.831   3.559  -3.187
  289    HB3  CYS  42           HB1      CYS  42   4.547   5.217  -3.705
  Start of MODEL   11
    1    H    PCA   1           H        PGL   1 -10.815   3.755   2.816
    2    HA   PCA   1           HA       PGL   1 -10.103   5.846   1.634
    3    HB2  PCA   1           HB1      PGL   1 -10.744   7.736   2.751
    4    HB3  PCA   1           HB2      PGL   1  -9.514   7.387   3.998
    5    HG2  PCA   1           HG1      PGL   1 -12.427   6.950   4.101
    6    HG3  PCA   1           HG2      PGL   1 -11.214   6.884   5.426
    7    H    GLU   2           H        GLU   2  -8.980   4.248   4.465
    8    HA   GLU   2           HA       GLU   2  -6.252   5.113   4.201
    9    HB2  GLU   2           HB2      GLU   2  -7.429   2.861   5.831
   10    HB3  GLU   2           HB1      GLU   2  -5.784   3.461   5.955
   11    HG2  GLU   2           HG2      GLU   2  -8.278   5.006   6.555
   12    HG3  GLU   2           HG1      GLU   2  -7.200   4.296   7.756
   13    H    ALA   3           H        ALA   3  -4.776   4.221   2.953
   14    HA   ALA   3           HA       ALA   3  -5.442   1.853   1.432
   15    HB1  ALA   3           HB1      ALA   3  -4.458   3.771   0.265
   16    HB2  ALA   3           HB2      ALA   3  -3.394   2.369   0.190
   17    HB3  ALA   3           HB3      ALA   3  -3.038   3.685   1.310
   18    H    PHE   4           H        PHE   4  -4.595  -0.076   1.851
   19    HA   PHE   4           HA       PHE   4  -3.098  -0.400   4.297
   20    HB2  PHE   4           HB2      PHE   4  -4.068  -2.463   2.310
   21    HB3  PHE   4           HB1      PHE   4  -3.457  -2.799   3.921
   22    HD1  PHE   4           HD1      PHE   4  -6.316  -2.328   1.973
   23    HD2  PHE   4           HD2      PHE   4  -4.807  -1.583   5.872
   24    HE1  PHE   4           HE1      PHE   4  -8.616  -2.135   2.828
   25    HE2  PHE   4           HE2      PHE   4  -7.090  -1.392   6.727
   26    HZ   PHE   4           HZ       PHE   4  -9.008  -1.672   5.199
   27    H    CYS   5           H        CYS   5  -0.975  -0.945   4.407
   28    HA   CYS   5           HA       CYS   5   0.452  -0.764   1.863
   29    HB2  CYS   5           HB2      CYS   5   1.351  -0.044   4.646
   30    HB3  CYS   5           HB1      CYS   5   2.352   0.053   3.201
   31    H    TYR   6           H        TYR   6   1.522  -2.385   1.178
   32    HA   TYR   6           HA       TYR   6   2.380  -4.502   3.036
   33    HB2  TYR   6           HB2      TYR   6   1.536  -4.905   0.167
   34    HB3  TYR   6           HB1      TYR   6   1.930  -6.138   1.324
   35    HD1  TYR   6           HD1      TYR   6  -0.653  -3.752   0.291
   36    HD2  TYR   6           HD2      TYR   6   0.337  -6.845   3.026
   37    HE1  TYR   6           HE1      TYR   6  -2.979  -3.889   0.954
   38    HE2  TYR   6           HE2      TYR   6  -1.998  -6.995   3.710
   39    HH   TYR   6           HH       TYR   6  -4.552  -5.263   2.046
   40    H    SER   7           H        SER   7   4.438  -4.522   3.083
   41    HA   SER   7           HA       SER   7   6.034  -3.351   0.952
   42    HB2  SER   7           HB2      SER   7   6.708  -4.510   3.638
   43    HB3  SER   7           HB1      SER   7   7.931  -3.811   2.552
   44    HG   SER   7           HG       SER   7   6.443  -1.946   2.544
   45    H    ASP   8           H        ASP   8   4.634  -5.476   0.177
   46    HA   ASP   8           HA       ASP   8   6.610  -7.384  -0.698
   47    HB2  ASP   8           HB2      ASP   8   5.746  -8.544   1.196
   48    HB3  ASP   8           HB1      ASP   8   4.099  -8.032   0.842
   49    H    ARG   9           H        ARG   9   6.147  -7.928  -2.796
   50    HA   ARG   9           HA       ARG   9   4.088  -6.329  -4.022
   51    HB2  ARG   9           HB2      ARG   9   6.151  -8.107  -5.274
   52    HB3  ARG   9           HB1      ARG   9   5.054  -7.047  -6.148
   53    HG2  ARG   9           HG2      ARG   9   6.022  -5.132  -4.838
   54    HG3  ARG   9           HG1      ARG   9   7.255  -6.263  -4.275
   55    HD2  ARG   9           HD2      ARG   9   6.635  -5.541  -7.105
   56    HD3  ARG   9           HD1      ARG   9   8.047  -5.004  -6.188
   57    HE   ARG   9           HE       ARG   9   7.668  -7.868  -6.487
   58   HH11  ARG   9          HH11      ARG   9   9.410  -4.992  -7.600
   59   HH12  ARG   9          HH12      ARG   9  10.638  -5.866  -8.383
   60   HH21  ARG   9          HH21      ARG   9   9.330  -9.073  -7.594
   61   HH22  ARG   9          HH22      ARG   9  10.575  -8.236  -8.403
   62    H    PHE  10           H        PHE  10   3.950  -9.273  -2.619
   63    HA   PHE  10           HA       PHE  10   2.071 -10.317  -4.580
   64    HB2  PHE  10           HB2      PHE  10   3.293 -11.641  -2.148
   65    HB3  PHE  10           HB1      PHE  10   2.211 -12.410  -3.298
   66    HD1  PHE  10           HD1      PHE  10   5.584 -11.697  -2.457
   67    HD2  PHE  10           HD2      PHE  10   3.017 -12.571  -5.726
   68    HE1  PHE  10           HE1      PHE  10   7.523 -12.410  -3.786
   69    HE2  PHE  10           HE2      PHE  10   4.955 -13.285  -7.056
   70    HZ   PHE  10           HZ       PHE  10   7.200 -13.210  -6.090
   71    H    CYS  11           H        CYS  11   2.131  -8.225  -2.180
   72    HA   CYS  11           HA       CYS  11   0.538  -7.193  -0.904
   73    HB2  CYS  11           HB2      CYS  11  -1.353  -9.252  -2.051
   74    HB3  CYS  11           HB1      CYS  11  -1.801  -7.797  -1.175
   75    H    GLN  12           H        GLN  12   2.047  -9.712  -0.042
   76    HA   GLN  12           HA       GLN  12   0.121 -10.812   1.848
   77    HB2  GLN  12           HB2      GLN  12   2.848 -11.765   1.031
   78    HB3  GLN  12           HB1      GLN  12   1.817 -12.566   2.210
   79    HG2  GLN  12           HG2      GLN  12   0.150 -13.004   0.537
   80    HG3  GLN  12           HG1      GLN  12   1.033 -12.051  -0.647
   81   HE21  GLN  12          1HE2      GLN  12   2.606 -14.262   1.584
   82   HE22  GLN  12          2HE2      GLN  12   3.072 -15.385   0.371
   83    H    ASN  13           H        ASN  13   2.562  -8.445   1.944
   84    HA   ASN  13           HA       ASN  13   2.966  -9.138   4.777
   85    HB2  ASN  13           HB2      ASN  13   4.972  -7.771   2.971
   86    HB3  ASN  13           HB1      ASN  13   5.134  -7.824   4.714
   87   HD21  ASN  13          HD21      ASN  13   7.042  -8.978   4.620
   88   HD22  ASN  13          HD22      ASN  13   7.131 -10.630   4.179
   89    H    TYR  14           H        TYR  14   1.411  -8.050   5.693
   90    HA   TYR  14           HA       TYR  14   0.787  -5.336   4.998
   91    HB2  TYR  14           HB2      TYR  14  -0.950  -6.969   5.618
   92    HB3  TYR  14           HB1      TYR  14  -0.214  -7.149   7.196
   93    HD1  TYR  14           HD1      TYR  14  -0.594  -5.500   8.936
   94    HD2  TYR  14           HD2      TYR  14  -2.205  -4.950   5.041
   95    HE1  TYR  14           HE1      TYR  14  -2.086  -3.766   9.807
   96    HE2  TYR  14           HE2      TYR  14  -3.678  -3.217   5.885
   97    HH   TYR  14           HH       TYR  14  -4.742  -2.676   8.193
   98    H    ILE  15           H        ILE  15   2.013  -3.720   5.760
   99    HA   ILE  15           HA       ILE  15   3.384  -4.110   8.319
  100    HB   ILE  15           HB       ILE  15   4.722  -2.106   7.781
  101   HG12  ILE  15          HG12      ILE  15   3.292  -2.119   5.105
  102   HG13  ILE  15          HG11      ILE  15   2.971  -0.970   6.395
  103   HG21  ILE  15          HG21      ILE  15   6.022  -3.072   5.929
  104   HG22  ILE  15          HG22      ILE  15   4.696  -4.186   5.599
  105   HG23  ILE  15          HG23      ILE  15   5.565  -4.281   7.130
  106   HD11  ILE  15          HD11      ILE  15   5.575  -1.295   4.922
  107   HD12  ILE  15          HD12      ILE  15   5.257  -0.131   6.209
  108   HD13  ILE  15          HD13      ILE  15   4.392  -0.011   4.676
  109    H    GLY  16           H        GLY  16   0.800  -2.416   6.870
  110    HA2  GLY  16           HA2      GLY  16  -0.527  -1.618   9.011
  111    HA3  GLY  16           HA1      GLY  16   0.659  -0.323   8.829
  112    H    SER  17           H        SER  17  -1.066   1.150   8.303
  113    HA   SER  17           HA       SER  17  -1.694   1.052   5.497
  114    HB2  SER  17           HB2      SER  17  -4.123   1.477   5.964
  115    HB3  SER  17           HB1      SER  17  -3.567  -0.140   6.402
  116    HG   SER  17           HG       SER  17  -3.770   2.034   8.196
  117    H    ILE  18           H        ILE  18  -1.531   3.035   4.680
  118    HA   ILE  18           HA       ILE  18  -2.178   5.357   6.212
  119    HB   ILE  18           HB       ILE  18   0.007   6.505   5.655
  120   HG12  ILE  18          HG12      ILE  18   0.990   3.704   5.092
  121   HG13  ILE  18          HG11      ILE  18   0.735   4.973   3.901
  122   HG21  ILE  18          HG21      ILE  18  -0.334   5.769   7.936
  123   HG22  ILE  18          HG22      ILE  18   1.354   5.544   7.476
  124   HG23  ILE  18          HG23      ILE  18   0.265   4.163   7.527
  125   HD11  ILE  18          HD11      ILE  18   2.719   5.071   6.161
  126   HD12  ILE  18          HD12      ILE  18   2.491   6.298   4.918
  127   HD13  ILE  18          HD13      ILE  18   3.100   4.700   4.480
  128    HA   PRO  19           HA       PRO  19  -3.535   6.398   2.072
  129    HB2  PRO  19           HB2      PRO  19  -3.200   9.222   2.917
  130    HB3  PRO  19           HB1      PRO  19  -4.642   8.402   2.311
  131    HG2  PRO  19           HG2      PRO  19  -4.433   9.055   4.887
  132    HG3  PRO  19           HG1      PRO  19  -5.184   7.530   4.386
  133    HD2  PRO  19           HD2      PRO  19  -2.444   8.016   5.489
  134    HD3  PRO  19           HD1      PRO  19  -3.604   6.707   5.827
  135    H    ASP  20           H        ASP  20  -0.945   8.143   3.604
  136    HA   ASP  20           HA       ASP  20   0.362   8.951   1.161
  137    HB2  ASP  20           HB2      ASP  20   1.977   9.984   2.788
  138    HB3  ASP  20           HB1      ASP  20   0.317  10.503   3.011
  139    H    CYS  21           H        CYS  21   0.148   6.347   1.121
  140    HA   CYS  21           HA       CYS  21   2.109   4.790   2.492
  141    HB2  CYS  21           HB2      CYS  21  -0.145   4.013   1.667
  142    HB3  CYS  21           HB1      CYS  21   0.541   3.994   0.049
  143    H    CYS  22           H        CYS  22   2.109   6.394  -0.637
  144    HA   CYS  22           HA       CYS  22   4.169   4.718  -1.640
  145    HB2  CYS  22           HB2      CYS  22   2.920   7.185  -2.795
  146    HB3  CYS  22           HB1      CYS  22   4.245   6.329  -3.583
  147    H    PHE  23           H        PHE  23   4.478   7.011   0.608
  148    HA   PHE  23           HA       PHE  23   7.056   7.933  -0.311
  149    HB2  PHE  23           HB2      PHE  23   5.699   8.219   2.382
  150    HB3  PHE  23           HB1      PHE  23   7.250   8.942   1.974
  151    HD1  PHE  23           HD1      PHE  23   7.348  10.684   0.189
  152    HD2  PHE  23           HD2      PHE  23   3.671   9.243   1.754
  153    HE1  PHE  23           HE1      PHE  23   6.200  12.664  -0.707
  154    HE2  PHE  23           HE2      PHE  23   2.510  11.225   0.857
  155    HZ   PHE  23           HZ       PHE  23   3.773  12.934  -0.372
  156    H    GLY  24           H        GLY  24   5.769   5.190   1.102
  157    HA2  GLY  24           HA2      GLY  24   8.395   4.322   2.076
  158    HA3  GLY  24           HA1      GLY  24   6.850   3.653   2.607
  159    H    ARG  25           H        ARG  25   9.022   2.185   1.454
  160    HA   ARG  25           HA       ARG  25   8.251   1.574  -1.237
  161    HB2  ARG  25           HB2      ARG  25  10.239   0.192   0.584
  162    HB3  ARG  25           HB1      ARG  25   9.983  -0.204  -1.109
  163    HG2  ARG  25           HG2      ARG  25  10.954   2.451  -0.064
  164    HG3  ARG  25           HG1      ARG  25  11.957   1.208  -0.814
  165    HD2  ARG  25           HD2      ARG  25  10.766   1.437  -2.898
  166    HD3  ARG  25           HD1      ARG  25   9.611   2.531  -2.162
  167    HE   ARG  25           HE       ARG  25  12.084   3.693  -1.854
  168   HH11  ARG  25          HH11      ARG  25  10.158   2.582  -4.614
  169   HH12  ARG  25          HH12      ARG  25  10.527   3.925  -5.584
  170   HH21  ARG  25          HH21      ARG  25  12.608   5.527  -3.240
  171   HH22  ARG  25          HH22      ARG  25  11.900   5.621  -4.799
  172    H    GLY  26           H        GLY  26   6.821   0.172  -1.934
  173    HA2  GLY  26           HA2      GLY  26   6.274  -2.312  -1.146
  174    HA3  GLY  26           HA1      GLY  26   5.366  -1.357   0.018
  175    H    SER  27           H        SER  27   3.531  -2.373  -0.846
  176    HA   SER  27           HA       SER  27   2.507  -1.208  -3.341
  177    HB2  SER  27           HB2      SER  27   1.711  -3.878  -2.170
  178    HB3  SER  27           HB1      SER  27   1.458  -3.274  -3.806
  179    HG   SER  27           HG       SER  27   3.524  -4.625  -2.746
  180    H    TYR  28           H        TYR  28   0.274  -0.594  -3.108
  181    HA   TYR  28           HA       TYR  28  -0.810  -0.896  -0.406
  182    HB2  TYR  28           HB2      TYR  28  -1.723   1.345  -0.403
  183    HB3  TYR  28           HB1      TYR  28  -0.004   1.452  -0.723
  184    HD1  TYR  28           HD1      TYR  28   0.781   2.036  -3.016
  185    HD2  TYR  28           HD2      TYR  28  -3.348   2.120  -1.996
  186    HE1  TYR  28           HE1      TYR  28   0.327   3.379  -4.991
  187    HE2  TYR  28           HE2      TYR  28  -3.817   3.464  -3.976
  188    HH   TYR  28           HH       TYR  28  -1.555   3.850  -6.475
  189    H    SER  29           H        SER  29  -3.017  -1.159  -0.266
  190    HA   SER  29           HA       SER  29  -4.556  -1.182  -2.713
  191    HB2  SER  29           HB2      SER  29  -5.366  -3.482  -2.299
  192    HB3  SER  29           HB1      SER  29  -3.628  -3.458  -2.587
  193    HG   SER  29           HG       SER  29  -4.652  -4.642  -0.656
  194    H    PHE  30           H        PHE  30  -6.900  -1.762  -2.076
  195    HA   PHE  30           HA       PHE  30  -7.425  -0.456   0.482
  196    HB2  PHE  30           HB2      PHE  30  -9.118  -0.547  -2.027
  197    HB3  PHE  30           HB1      PHE  30  -9.604   0.211  -0.513
  198    HD1  PHE  30           HD1      PHE  30  -7.773   0.609  -3.585
  199    HD2  PHE  30           HD2      PHE  30  -8.257   2.159   0.348
  200    HE1  PHE  30           HE1      PHE  30  -6.644   2.686  -4.267
  201    HE2  PHE  30           HE2      PHE  30  -7.137   4.240  -0.330
  202    HZ   PHE  30           HZ       PHE  30  -6.327   4.504  -2.638
  203    H    GLU  31           H        GLU  31  -6.926  -3.325  -0.228
  204    HA   GLU  31           HA       GLU  31  -9.224  -4.400   1.217
  205    HB2  GLU  31           HB2      GLU  31  -9.557  -4.880  -1.220
  206    HB3  GLU  31           HB1      GLU  31  -8.013  -5.716  -1.238
  207    HG2  GLU  31           HG2      GLU  31  -8.899  -7.334   0.394
  208    HG3  GLU  31           HG1      GLU  31 -10.453  -6.509   0.336
  209    H    LEU  32           H        LEU  32  -8.670  -6.151   2.565
  210    HA   LEU  32           HA       LEU  32  -5.934  -6.234   3.387
  211    HB2  LEU  32           HB2      LEU  32  -8.323  -7.826   4.297
  212    HB3  LEU  32           HB1      LEU  32  -6.737  -7.930   5.032
  213    HG   LEU  32           HG       LEU  32  -8.461  -5.450   4.957
  214   HD11  LEU  32          HD11      LEU  32  -9.372  -7.172   6.409
  215   HD12  LEU  32          HD12      LEU  32  -8.705  -5.834   7.353
  216   HD13  LEU  32          HD13      LEU  32  -7.802  -7.344   7.198
  217   HD21  LEU  32          HD21      LEU  32  -6.077  -4.915   4.965
  218   HD22  LEU  32          HD22      LEU  32  -5.828  -6.000   6.332
  219   HD23  LEU  32          HD23      LEU  32  -6.809  -4.548   6.524
  220    H    GLN  33           H        GLN  33  -4.472  -7.274   2.451
  221    HA   GLN  33           HA       GLN  33  -3.348  -8.600   1.058
  222    HB2  GLN  33           HB2      GLN  33  -4.691 -10.668   2.783
  223    HB3  GLN  33           HB1      GLN  33  -3.406 -11.047   1.650
  224    HG2  GLN  33           HG2      GLN  33  -1.886  -9.567   2.859
  225    HG3  GLN  33           HG1      GLN  33  -3.179  -9.155   3.985
  226   HE21  GLN  33          1HE2      GLN  33  -0.556 -10.467   4.453
  227   HE22  GLN  33          2HE2      GLN  33  -0.933 -11.951   5.220
  228    HA   PRO  34           HA       PRO  34  -6.503  -9.751  -2.063
  229    HB2  PRO  34           HB2      PRO  34  -5.984  -7.838  -3.878
  230    HB3  PRO  34           HB1      PRO  34  -6.996  -7.487  -2.473
  231    HG2  PRO  34           HG2      PRO  34  -4.110  -6.865  -2.928
  232    HG3  PRO  34           HG1      PRO  34  -5.382  -5.835  -2.245
  233    HD2  PRO  34           HD2      PRO  34  -3.573  -7.221  -0.721
  234    HD3  PRO  34           HD1      PRO  34  -5.184  -6.756  -0.170
  235    HA   PRO  35           HA       PRO  35  -3.375 -11.757  -4.611
  236    HB2  PRO  35           HB2      PRO  35  -4.200 -11.285  -7.210
  237    HB3  PRO  35           HB1      PRO  35  -4.846 -12.562  -6.180
  238    HG2  PRO  35           HG2      PRO  35  -5.962  -9.867  -6.779
  239    HG3  PRO  35           HG1      PRO  35  -6.805 -11.417  -6.618
  240    HD2  PRO  35           HD2      PRO  35  -6.830  -9.593  -4.655
  241    HD3  PRO  35           HD1      PRO  35  -6.781 -11.338  -4.321
  242    HA   PRO  36           HA       PRO  36  -0.011  -8.971  -5.356
  243    HB2  PRO  36           HB2      PRO  36   0.586 -10.042  -7.965
  244    HB3  PRO  36           HB1      PRO  36   1.476 -10.267  -6.467
  245    HG2  PRO  36           HG2      PRO  36  -0.502 -12.015  -7.754
  246    HG3  PRO  36           HG1      PRO  36   0.701 -12.411  -6.519
  247    HD2  PRO  36           HD2      PRO  36  -1.935 -12.354  -5.996
  248    HD3  PRO  36           HD1      PRO  36  -0.731 -11.867  -4.782
  249    H    TRP  37           H        TRP  37  -1.932  -9.496  -8.291
  250    HA   TRP  37           HA       TRP  37  -1.084  -7.107  -9.568
  251    HB2  TRP  37           HB2      TRP  37  -2.934  -7.628 -11.197
  252    HB3  TRP  37           HB1      TRP  37  -1.722  -8.881 -10.982
  253    HD1  TRP  37           HD       TRP  37  -5.435  -8.131 -10.091
  254    HE1  TRP  37           HE1      TRP  37  -6.601 -10.361  -9.662
  255    HE3  TRP  37          3HE       TRP  37  -1.377 -11.245 -10.271
  256    HZ2  TRP  37           HZ2      TRP  37  -5.924 -13.084  -9.414
  257    HZ3  TRP  37           HZ3      TRP  37  -1.730 -13.650  -9.912
  258    HH2  TRP  37           HH       TRP  37  -3.957 -14.547  -9.494
  259    H    GLU  38           H        GLU  38  -3.418  -7.613  -7.174
  260    HA   GLU  38           HA       GLU  38  -5.117  -5.462  -8.016
  261    HB2  GLU  38           HB2      GLU  38  -5.134  -7.362  -5.729
  262    HB3  GLU  38           HB1      GLU  38  -6.216  -5.969  -5.764
  263    HG2  GLU  38           HG2      GLU  38  -6.020  -8.013  -7.943
  264    HG3  GLU  38           HG1      GLU  38  -7.229  -8.094  -6.673
  265    H    CYS  39           H        CYS  39  -2.363  -5.801  -6.005
  266    HA   CYS  39           HA       CYS  39  -2.907  -3.368  -4.563
  267    HB2  CYS  39           HB2      CYS  39  -0.380  -5.010  -4.761
  268    HB3  CYS  39           HB1      CYS  39  -0.585  -3.586  -3.747
  269    H    TYR  40           H        TYR  40  -2.088  -1.415  -4.954
  270    HA   TYR  40           HA       TYR  40  -1.026  -0.974  -7.610
  271    HB2  TYR  40           HB2      TYR  40  -1.755   1.010  -5.431
  272    HB3  TYR  40           HB1      TYR  40  -1.463   1.370  -7.127
  273    HD1  TYR  40           HD1      TYR  40  -3.875   0.145  -4.687
  274    HD2  TYR  40           HD2      TYR  40  -3.140   0.767  -8.826
  275    HE1  TYR  40           HE1      TYR  40  -6.269  -0.151  -5.147
  276    HE2  TYR  40           HE2      TYR  40  -5.527   0.479  -9.298
  277    HH   TYR  40           HH       TYR  40  -7.916   0.510  -6.930
  278    H    GLN  41           H        GLN  41   1.108  -0.709  -7.855
  279    HA   GLN  41           HA       GLN  41   2.696  -0.843  -5.427
  280    HB2  GLN  41           HB2      GLN  41   3.509  -1.291  -8.300
  281    HB3  GLN  41           HB1      GLN  41   4.554  -1.495  -6.900
  282    HG2  GLN  41           HG2      GLN  41   3.054  -3.252  -6.055
  283    HG3  GLN  41           HG1      GLN  41   2.068  -3.075  -7.501
  284   HE21  GLN  41          1HE2      GLN  41   4.446  -2.693  -9.232
  285   HE22  GLN  41          2HE2      GLN  41   5.156  -4.255  -9.349
  286    H    CYS  42           H        CYS  42   3.929   0.743  -4.733
  287    HA   CYS  42           HA       CYS  42   3.704   3.277  -6.024
  288    HB2  CYS  42           HB2      CYS  42   5.199   2.437  -3.531
  289    HB3  CYS  42           HB1      CYS  42   5.003   4.100  -4.078
  Start of MODEL   12
    1    H    PCA   1           H        PGL   1 -11.915   0.829   2.942
    2    HA   PCA   1           HA       PGL   1 -12.330   3.097   1.930
    3    HB2  PCA   1           HB1      PGL   1 -13.513   4.453   3.332
    4    HB3  PCA   1           HB2      PGL   1 -12.055   4.615   4.351
    5    HG2  PCA   1           HG1      PGL   1 -14.465   3.055   4.876
    6    HG3  PCA   1           HG2      PGL   1 -13.031   3.305   5.931
    7    H    GLU   2           H        GLU   2 -10.249   1.917   4.384
    8    HA   GLU   2           HA       GLU   2  -8.195   3.895   3.991
    9    HB2  GLU   2           HB2      GLU   2  -8.280   1.367   5.627
   10    HB3  GLU   2           HB1      GLU   2  -6.927   2.487   5.600
   11    HG2  GLU   2           HG2      GLU   2  -9.726   3.127   6.504
   12    HG3  GLU   2           HG1      GLU   2  -8.332   2.841   7.549
   13    H    ALA   3           H        ALA   3  -6.172   3.503   3.131
   14    HA   ALA   3           HA       ALA   3  -6.023   1.267   1.260
   15    HB1  ALA   3           HB1      ALA   3  -4.278   3.726   1.548
   16    HB2  ALA   3           HB2      ALA   3  -5.553   3.505   0.351
   17    HB3  ALA   3           HB3      ALA   3  -4.109   2.494   0.299
   18    H    PHE   4           H        PHE   4  -4.923  -0.441   1.843
   19    HA   PHE   4           HA       PHE   4  -3.402  -0.372   4.316
   20    HB2  PHE   4           HB2      PHE   4  -4.138  -2.751   2.610
   21    HB3  PHE   4           HB1      PHE   4  -3.635  -2.765   4.295
   22    HD1  PHE   4           HD1      PHE   4  -5.228  -1.267   5.885
   23    HD2  PHE   4           HD2      PHE   4  -6.350  -2.982   2.159
   24    HE1  PHE   4           HE1      PHE   4  -7.597  -1.147   6.539
   25    HE2  PHE   4           HE2      PHE   4  -8.714  -2.858   2.813
   26    HZ   PHE   4           HZ       PHE   4  -9.338  -1.941   4.999
   27    H    CYS   5           H        CYS   5  -1.249  -0.497   4.336
   28    HA   CYS   5           HA       CYS   5   0.100  -0.634   1.763
   29    HB2  CYS   5           HB2      CYS   5   1.132   0.291   4.445
   30    HB3  CYS   5           HB1      CYS   5   1.960   0.436   2.900
   31    H    TYR   6           H        TYR   6   1.374  -2.222   1.284
   32    HA   TYR   6           HA       TYR   6   2.212  -4.172   3.331
   33    HB2  TYR   6           HB2      TYR   6   1.684  -4.710   0.374
   34    HB3  TYR   6           HB1      TYR   6   2.094  -5.886   1.613
   35    HD1  TYR   6           HD1      TYR   6  -0.541  -3.762   0.243
   36    HD2  TYR   6           HD2      TYR   6   0.402  -6.692   3.168
   37    HE1  TYR   6           HE1      TYR   6  -2.905  -4.110   0.645
   38    HE2  TYR   6           HE2      TYR   6  -1.978  -7.048   3.586
   39    HH   TYR   6           HH       TYR   6  -4.414  -5.617   1.543
   40    H    SER   7           H        SER   7   4.320  -4.769   3.282
   41    HA   SER   7           HA       SER   7   6.103  -2.853   2.141
   42    HB2  SER   7           HB2      SER   7   7.800  -4.312   3.266
   43    HB3  SER   7           HB1      SER   7   6.476  -3.740   4.301
   44    HG   SER   7           HG       SER   7   6.703  -6.321   3.106
   45    H    ASP   8           H        ASP   8   4.770  -5.778   1.119
   46    HA   ASP   8           HA       ASP   8   6.911  -6.155  -0.842
   47    HB2  ASP   8           HB2      ASP   8   5.238  -8.252   0.525
   48    HB3  ASP   8           HB1      ASP   8   6.295  -8.576  -0.846
   49    H    ARG   9           H        ARG   9   6.338  -6.833  -2.870
   50    HA   ARG   9           HA       ARG   9   3.936  -5.678  -3.850
   51    HB2  ARG   9           HB2      ARG   9   6.075  -7.287  -5.195
   52    HB3  ARG   9           HB1      ARG   9   4.742  -6.509  -6.040
   53    HG2  ARG   9           HG2      ARG   9   5.471  -4.334  -5.186
   54    HG3  ARG   9           HG1      ARG   9   6.828  -5.125  -4.376
   55    HD2  ARG   9           HD2      ARG   9   7.641  -5.897  -6.490
   56    HD3  ARG   9           HD1      ARG   9   6.264  -5.130  -7.300
   57    HE   ARG   9           HE       ARG   9   7.655  -3.229  -5.763
   58   HH11  ARG   9          HH11      ARG   9   8.153  -5.102  -8.728
   59   HH12  ARG   9          HH12      ARG   9   9.051  -3.874  -9.509
   60   HH21  ARG   9          HH21      ARG   9   8.935  -1.583  -6.824
   61   HH22  ARG   9          HH22      ARG   9   9.567  -1.858  -8.377
   62    H    PHE  10           H        PHE  10   4.591  -8.649  -2.531
   63    HA   PHE  10           HA       PHE  10   2.716 -10.096  -4.163
   64    HB2  PHE  10           HB2      PHE  10   4.305 -10.982  -1.758
   65    HB3  PHE  10           HB1      PHE  10   3.243 -12.028  -2.698
   66    HD1  PHE  10           HD1      PHE  10   6.545 -11.132  -2.246
   67    HD2  PHE  10           HD2      PHE  10   3.727 -11.817  -5.361
   68    HE1  PHE  10           HE1      PHE  10   8.386 -11.570  -3.820
   69    HE2  PHE  10           HE2      PHE  10   5.563 -12.261  -6.931
   70    HZ   PHE  10           HZ       PHE  10   7.896 -12.137  -6.160
   71    H    CYS  11           H        CYS  11   2.307  -7.916  -1.812
   72    HA   CYS  11           HA       CYS  11   0.402  -7.150  -0.812
   73    HB2  CYS  11           HB2      CYS  11  -0.889  -9.453  -2.250
   74    HB3  CYS  11           HB1      CYS  11  -1.746  -8.158  -1.432
   75    H    GLN  12           H        GLN  12   1.929  -9.762   0.369
   76    HA   GLN  12           HA       GLN  12  -0.267 -10.277   2.221
   77    HB2  GLN  12           HB2      GLN  12   1.932 -12.165   1.394
   78    HB3  GLN  12           HB1      GLN  12   0.783 -12.491   2.686
   79    HG2  GLN  12           HG2      GLN  12  -1.048 -12.283   1.040
   80    HG3  GLN  12           HG1      GLN  12   0.159 -12.079  -0.226
   81   HE21  GLN  12          1HE2      GLN  12   1.410 -13.851  -0.829
   82   HE22  GLN  12          2HE2      GLN  12   0.964 -15.460  -0.433
   83    H    ASN  13           H        ASN  13   2.118  -8.302   2.260
   84    HA   ASN  13           HA       ASN  13   2.683  -8.951   5.046
   85    HB2  ASN  13           HB2      ASN  13   4.694  -7.953   3.051
   86    HB3  ASN  13           HB1      ASN  13   4.902  -7.626   4.765
   87   HD21  ASN  13          HD21      ASN  13   6.559  -9.174   3.028
   88   HD22  ASN  13          HD22      ASN  13   6.612 -10.783   3.661
   89    H    TYR  14           H        TYR  14   0.996  -7.807   5.648
   90    HA   TYR  14           HA       TYR  14   0.528  -5.098   5.023
   91    HB2  TYR  14           HB2      TYR  14  -1.244  -6.591   5.741
   92    HB3  TYR  14           HB1      TYR  14  -0.430  -6.887   7.263
   93    HD1  TYR  14           HD1      TYR  14  -2.318  -4.375   5.303
   94    HD2  TYR  14           HD2      TYR  14  -0.761  -5.449   9.114
   95    HE1  TYR  14           HE1      TYR  14  -3.663  -2.615   6.352
   96    HE2  TYR  14           HE2      TYR  14  -2.095  -3.701  10.167
   97    HH   TYR  14           HH       TYR  14  -4.623  -2.149   8.649
   98    H    ILE  15           H        ILE  15   1.568  -3.357   5.784
   99    HA   ILE  15           HA       ILE  15   2.993  -3.616   8.347
  100    HB   ILE  15           HB       ILE  15   4.383  -1.682   7.662
  101   HG12  ILE  15          HG12      ILE  15   3.014  -1.979   4.968
  102   HG13  ILE  15          HG11      ILE  15   2.785  -0.640   6.083
  103   HG21  ILE  15          HG21      ILE  15   5.764  -2.858   6.039
  104   HG22  ILE  15          HG22      ILE  15   4.438  -3.981   5.722
  105   HG23  ILE  15          HG23      ILE  15   5.195  -3.934   7.316
  106   HD11  ILE  15          HD11      ILE  15   5.130  -0.006   5.793
  107   HD12  ILE  15          HD12      ILE  15   4.270  -0.036   4.254
  108   HD13  ILE  15          HD13      ILE  15   5.356  -1.358   4.683
  109    H    GLY  16           H        GLY  16   0.241  -2.503   7.088
  110    HA2  GLY  16           HA2      GLY  16  -1.245  -1.459   8.718
  111    HA3  GLY  16           HA1      GLY  16   0.088  -0.366   9.089
  112    H    SER  17           H        SER  17  -1.392   1.329   8.606
  113    HA   SER  17           HA       SER  17  -1.343   1.909   5.767
  114    HB2  SER  17           HB2      SER  17  -3.543   3.212   6.231
  115    HB3  SER  17           HB1      SER  17  -3.653   1.459   6.094
  116    HG   SER  17           HG       SER  17  -3.324   2.759   8.590
  117    H    ILE  18           H        ILE  18  -0.507   3.883   5.306
  118    HA   ILE  18           HA       ILE  18  -0.065   5.781   7.441
  119    HB   ILE  18           HB       ILE  18   2.394   5.920   6.805
  120   HG12  ILE  18          HG12      ILE  18   1.835   3.176   5.644
  121   HG13  ILE  18          HG11      ILE  18   2.324   4.611   4.754
  122   HG21  ILE  18          HG21      ILE  18   3.111   4.135   8.332
  123   HG22  ILE  18          HG22      ILE  18   1.484   3.456   8.271
  124   HG23  ILE  18          HG23      ILE  18   1.744   5.058   8.957
  125   HD11  ILE  18          HD11      ILE  18   3.972   3.143   6.796
  126   HD12  ILE  18          HD12      ILE  18   4.485   4.574   5.898
  127   HD13  ILE  18          HD13      ILE  18   4.173   3.058   5.046
  128    HA   PRO  19           HA       PRO  19  -0.642   8.546   4.056
  129    HB2  PRO  19           HB2      PRO  19   0.708  10.750   4.936
  130    HB3  PRO  19           HB1      PRO  19  -0.863  10.260   5.577
  131    HG2  PRO  19           HG2      PRO  19   1.867   9.816   6.714
  132    HG3  PRO  19           HG1      PRO  19   0.370  10.272   7.546
  133    HD2  PRO  19           HD2      PRO  19   1.341   7.741   7.550
  134    HD3  PRO  19           HD1      PRO  19  -0.395   8.095   7.619
  135    H    ASP  20           H        ASP  20   2.561   7.792   5.150
  136    HA   ASP  20           HA       ASP  20   3.808   8.836   2.732
  137    HB2  ASP  20           HB2      ASP  20   5.917   8.420   3.906
  138    HB3  ASP  20           HB1      ASP  20   4.833   9.359   4.924
  139    H    CYS  21           H        CYS  21   2.038   6.565   2.728
  140    HA   CYS  21           HA       CYS  21   3.034   4.016   2.853
  141    HB2  CYS  21           HB2      CYS  21   0.674   4.804   2.372
  142    HB3  CYS  21           HB1      CYS  21   1.165   4.973   0.693
  143    H    CYS  22           H        CYS  22   3.269   6.229   0.046
  144    HA   CYS  22           HA       CYS  22   4.720   4.193  -1.408
  145    HB2  CYS  22           HB2      CYS  22   3.747   6.913  -2.221
  146    HB3  CYS  22           HB1      CYS  22   4.673   5.861  -3.287
  147    H    PHE  23           H        PHE  23   5.744   6.157   0.899
  148    HA   PHE  23           HA       PHE  23   8.161   6.919  -0.498
  149    HB2  PHE  23           HB2      PHE  23   7.224   7.535   2.316
  150    HB3  PHE  23           HB1      PHE  23   8.799   8.001   1.685
  151    HD1  PHE  23           HD1      PHE  23   9.055   9.930   0.363
  152    HD2  PHE  23           HD2      PHE  23   5.159   8.481   1.234
  153    HE1  PHE  23           HE1      PHE  23   8.085  11.995  -0.562
  154    HE2  PHE  23           HE2      PHE  23   4.173  10.542   0.318
  155    HZ   PHE  23           HZ       PHE  23   5.639  12.304  -0.584
  156    H    GLY  24           H        GLY  24   8.655   4.814  -0.921
  157    HA2  GLY  24           HA2      GLY  24  10.658   3.516  -0.009
  158    HA3  GLY  24           HA1      GLY  24   9.530   3.135   1.300
  159    H    ARG  25           H        ARG  25  10.115   0.911   0.234
  160    HA   ARG  25           HA       ARG  25   8.538   0.382  -2.107
  161    HB2  ARG  25           HB2      ARG  25   9.071  -2.026  -1.687
  162    HB3  ARG  25           HB1      ARG  25  10.482  -0.999  -1.841
  163    HG2  ARG  25           HG2      ARG  25  10.807  -1.032   0.561
  164    HG3  ARG  25           HG1      ARG  25   9.318  -1.955   0.764
  165    HD2  ARG  25           HD2      ARG  25  11.356  -3.354   0.873
  166    HD3  ARG  25           HD1      ARG  25  10.262  -3.824  -0.426
  167    HE   ARG  25           HE       ARG  25  12.044  -2.049  -1.537
  168   HH11  ARG  25          HH11      ARG  25  12.353  -5.158   0.116
  169   HH12  ARG  25          HH12      ARG  25  13.671  -5.668  -0.854
  170   HH21  ARG  25          HH21      ARG  25  13.779  -2.748  -2.830
  171   HH22  ARG  25          HH22      ARG  25  14.519  -4.267  -2.559
  172    H    GLY  26           H        GLY  26   6.414   0.148  -2.136
  173    HA2  GLY  26           HA2      GLY  26   5.110  -1.179   0.037
  174    HA3  GLY  26           HA1      GLY  26   4.767   0.540  -0.089
  175    H    SER  27           H        SER  27   3.275  -1.997  -0.535
  176    HA   SER  27           HA       SER  27   2.120  -1.264  -3.144
  177    HB2  SER  27           HB2      SER  27   1.772  -3.868  -1.635
  178    HB3  SER  27           HB1      SER  27   1.380  -3.535  -3.321
  179    HG   SER  27           HG       SER  27   3.582  -4.502  -2.324
  180    H    TYR  28           H        TYR  28  -0.001  -0.587  -2.970
  181    HA   TYR  28           HA       TYR  28  -1.213  -0.956  -0.341
  182    HB2  TYR  28           HB2      TYR  28  -2.183   1.282  -0.372
  183    HB3  TYR  28           HB1      TYR  28  -0.439   1.366  -0.487
  184    HD1  TYR  28           HD1      TYR  28  -3.599   2.161  -2.063
  185    HD2  TYR  28           HD2      TYR  28   0.627   2.058  -2.716
  186    HE1  TYR  28           HE1      TYR  28  -3.846   3.636  -3.988
  187    HE2  TYR  28           HE2      TYR  28   0.370   3.517  -4.618
  188    HH   TYR  28           HH       TYR  28  -1.394   4.159  -6.252
  189    H    SER  29           H        SER  29  -3.228  -1.604  -0.254
  190    HA   SER  29           HA       SER  29  -4.805  -1.503  -2.700
  191    HB2  SER  29           HB2      SER  29  -5.574  -3.832  -2.260
  192    HB3  SER  29           HB1      SER  29  -3.850  -3.752  -2.629
  193    HG   SER  29           HG       SER  29  -5.104  -4.585  -0.349
  194    H    PHE  30           H        PHE  30  -7.124  -1.890  -2.188
  195    HA   PHE  30           HA       PHE  30  -7.678  -0.748   0.430
  196    HB2  PHE  30           HB2      PHE  30  -9.385  -0.904  -2.055
  197    HB3  PHE  30           HB1      PHE  30  -9.928  -0.217  -0.528
  198    HD1  PHE  30           HD1      PHE  30  -7.905   0.292  -3.499
  199    HD2  PHE  30           HD2      PHE  30  -8.929   1.875   0.312
  200    HE1  PHE  30           HE1      PHE  30  -6.926   2.466  -4.141
  201    HE2  PHE  30           HE2      PHE  30  -7.962   4.042  -0.324
  202    HZ   PHE  30           HZ       PHE  30  -6.960   4.341  -2.546
  203    H    GLU  31           H        GLU  31  -7.247  -3.641  -0.605
  204    HA   GLU  31           HA       GLU  31  -9.362  -4.777   1.083
  205    HB2  GLU  31           HB2      GLU  31  -8.254  -6.005  -1.458
  206    HB3  GLU  31           HB1      GLU  31  -9.384  -6.791  -0.367
  207    HG2  GLU  31           HG2      GLU  31 -11.034  -5.030  -0.835
  208    HG3  GLU  31           HG1      GLU  31  -9.902  -4.290  -1.956
  209    H    LEU  32           H        LEU  32  -8.727  -6.612   2.304
  210    HA   LEU  32           HA       LEU  32  -5.956  -6.522   3.065
  211    HB2  LEU  32           HB2      LEU  32  -8.278  -8.092   4.173
  212    HB3  LEU  32           HB1      LEU  32  -6.646  -8.291   4.762
  213    HG   LEU  32           HG       LEU  32  -7.792  -6.933   6.303
  214   HD11  LEU  32          HD11      LEU  32  -6.544  -4.859   6.316
  215   HD12  LEU  32          HD12      LEU  32  -6.072  -5.123   4.644
  216   HD13  LEU  32          HD13      LEU  32  -5.524  -6.236   5.899
  217   HD21  LEU  32          HD21      LEU  32  -9.671  -6.216   4.953
  218   HD22  LEU  32          HD22      LEU  32  -8.613  -5.162   4.012
  219   HD23  LEU  32          HD23      LEU  32  -8.903  -4.820   5.717
  220    H    GLN  33           H        GLN  33  -4.509  -7.549   2.159
  221    HA   GLN  33           HA       GLN  33  -3.355  -8.905   0.827
  222    HB2  GLN  33           HB2      GLN  33  -4.770 -11.027   2.413
  223    HB3  GLN  33           HB1      GLN  33  -3.329 -11.284   1.446
  224    HG2  GLN  33           HG2      GLN  33  -2.133  -9.668   2.894
  225    HG3  GLN  33           HG1      GLN  33  -3.581  -9.551   3.888
  226   HE21  GLN  33          1HE2      GLN  33  -4.251 -12.367   3.606
  227   HE22  GLN  33          2HE2      GLN  33  -3.113 -13.240   4.554
  228    HA   PRO  34           HA       PRO  34  -6.374 -10.142  -2.350
  229    HB2  PRO  34           HB2      PRO  34  -6.058  -8.118  -4.076
  230    HB3  PRO  34           HB1      PRO  34  -7.061  -7.897  -2.638
  231    HG2  PRO  34           HG2      PRO  34  -4.272  -6.983  -3.165
  232    HG3  PRO  34           HG1      PRO  34  -5.591  -6.142  -2.333
  233    HD2  PRO  34           HD2      PRO  34  -3.528  -7.533  -1.082
  234    HD3  PRO  34           HD1      PRO  34  -5.065  -7.085  -0.338
  235    HA   PRO  35           HA       PRO  35  -3.067 -11.761  -4.964
  236    HB2  PRO  35           HB2      PRO  35  -3.920 -11.218  -7.541
  237    HB3  PRO  35           HB1      PRO  35  -4.466 -12.598  -6.587
  238    HG2  PRO  35           HG2      PRO  35  -5.794  -9.967  -7.046
  239    HG3  PRO  35           HG1      PRO  35  -6.507 -11.589  -6.975
  240    HD2  PRO  35           HD2      PRO  35  -6.691  -9.881  -4.920
  241    HD3  PRO  35           HD1      PRO  35  -6.502 -11.625  -4.668
  242    HA   PRO  36           HA       PRO  36  -0.095  -8.605  -5.480
  243    HB2  PRO  36           HB2      PRO  36   1.164  -9.406  -7.859
  244    HB3  PRO  36           HB1      PRO  36   1.580  -9.918  -6.225
  245    HG2  PRO  36           HG2      PRO  36  -0.121 -11.292  -8.259
  246    HG3  PRO  36           HG1      PRO  36   1.015 -11.989  -7.091
  247    HD2  PRO  36           HD2      PRO  36  -1.606 -12.138  -6.678
  248    HD3  PRO  36           HD1      PRO  36  -0.501 -11.804  -5.326
  249    H    TRP  37           H        TRP  37  -1.849  -9.247  -8.479
  250    HA   TRP  37           HA       TRP  37  -1.123  -6.774  -9.704
  251    HB2  TRP  37           HB2      TRP  37  -2.877  -7.340 -11.399
  252    HB3  TRP  37           HB1      TRP  37  -1.663  -8.588 -11.162
  253    HD1  TRP  37           HD       TRP  37  -5.404  -7.876 -10.356
  254    HE1  TRP  37           HE1      TRP  37  -6.571 -10.126  -9.998
  255    HE3  TRP  37          3HE       TRP  37  -1.331 -10.968 -10.563
  256    HZ2  TRP  37           HZ2      TRP  37  -5.892 -12.830  -9.836
  257    HZ3  TRP  37           HZ3      TRP  37  -1.696 -13.382 -10.293
  258    HH2  TRP  37           HH       TRP  37  -3.941 -14.284  -9.935
  259    H    GLU  38           H        GLU  38  -3.352  -7.449  -7.284
  260    HA   GLU  38           HA       GLU  38  -5.155  -5.316  -8.067
  261    HB2  GLU  38           HB2      GLU  38  -5.217  -7.353  -5.870
  262    HB3  GLU  38           HB1      GLU  38  -6.385  -6.040  -5.982
  263    HG2  GLU  38           HG2      GLU  38  -5.879  -8.037  -8.161
  264    HG3  GLU  38           HG1      GLU  38  -7.164  -8.207  -6.972
  265    H    CYS  39           H        CYS  39  -2.354  -5.671  -6.267
  266    HA   CYS  39           HA       CYS  39  -2.984  -3.460  -4.492
  267    HB2  CYS  39           HB2      CYS  39  -0.438  -5.054  -4.833
  268    HB3  CYS  39           HB1      CYS  39  -0.674  -3.754  -3.672
  269    H    TYR  40           H        TYR  40  -2.325  -1.443  -4.827
  270    HA   TYR  40           HA       TYR  40  -1.240  -0.825  -7.396
  271    HB2  TYR  40           HB2      TYR  40  -1.922   0.959  -5.051
  272    HB3  TYR  40           HB1      TYR  40  -1.526   1.502  -6.674
  273    HD1  TYR  40           HD1      TYR  40  -3.114   1.087  -8.529
  274    HD2  TYR  40           HD2      TYR  40  -4.109   0.185  -4.500
  275    HE1  TYR  40           HE1      TYR  40  -5.458   0.991  -9.147
  276    HE2  TYR  40           HE2      TYR  40  -6.485   0.081  -5.099
  277    HH   TYR  40           HH       TYR  40  -7.527   0.024  -8.357
  278    H    GLN  41           H        GLN  41   0.820  -0.787  -7.740
  279    HA   GLN  41           HA       GLN  41   2.710  -1.120  -5.666
  280    HB2  GLN  41           HB2      GLN  41   2.785  -2.374  -7.703
  281    HB3  GLN  41           HB1      GLN  41   2.789  -0.901  -8.654
  282    HG2  GLN  41           HG2      GLN  41   4.923  -0.326  -7.717
  283    HG3  GLN  41           HG1      GLN  41   4.942  -1.867  -6.834
  284   HE21  GLN  41          1HE2      GLN  41   5.098  -0.361  -9.946
  285   HE22  GLN  41          2HE2      GLN  41   5.652  -1.743 -10.822
  286    H    CYS  42           H        CYS  42   3.673   0.585  -4.665
  287    HA   CYS  42           HA       CYS  42   3.591   3.171  -5.833
  288    HB2  CYS  42           HB2      CYS  42   5.018   2.141  -3.362
  289    HB3  CYS  42           HB1      CYS  42   4.940   3.831  -3.834
  Start of MODEL   13
    1    H    PCA   1           H        PGL   1  -9.230   6.629   2.137
    2    HA   PCA   1           HA       PGL   1  -8.713   8.441   3.805
    3    HB2  PCA   1           HB1      PGL   1 -10.016   8.332   5.671
    4    HB3  PCA   1           HB2      PGL   1  -9.184   6.823   6.138
    5    HG2  PCA   1           HG1      PGL   1 -11.867   7.135   5.057
    6    HG3  PCA   1           HG2      PGL   1 -11.032   5.630   5.575
    7    H    GLU   2           H        GLU   2  -8.192   5.034   3.608
    8    HA   GLU   2           HA       GLU   2  -5.415   5.405   4.497
    9    HB2  GLU   2           HB2      GLU   2  -7.136   3.051   5.237
   10    HB3  GLU   2           HB1      GLU   2  -5.459   3.337   5.657
   11    HG2  GLU   2           HG2      GLU   2  -6.079   5.147   7.100
   12    HG3  GLU   2           HG1      GLU   2  -7.770   4.996   6.604
   13    H    ALA   3           H        ALA   3  -4.002   4.396   3.181
   14    HA   ALA   3           HA       ALA   3  -4.984   2.409   1.294
   15    HB1  ALA   3           HB1      ALA   3  -3.758   4.300   0.304
   16    HB2  ALA   3           HB2      ALA   3  -2.820   2.818   0.144
   17    HB3  ALA   3           HB3      ALA   3  -2.401   3.999   1.386
   18    H    PHE   4           H        PHE   4  -4.304   0.337   1.575
   19    HA   PHE   4           HA       PHE   4  -3.046  -0.301   4.105
   20    HB2  PHE   4           HB2      PHE   4  -4.336  -1.974   1.940
   21    HB3  PHE   4           HB1      PHE   4  -3.629  -2.672   3.381
   22    HD1  PHE   4           HD1      PHE   4  -5.629   0.469   3.317
   23    HD2  PHE   4           HD2      PHE   4  -5.601  -3.675   4.219
   24    HE1  PHE   4           HE1      PHE   4  -7.794   0.710   4.445
   25    HE2  PHE   4           HE2      PHE   4  -7.773  -3.431   5.350
   26    HZ   PHE   4           HZ       PHE   4  -8.867  -1.247   5.465
   27    H    CYS   5           H        CYS   5  -0.975  -0.821   4.292
   28    HA   CYS   5           HA       CYS   5   0.599  -0.827   1.840
   29    HB2  CYS   5           HB2      CYS   5   1.367  -0.318   4.690
   30    HB3  CYS   5           HB1      CYS   5   2.479  -0.294   3.325
   31    H    TYR   6           H        TYR   6   1.682  -2.467   1.160
   32    HA   TYR   6           HA       TYR   6   2.365  -4.690   2.968
   33    HB2  TYR   6           HB2      TYR   6   1.652  -5.019   0.018
   34    HB3  TYR   6           HB1      TYR   6   1.992  -6.263   1.191
   35    HD1  TYR   6           HD1      TYR   6  -0.510  -3.701   0.276
   36    HD2  TYR   6           HD2      TYR   6   0.348  -7.113   2.654
   37    HE1  TYR   6           HE1      TYR   6  -2.838  -3.811   0.947
   38    HE2  TYR   6           HE2      TYR   6  -1.988  -7.232   3.326
   39    HH   TYR   6           HH       TYR   6  -4.430  -5.254   1.893
   40    H    SER   7           H        SER   7   4.337  -5.082   3.110
   41    HA   SER   7           HA       SER   7   6.375  -3.465   2.199
   42    HB2  SER   7           HB2      SER   7   6.466  -6.331   3.047
   43    HB3  SER   7           HB1      SER   7   7.862  -5.235   3.044
   44    HG   SER   7           HG       SER   7   7.020  -4.168   4.687
   45    H    ASP   8           H        ASP   8   5.108  -6.393   0.747
   46    HA   ASP   8           HA       ASP   8   7.073  -6.126  -1.396
   47    HB2  ASP   8           HB2      ASP   8   7.648  -8.071  -0.153
   48    HB3  ASP   8           HB1      ASP   8   5.983  -8.615  -0.090
   49    H    ARG   9           H        ARG   9   6.351  -6.899  -3.489
   50    HA   ARG   9           HA       ARG   9   3.811  -5.740  -4.046
   51    HB2  ARG   9           HB2      ARG   9   5.873  -6.918  -5.863
   52    HB3  ARG   9           HB1      ARG   9   4.427  -6.062  -6.391
   53    HG2  ARG   9           HG2      ARG   9   5.153  -4.060  -5.214
   54    HG3  ARG   9           HG1      ARG   9   6.595  -4.905  -4.652
   55    HD2  ARG   9           HD2      ARG   9   7.270  -5.233  -6.965
   56    HD3  ARG   9           HD1      ARG   9   5.827  -4.338  -7.476
   57    HE   ARG   9           HE       ARG   9   6.963  -2.565  -5.858
   58   HH11  ARG   9          HH11      ARG   9   8.495  -4.454  -8.445
   59   HH12  ARG   9          HH12      ARG   9   9.680  -3.273  -8.778
   60   HH21  ARG   9          HH21      ARG   9   8.616  -0.979  -6.310
   61   HH22  ARG   9          HH22      ARG   9   9.751  -1.272  -7.534
   62    H    PHE  10           H        PHE  10   4.565  -8.865  -3.157
   63    HA   PHE  10           HA       PHE  10   2.454  -9.955  -4.789
   64    HB2  PHE  10           HB2      PHE  10   4.432 -11.282  -2.940
   65    HB3  PHE  10           HB1      PHE  10   3.066 -12.153  -3.631
   66    HD1  PHE  10           HD1      PHE  10   3.003 -12.714  -5.966
   67    HD2  PHE  10           HD2      PHE  10   6.252 -10.496  -4.362
   68    HE1  PHE  10           HE1      PHE  10   4.276 -13.112  -8.024
   69    HE2  PHE  10           HE2      PHE  10   7.541 -10.894  -6.424
   70    HZ   PHE  10           HZ       PHE  10   6.554 -12.199  -8.259
   71    H    CYS  11           H        CYS  11   2.418  -8.166  -2.173
   72    HA   CYS  11           HA       CYS  11   0.652  -7.459  -0.904
   73    HB2  CYS  11           HB2      CYS  11  -0.915  -9.702  -2.161
   74    HB3  CYS  11           HB1      CYS  11  -1.574  -8.333  -1.279
   75    H    GLN  12           H        GLN  12   2.254 -10.208  -0.220
   76    HA   GLN  12           HA       GLN  12   0.414 -11.229   1.764
   77    HB2  GLN  12           HB2      GLN  12   3.180 -12.146   1.011
   78    HB3  GLN  12           HB1      GLN  12   2.075 -12.970   2.092
   79    HG2  GLN  12           HG2      GLN  12   1.606 -12.447  -0.825
   80    HG3  GLN  12           HG1      GLN  12   2.101 -13.982  -0.114
   81   HE21  GLN  12          1HE2      GLN  12   0.656 -15.085   1.123
   82   HE22  GLN  12          2HE2      GLN  12  -1.056 -14.828   1.037
   83    H    ASN  13           H        ASN  13   2.155  -8.553   1.990
   84    HA   ASN  13           HA       ASN  13   3.042  -9.264   4.715
   85    HB2  ASN  13           HB2      ASN  13   4.645  -7.539   2.817
   86    HB3  ASN  13           HB1      ASN  13   5.045  -7.839   4.500
   87   HD21  ASN  13          HD21      ASN  13   5.853  -9.912   5.081
   88   HD22  ASN  13          HD22      ASN  13   6.471 -10.972   3.884
   89    H    TYR  14           H        TYR  14   1.105  -8.299   5.438
   90    HA   TYR  14           HA       TYR  14   0.522  -5.547   4.834
   91    HB2  TYR  14           HB2      TYR  14  -1.268  -7.194   5.331
   92    HB3  TYR  14           HB1      TYR  14  -0.652  -7.357   6.965
   93    HD1  TYR  14           HD1      TYR  14  -2.162  -4.925   4.602
   94    HD2  TYR  14           HD2      TYR  14  -1.392  -5.882   8.674
   95    HE1  TYR  14           HE1      TYR  14  -3.636  -3.106   5.313
   96    HE2  TYR  14           HE2      TYR  14  -2.867  -4.066   9.383
   97    HH   TYR  14           HH       TYR  14  -3.750  -1.944   8.462
   98    H    ILE  15           H        ILE  15   1.327  -3.813   5.819
   99    HA   ILE  15           HA       ILE  15   2.531  -4.193   8.482
  100    HB   ILE  15           HB       ILE  15   4.077  -2.298   7.931
  101   HG12  ILE  15          HG12      ILE  15   3.119  -2.830   5.107
  102   HG13  ILE  15          HG11      ILE  15   2.840  -1.363   6.035
  103   HG21  ILE  15          HG21      ILE  15   5.635  -3.702   6.660
  104   HG22  ILE  15          HG22      ILE  15   4.314  -4.820   6.318
  105   HG23  ILE  15          HG23      ILE  15   4.849  -4.566   7.980
  106   HD11  ILE  15          HD11      ILE  15   5.515  -2.393   5.122
  107   HD12  ILE  15          HD12      ILE  15   5.233  -0.907   6.033
  108   HD13  ILE  15          HD13      ILE  15   4.605  -1.070   4.392
  109    H    GLY  16           H        GLY  16  -0.063  -2.900   7.141
  110    HA2  GLY  16           HA2      GLY  16  -1.354  -1.738   8.941
  111    HA3  GLY  16           HA1      GLY  16  -0.034  -0.579   8.946
  112    H    SER  17           H        SER  17  -1.780   0.951   8.481
  113    HA   SER  17           HA       SER  17  -2.228   1.147   5.634
  114    HB2  SER  17           HB2      SER  17  -4.672   1.645   6.076
  115    HB3  SER  17           HB1      SER  17  -4.193  -0.023   6.342
  116    HG   SER  17           HG       SER  17  -5.121   1.847   8.156
  117    H    ILE  18           H        ILE  18  -2.008   3.192   4.952
  118    HA   ILE  18           HA       ILE  18  -2.333   5.422   6.789
  119    HB   ILE  18           HB       ILE  18  -0.148   6.423   5.949
  120   HG12  ILE  18          HG12      ILE  18   0.353   3.562   5.085
  121   HG13  ILE  18          HG11      ILE  18   0.239   4.967   4.036
  122   HG21  ILE  18          HG21      ILE  18   0.028   3.984   7.701
  123   HG22  ILE  18          HG22      ILE  18  -0.311   5.638   8.216
  124   HG23  ILE  18          HG23      ILE  18   1.273   5.221   7.561
  125   HD11  ILE  18          HD11      ILE  18   2.298   5.857   5.002
  126   HD12  ILE  18          HD12      ILE  18   2.542   4.230   4.356
  127   HD13  ILE  18          HD13      ILE  18   2.375   4.473   6.093
  128    HA   PRO  19           HA       PRO  19  -4.303   7.374   3.349
  129    HB2  PRO  19           HB2      PRO  19  -2.623   9.784   3.819
  130    HB3  PRO  19           HB1      PRO  19  -4.381   9.637   3.745
  131    HG2  PRO  19           HG2      PRO  19  -3.168   9.944   6.086
  132    HG3  PRO  19           HG1      PRO  19  -4.550   8.847   5.910
  133    HD2  PRO  19           HD2      PRO  19  -1.642   8.200   6.126
  134    HD3  PRO  19           HD1      PRO  19  -3.047   7.360   6.809
  135    H    ASP  20           H        ASP  20  -0.892   8.428   3.380
  136    HA   ASP  20           HA       ASP  20  -0.821   7.737   0.531
  137    HB2  ASP  20           HB2      ASP  20   0.830   9.782   2.031
  138    HB3  ASP  20           HB1      ASP  20   1.249   9.210   0.427
  139    H    CYS  21           H        CYS  21  -0.024   5.827   0.280
  140    HA   CYS  21           HA       CYS  21   1.792   4.752   2.276
  141    HB2  CYS  21           HB2      CYS  21  -0.190   3.457   1.527
  142    HB3  CYS  21           HB1      CYS  21   0.501   3.383  -0.088
  143    H    CYS  22           H        CYS  22   1.994   6.199  -0.788
  144    HA   CYS  22           HA       CYS  22   4.277   4.687  -1.649
  145    HB2  CYS  22           HB2      CYS  22   2.937   7.082  -2.891
  146    HB3  CYS  22           HB1      CYS  22   4.277   6.186  -3.603
  147    H    PHE  23           H        PHE  23   4.376   6.427   0.780
  148    HA   PHE  23           HA       PHE  23   6.741   7.997   0.085
  149    HB2  PHE  23           HB2      PHE  23   4.912   7.992   2.488
  150    HB3  PHE  23           HB1      PHE  23   6.509   8.728   2.570
  151    HD1  PHE  23           HD1      PHE  23   3.353   8.820   0.587
  152    HD2  PHE  23           HD2      PHE  23   6.800  10.927   1.913
  153    HE1  PHE  23           HE1      PHE  23   2.466  10.896  -0.402
  154    HE2  PHE  23           HE2      PHE  23   5.917  12.995   0.937
  155    HZ   PHE  23           HZ       PHE  23   3.747  12.982  -0.227
  156    H    GLY  24           H        GLY  24   6.453   5.071   0.192
  157    HA2  GLY  24           HA2      GLY  24   8.938   4.498   1.406
  158    HA3  GLY  24           HA1      GLY  24   7.576   3.769   2.264
  159    H    ARG  25           H        ARG  25   9.311   2.093   1.132
  160    HA   ARG  25           HA       ARG  25   8.493   1.343  -1.515
  161    HB2  ARG  25           HB2      ARG  25  10.775   0.912  -0.816
  162    HB3  ARG  25           HB1      ARG  25  10.212  -0.057   0.534
  163    HG2  ARG  25           HG2      ARG  25   9.358  -1.740  -0.996
  164    HG3  ARG  25           HG1      ARG  25   9.844  -0.756  -2.377
  165    HD2  ARG  25           HD2      ARG  25  12.165  -0.897  -1.662
  166    HD3  ARG  25           HD1      ARG  25  11.693  -1.875  -0.272
  167    HE   ARG  25           HE       ARG  25  10.762  -3.190  -2.514
  168   HH11  ARG  25          HH11      ARG  25  13.907  -2.194  -1.238
  169   HH12  ARG  25          HH12      ARG  25  14.775  -3.466  -1.969
  170   HH21  ARG  25          HH21      ARG  25  11.940  -4.910  -3.532
  171   HH22  ARG  25          HH22      ARG  25  13.628  -5.050  -3.325
  172    H    GLY  26           H        GLY  26   6.674   0.247  -1.959
  173    HA2  GLY  26           HA2      GLY  26   5.967  -2.127  -0.792
  174    HA3  GLY  26           HA1      GLY  26   5.126  -0.884   0.120
  175    H    SER  27           H        SER  27   3.445  -2.349  -0.806
  176    HA   SER  27           HA       SER  27   2.407  -1.238  -3.328
  177    HB2  SER  27           HB2      SER  27   1.770  -3.951  -2.159
  178    HB3  SER  27           HB1      SER  27   1.478  -3.369  -3.801
  179    HG   SER  27           HG       SER  27   3.675  -4.499  -2.701
  180    H    TYR  28           H        TYR  28   0.076  -0.827  -3.195
  181    HA   TYR  28           HA       TYR  28  -0.969  -1.112  -0.498
  182    HB2  TYR  28           HB2      TYR  28  -1.917   1.104  -0.500
  183    HB3  TYR  28           HB1      TYR  28  -0.187   1.216  -0.776
  184    HD1  TYR  28           HD1      TYR  28   0.664   1.853  -3.088
  185    HD2  TYR  28           HD2      TYR  28  -3.493   1.865  -2.100
  186    HE1  TYR  28           HE1      TYR  28   0.202   3.183  -5.042
  187    HE2  TYR  28           HE2      TYR  28  -3.953   3.207  -4.073
  188    HH   TYR  28           HH       TYR  28  -1.668   3.626  -6.537
  189    H    SER  29           H        SER  29  -3.153  -1.270  -0.294
  190    HA   SER  29           HA       SER  29  -4.866  -1.339  -2.617
  191    HB2  SER  29           HB2      SER  29  -5.790  -3.560  -1.944
  192    HB3  SER  29           HB1      SER  29  -4.097  -3.683  -2.428
  193    HG   SER  29           HG       SER  29  -5.215  -4.361  -0.083
  194    H    PHE  30           H        PHE  30  -7.242  -1.670  -1.651
  195    HA   PHE  30           HA       PHE  30  -7.245  -0.173   0.862
  196    HB2  PHE  30           HB2      PHE  30  -9.319  -0.225  -1.353
  197    HB3  PHE  30           HB1      PHE  30  -9.436   0.714   0.135
  198    HD1  PHE  30           HD1      PHE  30  -7.806   2.559   0.560
  199    HD2  PHE  30           HD2      PHE  30  -8.010   0.547  -3.180
  200    HE1  PHE  30           HE1      PHE  30  -6.537   4.373  -0.482
  201    HE2  PHE  30           HE2      PHE  30  -6.737   2.370  -4.236
  202    HZ   PHE  30           HZ       PHE  30  -5.994   4.285  -2.885
  203    H    GLU  31           H        GLU  31  -7.021  -3.018   0.486
  204    HA   GLU  31           HA       GLU  31  -9.136  -3.936   2.231
  205    HB2  GLU  31           HB2      GLU  31  -9.652  -5.863   0.770
  206    HB3  GLU  31           HB1      GLU  31 -10.116  -4.333   0.032
  207    HG2  GLU  31           HG2      GLU  31  -8.102  -4.379  -1.342
  208    HG3  GLU  31           HG1      GLU  31  -7.617  -5.895  -0.585
  209    H    LEU  32           H        LEU  32  -8.619  -6.152   3.024
  210    HA   LEU  32           HA       LEU  32  -5.820  -6.302   3.657
  211    HB2  LEU  32           HB2      LEU  32  -8.160  -8.022   4.488
  212    HB3  LEU  32           HB1      LEU  32  -6.523  -8.293   5.021
  213    HG   LEU  32           HG       LEU  32  -7.709  -7.280   6.786
  214   HD11  LEU  32          HD11      LEU  32  -6.492  -5.225   7.215
  215   HD12  LEU  32          HD12      LEU  32  -5.941  -5.216   5.541
  216   HD13  LEU  32          HD13      LEU  32  -5.468  -6.529   6.619
  217   HD21  LEU  32          HD21      LEU  32  -8.800  -5.042   6.589
  218   HD22  LEU  32          HD22      LEU  32  -9.587  -6.326   5.679
  219   HD23  LEU  32          HD23      LEU  32  -8.585  -5.155   4.834
  220    H    GLN  33           H        GLN  33  -4.427  -7.337   2.562
  221    HA   GLN  33           HA       GLN  33  -3.459  -8.549   0.948
  222    HB2  GLN  33           HB2      GLN  33  -4.612 -10.661   2.738
  223    HB3  GLN  33           HB1      GLN  33  -3.456 -11.017   1.463
  224    HG2  GLN  33           HG2      GLN  33  -1.855  -9.479   2.516
  225    HG3  GLN  33           HG1      GLN  33  -3.011  -9.191   3.815
  226   HE21  GLN  33          1HE2      GLN  33  -3.356 -10.769   5.305
  227   HE22  GLN  33          2HE2      GLN  33  -2.340 -12.158   5.482
  228    HA   PRO  34           HA       PRO  34  -6.557  -9.756  -2.087
  229    HB2  PRO  34           HB2      PRO  34  -6.003  -7.875  -3.931
  230    HB3  PRO  34           HB1      PRO  34  -7.034  -7.498  -2.548
  231    HG2  PRO  34           HG2      PRO  34  -4.200  -6.770  -3.055
  232    HG3  PRO  34           HG1      PRO  34  -5.459  -5.865  -2.204
  233    HD2  PRO  34           HD2      PRO  34  -3.433  -7.426  -1.027
  234    HD3  PRO  34           HD1      PRO  34  -4.861  -6.770  -0.211
  235    HA   PRO  35           HA       PRO  35  -3.437 -11.846  -4.522
  236    HB2  PRO  35           HB2      PRO  35  -4.281 -11.508  -7.143
  237    HB3  PRO  35           HB1      PRO  35  -4.878 -12.754  -6.046
  238    HG2  PRO  35           HG2      PRO  35  -6.085 -10.141  -6.787
  239    HG3  PRO  35           HG1      PRO  35  -6.875 -11.697  -6.479
  240    HD2  PRO  35           HD2      PRO  35  -6.878  -9.693  -4.670
  241    HD3  PRO  35           HD1      PRO  35  -6.846 -11.402  -4.197
  242    HA   PRO  36           HA       PRO  36   0.005  -9.164  -5.261
  243    HB2  PRO  36           HB2      PRO  36   0.305 -10.613  -7.816
  244    HB3  PRO  36           HB1      PRO  36   1.474 -10.360  -6.526
  245    HG2  PRO  36           HG2      PRO  36  -0.064 -12.660  -6.958
  246    HG3  PRO  36           HG1      PRO  36   0.881 -12.284  -5.515
  247    HD2  PRO  36           HD2      PRO  36  -1.913 -12.523  -5.715
  248    HD3  PRO  36           HD1      PRO  36  -1.005 -11.896  -4.327
  249    H    TRP  37           H        TRP  37  -1.872  -9.742  -8.204
  250    HA   TRP  37           HA       TRP  37  -0.862  -7.434  -9.550
  251    HB2  TRP  37           HB2      TRP  37  -2.563  -8.101 -11.295
  252    HB3  TRP  37           HB1      TRP  37  -1.321  -9.289 -10.916
  253    HD1  TRP  37           HD       TRP  37  -5.102  -8.678 -10.568
  254    HE1  TRP  37           HE1      TRP  37  -6.229 -10.903  -9.977
  255    HE3  TRP  37          3HE       TRP  37  -0.924 -11.531  -9.743
  256    HZ2  TRP  37           HZ2      TRP  37  -5.462 -13.528  -9.269
  257    HZ3  TRP  37           HZ3      TRP  37  -1.222 -13.879  -9.110
  258    HH2  TRP  37           HH       TRP  37  -3.439 -14.851  -8.877
  259    H    GLU  38           H        GLU  38  -3.246  -7.741  -7.245
  260    HA   GLU  38           HA       GLU  38  -4.837  -5.582  -8.361
  261    HB2  GLU  38           HB2      GLU  38  -5.292  -7.378  -5.990
  262    HB3  GLU  38           HB1      GLU  38  -6.390  -6.095  -6.493
  263    HG2  GLU  38           HG2      GLU  38  -5.572  -8.396  -8.241
  264    HG3  GLU  38           HG1      GLU  38  -7.045  -8.378  -7.283
  265    H    CYS  39           H        CYS  39  -2.304  -6.093  -6.179
  266    HA   CYS  39           HA       CYS  39  -2.852  -3.729  -4.617
  267    HB2  CYS  39           HB2      CYS  39  -0.334  -5.398  -4.842
  268    HB3  CYS  39           HB1      CYS  39  -0.533  -4.025  -3.764
  269    H    TYR  40           H        TYR  40  -2.245  -1.754  -5.104
  270    HA   TYR  40           HA       TYR  40  -1.028  -1.268  -7.672
  271    HB2  TYR  40           HB2      TYR  40  -1.832   0.729  -5.538
  272    HB3  TYR  40           HB1      TYR  40  -1.582   1.037  -7.250
  273    HD1  TYR  40           HD1      TYR  40  -3.921  -0.027  -4.714
  274    HD2  TYR  40           HD2      TYR  40  -3.257   0.189  -8.905
  275    HE1  TYR  40           HE1      TYR  40  -6.314  -0.378  -5.096
  276    HE2  TYR  40           HE2      TYR  40  -5.659  -0.159  -9.304
  277    HH   TYR  40           HH       TYR  40  -7.977   0.073  -6.836
  278    H    GLN  41           H        GLN  41   1.103  -0.922  -7.846
  279    HA   GLN  41           HA       GLN  41   2.603  -0.924  -5.363
  280    HB2  GLN  41           HB2      GLN  41   4.597  -1.392  -6.808
  281    HB3  GLN  41           HB1      GLN  41   3.352  -2.628  -6.826
  282    HG2  GLN  41           HG2      GLN  41   2.572  -1.833  -8.984
  283    HG3  GLN  41           HG1      GLN  41   3.773  -0.539  -8.955
  284   HE21  GLN  41          1HE2      GLN  41   5.912  -1.034  -9.365
  285   HE22  GLN  41          2HE2      GLN  41   6.391  -2.585  -9.964
  286    H    CYS  42           H        CYS  42   4.024   0.582  -4.756
  287    HA   CYS  42           HA       CYS  42   3.741   3.128  -6.022
  288    HB2  CYS  42           HB2      CYS  42   5.206   2.289  -3.510
  289    HB3  CYS  42           HB1      CYS  42   5.032   3.952  -4.063
  Start of MODEL   14
    1    H    PCA   1           H        PGL   1 -10.440   3.389   0.455
    2    HA   PCA   1           HA       PGL   1  -9.786   5.868   0.105
    3    HB2  PCA   1           HB1      PGL   1 -10.982   7.308   1.404
    4    HB3  PCA   1           HB2      PGL   1 -10.382   6.499   2.879
    5    HG2  PCA   1           HG1      PGL   1 -12.993   6.236   1.606
    6    HG3  PCA   1           HG2      PGL   1 -12.407   5.503   3.138
    7    H    GLU   2           H        GLU   2  -9.518   3.486   2.579
    8    HA   GLU   2           HA       GLU   2  -6.997   4.539   3.506
    9    HB2  GLU   2           HB2      GLU   2  -8.440   2.006   4.311
   10    HB3  GLU   2           HB1      GLU   2  -7.015   2.672   5.093
   11    HG2  GLU   2           HG2      GLU   2  -9.743   3.942   4.979
   12    HG3  GLU   2           HG1      GLU   2  -9.001   3.171   6.378
   13    H    ALA   3           H        ALA   3  -5.199   4.035   2.660
   14    HA   ALA   3           HA       ALA   3  -4.982   1.830   0.780
   15    HB1  ALA   3           HB1      ALA   3  -4.135   4.017   0.070
   16    HB2  ALA   3           HB2      ALA   3  -2.814   2.857   0.201
   17    HB3  ALA   3           HB3      ALA   3  -3.058   4.060   1.463
   18    H    PHE   4           H        PHE   4  -4.252   0.001   1.451
   19    HA   PHE   4           HA       PHE   4  -2.888  -0.248   4.016
   20    HB2  PHE   4           HB2      PHE   4  -4.015  -2.327   2.132
   21    HB3  PHE   4           HB1      PHE   4  -3.368  -2.653   3.737
   22    HD1  PHE   4           HD1      PHE   4  -6.237  -1.767   1.842
   23    HD2  PHE   4           HD2      PHE   4  -4.520  -1.502   5.713
   24    HE1  PHE   4           HE1      PHE   4  -8.448  -1.269   2.784
   25    HE2  PHE   4           HE2      PHE   4  -6.725  -1.001   6.666
   26    HZ   PHE   4           HZ       PHE   4  -8.696  -0.881   5.195
   27    H    CYS   5           H        CYS   5  -0.813  -0.879   4.155
   28    HA   CYS   5           HA       CYS   5   0.621  -0.782   1.614
   29    HB2  CYS   5           HB2      CYS   5   1.583  -0.190   4.394
   30    HB3  CYS   5           HB1      CYS   5   2.502   0.017   2.903
   31    H    TYR   6           H        TYR   6   1.735  -2.376   0.942
   32    HA   TYR   6           HA       TYR   6   2.483  -4.565   2.776
   33    HB2  TYR   6           HB2      TYR   6   1.596  -4.864  -0.076
   34    HB3  TYR   6           HB1      TYR   6   2.035  -6.158   0.992
   35    HD1  TYR   6           HD1      TYR   6  -0.577  -3.665   0.251
   36    HD2  TYR   6           HD2      TYR   6   0.491  -6.991   2.677
   37    HE1  TYR   6           HE1      TYR   6  -2.857  -3.840   0.996
   38    HE2  TYR   6           HE2      TYR   6  -1.808  -7.172   3.448
   39    HH   TYR   6           HH       TYR   6  -4.377  -5.286   1.993
   40    H    SER   7           H        SER   7   4.506  -4.685   2.855
   41    HA   SER   7           HA       SER   7   6.298  -3.419   0.987
   42    HB2  SER   7           HB2      SER   7   6.774  -5.175   3.374
   43    HB3  SER   7           HB1      SER   7   8.041  -4.251   2.544
   44    HG   SER   7           HG       SER   7   6.473  -2.404   3.031
   45    H    ASP   8           H        ASP   8   4.835  -5.342  -0.302
   46    HA   ASP   8           HA       ASP   8   6.828  -7.022  -1.426
   47    HB2  ASP   8           HB2      ASP   8   6.197  -8.505   0.377
   48    HB3  ASP   8           HB1      ASP   8   4.488  -8.247   0.046
   49    H    ARG   9           H        ARG   9   6.226  -7.720  -3.435
   50    HA   ARG   9           HA       ARG   9   4.389  -5.985  -4.773
   51    HB2  ARG   9           HB2      ARG   9   6.204  -8.198  -5.713
   52    HB3  ARG   9           HB1      ARG   9   5.095  -7.395  -6.805
   53    HG2  ARG   9           HG2      ARG   9   7.364  -6.492  -6.991
   54    HG3  ARG   9           HG1      ARG   9   6.230  -5.271  -6.436
   55    HD2  ARG   9           HD2      ARG   9   8.359  -5.137  -5.236
   56    HD3  ARG   9           HD1      ARG   9   7.031  -5.552  -4.155
   57    HE   ARG   9           HE       ARG   9   8.472  -7.806  -5.198
   58   HH11  ARG   9          HH11      ARG   9   8.350  -5.426  -2.582
   59   HH12  ARG   9          HH12      ARG   9   9.246  -6.371  -1.492
   60   HH21  ARG   9          HH21      ARG   9   9.713  -9.097  -3.669
   61   HH22  ARG   9          HH22      ARG   9  10.039  -8.473  -2.118
   62    H    PHE  10           H        PHE  10   4.137  -9.136  -3.411
   63    HA   PHE  10           HA       PHE  10   1.855  -9.775  -5.091
   64    HB2  PHE  10           HB2      PHE  10   3.387 -11.560  -3.187
   65    HB3  PHE  10           HB1      PHE  10   2.197 -12.060  -4.388
   66    HD1  PHE  10           HD1      PHE  10   5.644 -11.243  -3.753
   67    HD2  PHE  10           HD2      PHE  10   2.748 -11.815  -6.819
   68    HE1  PHE  10           HE1      PHE  10   7.441 -11.457  -5.402
   69    HE2  PHE  10           HE2      PHE  10   4.544 -12.031  -8.473
   70    HZ   PHE  10           HZ       PHE  10   6.895 -11.854  -7.773
   71    H    CYS  11           H        CYS  11   2.265  -7.957  -2.656
   72    HA   CYS  11           HA       CYS  11   0.910  -7.085  -1.031
   73    HB2  CYS  11           HB2      CYS  11  -1.087  -9.238  -1.739
   74    HB3  CYS  11           HB1      CYS  11  -1.398  -7.702  -0.940
   75    H    GLN  12           H        GLN  12   2.710  -9.522  -0.557
   76    HA   GLN  12           HA       GLN  12   1.270 -11.044   1.395
   77    HB2  GLN  12           HB2      GLN  12   4.172 -11.107   0.661
   78    HB3  GLN  12           HB1      GLN  12   3.344 -12.276   1.681
   79    HG2  GLN  12           HG2      GLN  12   1.956 -12.961  -0.156
   80    HG3  GLN  12           HG1      GLN  12   2.642 -11.699  -1.175
   81   HE21  GLN  12          1HE2      GLN  12   4.740 -11.870  -1.817
   82   HE22  GLN  12          2HE2      GLN  12   5.578 -13.377  -1.900
   83    H    ASN  13           H        ASN  13   3.219  -8.169   1.656
   84    HA   ASN  13           HA       ASN  13   3.623  -8.911   4.480
   85    HB2  ASN  13           HB2      ASN  13   5.445  -7.117   2.865
   86    HB3  ASN  13           HB1      ASN  13   5.643  -7.486   4.571
   87   HD21  ASN  13          HD21      ASN  13   7.560  -7.957   2.567
   88   HD22  ASN  13          HD22      ASN  13   7.815  -9.652   2.445
   89    H    TYR  14           H        TYR  14   1.710  -8.048   5.166
   90    HA   TYR  14           HA       TYR  14   0.929  -5.369   4.694
   91    HB2  TYR  14           HB2      TYR  14  -0.652  -7.157   5.319
   92    HB3  TYR  14           HB1      TYR  14   0.117  -7.281   6.893
   93    HD1  TYR  14           HD1      TYR  14  -0.647  -5.957   8.683
   94    HD2  TYR  14           HD2      TYR  14  -1.785  -4.940   4.714
   95    HE1  TYR  14           HE1      TYR  14  -2.236  -4.313   9.560
   96    HE2  TYR  14           HE2      TYR  14  -3.364  -3.292   5.582
   97    HH   TYR  14           HH       TYR  14  -4.681  -2.978   7.761
   98    H    ILE  15           H        ILE  15   1.845  -3.595   5.576
   99    HA   ILE  15           HA       ILE  15   3.190  -3.906   8.183
  100    HB   ILE  15           HB       ILE  15   4.541  -1.913   7.644
  101   HG12  ILE  15          HG12      ILE  15   3.295  -2.116   4.884
  102   HG13  ILE  15          HG11      ILE  15   2.925  -0.870   6.068
  103   HG21  ILE  15          HG21      ILE  15   4.700  -4.103   5.583
  104   HG22  ILE  15          HG22      ILE  15   5.396  -4.142   7.198
  105   HG23  ILE  15          HG23      ILE  15   6.001  -2.988   6.005
  106   HD11  ILE  15          HD11      ILE  15   5.215  -0.062   5.945
  107   HD12  ILE  15          HD12      ILE  15   4.461  -0.075   4.351
  108   HD13  ILE  15          HD13      ILE  15   5.613  -1.337   4.793
  109    H    GLY  16           H        GLY  16   0.425  -2.889   6.974
  110    HA2  GLY  16           HA2      GLY  16  -1.028  -1.921   8.734
  111    HA3  GLY  16           HA1      GLY  16   0.215  -0.681   8.902
  112    H    SER  17           H        SER  17  -1.403   0.881   8.403
  113    HA   SER  17           HA       SER  17  -1.759   1.162   5.542
  114    HB2  SER  17           HB2      SER  17  -4.125   1.998   6.173
  115    HB3  SER  17           HB1      SER  17  -3.843   0.261   6.117
  116    HG   SER  17           HG       SER  17  -4.271   1.947   8.282
  117    H    ILE  18           H        ILE  18  -1.250   3.182   4.925
  118    HA   ILE  18           HA       ILE  18  -1.489   5.398   6.761
  119    HB   ILE  18           HB       ILE  18   0.834   6.197   6.105
  120   HG12  ILE  18          HG12      ILE  18   1.199   3.293   5.334
  121   HG13  ILE  18          HG11      ILE  18   1.235   4.674   4.249
  122   HG21  ILE  18          HG21      ILE  18   0.656   3.797   7.905
  123   HG22  ILE  18          HG22      ILE  18   0.449   5.491   8.358
  124   HG23  ILE  18          HG23      ILE  18   2.026   4.902   7.836
  125   HD11  ILE  18          HD11      ILE  18   3.206   4.089   6.442
  126   HD12  ILE  18          HD12      ILE  18   3.258   5.478   5.355
  127   HD13  ILE  18          HD13      ILE  18   3.469   3.846   4.715
  128    HA   PRO  19           HA       PRO  19  -2.649   7.197   2.884
  129    HB2  PRO  19           HB2      PRO  19  -2.690   9.803   3.534
  130    HB3  PRO  19           HB1      PRO  19  -3.878   8.669   4.182
  131    HG2  PRO  19           HG2      PRO  19  -1.433   9.791   5.485
  132    HG3  PRO  19           HG1      PRO  19  -3.041   9.507   6.175
  133    HD2  PRO  19           HD2      PRO  19  -0.886   7.828   6.520
  134    HD3  PRO  19           HD1      PRO  19  -2.579   7.310   6.633
  135    H    ASP  20           H        ASP  20   0.355   7.504   4.211
  136    HA   ASP  20           HA       ASP  20   1.468   8.920   1.885
  137    HB2  ASP  20           HB2      ASP  20   3.387   9.454   3.327
  138    HB3  ASP  20           HB1      ASP  20   1.899  10.032   4.064
  139    H    CYS  21           H        CYS  21   0.627   6.306   1.775
  140    HA   CYS  21           HA       CYS  21   2.426   4.315   2.517
  141    HB2  CYS  21           HB2      CYS  21  -0.003   4.116   1.773
  142    HB3  CYS  21           HB1      CYS  21   0.613   4.167   0.124
  143    H    CYS  22           H        CYS  22   2.321   6.281  -0.437
  144    HA   CYS  22           HA       CYS  22   4.315   4.710  -1.751
  145    HB2  CYS  22           HB2      CYS  22   3.157   7.412  -2.421
  146    HB3  CYS  22           HB1      CYS  22   4.368   6.605  -3.411
  147    H    PHE  23           H        PHE  23   4.600   6.685   0.809
  148    HA   PHE  23           HA       PHE  23   7.292   7.538   0.064
  149    HB2  PHE  23           HB2      PHE  23   5.542   8.364   2.402
  150    HB3  PHE  23           HB1      PHE  23   7.170   8.962   2.102
  151    HD1  PHE  23           HD1      PHE  23   7.601  10.556   0.341
  152    HD2  PHE  23           HD2      PHE  23   3.674   9.068   1.011
  153    HE1  PHE  23           HE1      PHE  23   6.685  12.335  -1.080
  154    HE2  PHE  23           HE2      PHE  23   2.752  10.848  -0.414
  155    HZ   PHE  23           HZ       PHE  23   4.259  12.482  -1.458
  156    H    GLY  24           H        GLY  24   5.833   4.934   1.168
  157    HA2  GLY  24           HA2      GLY  24   7.945   4.280   3.101
  158    HA3  GLY  24           HA1      GLY  24   6.284   3.712   3.264
  159    H    ARG  25           H        ARG  25   7.976   1.771   3.260
  160    HA   ARG  25           HA       ARG  25   8.701   0.828   0.642
  161    HB2  ARG  25           HB2      ARG  25   8.678  -0.543   3.316
  162    HB3  ARG  25           HB1      ARG  25   9.273  -1.269   1.839
  163    HG2  ARG  25           HG2      ARG  25  11.030   0.368   1.704
  164    HG3  ARG  25           HG1      ARG  25  10.386   1.205   3.121
  165    HD2  ARG  25           HD2      ARG  25  11.354  -1.645   3.064
  166    HD3  ARG  25           HD1      ARG  25  12.267  -0.281   3.703
  167    HE   ARG  25           HE       ARG  25  10.258  -0.011   5.233
  168   HH11  ARG  25          HH11      ARG  25  11.465  -3.163   4.129
  169   HH12  ARG  25          HH12      ARG  25  10.872  -4.012   5.483
  170   HH21  ARG  25          HH21      ARG  25   9.462  -1.216   7.122
  171   HH22  ARG  25          HH22      ARG  25   9.722  -2.890   7.190
  172    H    GLY  26           H        GLY  26   7.042   0.158  -0.718
  173    HA2  GLY  26           HA2      GLY  26   5.990  -2.187  -0.702
  174    HA3  GLY  26           HA1      GLY  26   5.026  -1.499   0.582
  175    H    SER  27           H        SER  27   3.720  -2.567  -1.156
  176    HA   SER  27           HA       SER  27   2.824  -0.807  -3.307
  177    HB2  SER  27           HB2      SER  27   1.762  -3.525  -2.548
  178    HB3  SER  27           HB1      SER  27   1.773  -2.753  -4.132
  179    HG   SER  27           HG       SER  27   3.568  -4.380  -3.009
  180    H    TYR  28           H        TYR  28   0.383  -0.558  -3.334
  181    HA   TYR  28           HA       TYR  28  -0.731  -0.687  -0.632
  182    HB2  TYR  28           HB2      TYR  28  -1.818   1.473  -0.911
  183    HB3  TYR  28           HB1      TYR  28  -0.082   1.652  -1.083
  184    HD1  TYR  28           HD1      TYR  28  -3.328   2.001  -2.698
  185    HD2  TYR  28           HD2      TYR  28   0.891   2.164  -3.394
  186    HE1  TYR  28           HE1      TYR  28  -3.707   3.181  -4.814
  187    HE2  TYR  28           HE2      TYR  28   0.507   3.322  -5.475
  188    HH   TYR  28           HH       TYR  28  -1.267   3.593  -7.142
  189    H    SER  29           H        SER  29  -2.839  -1.228  -0.476
  190    HA   SER  29           HA       SER  29  -4.375  -1.479  -2.945
  191    HB2  SER  29           HB2      SER  29  -5.254  -3.662  -2.188
  192    HB3  SER  29           HB1      SER  29  -3.504  -3.735  -2.390
  193    HG   SER  29           HG       SER  29  -4.950  -4.220  -0.177
  194    H    PHE  30           H        PHE  30  -6.751  -1.799  -2.319
  195    HA   PHE  30           HA       PHE  30  -7.252  -0.060  -0.036
  196    HB2  PHE  30           HB2      PHE  30  -8.924  -0.626  -2.485
  197    HB3  PHE  30           HB1      PHE  30  -9.460   0.388  -1.152
  198    HD1  PHE  30           HD1      PHE  30  -7.872   0.375  -4.281
  199    HD2  PHE  30           HD2      PHE  30  -7.782   2.315  -0.495
  200    HE1  PHE  30           HE1      PHE  30  -6.703   2.282  -5.289
  201    HE2  PHE  30           HE2      PHE  30  -6.622   4.229  -1.499
  202    HZ   PHE  30           HZ       PHE  30  -6.076   4.215  -3.900
  203    H    GLU  31           H        GLU  31  -7.053  -3.161  -0.549
  204    HA   GLU  31           HA       GLU  31  -9.159  -3.795   1.378
  205    HB2  GLU  31           HB2      GLU  31  -8.467  -5.458  -1.045
  206    HB3  GLU  31           HB1      GLU  31  -9.526  -5.977   0.256
  207    HG2  GLU  31           HG2      GLU  31 -10.996  -4.044  -0.268
  208    HG3  GLU  31           HG1      GLU  31  -9.976  -3.717  -1.665
  209    H    LEU  32           H        LEU  32  -8.760  -5.802   2.539
  210    HA   LEU  32           HA       LEU  32  -5.987  -5.888   3.352
  211    HB2  LEU  32           HB2      LEU  32  -8.482  -7.055   4.539
  212    HB3  LEU  32           HB1      LEU  32  -6.881  -7.316   5.195
  213    HG   LEU  32           HG       LEU  32  -8.200  -4.616   4.921
  214   HD11  LEU  32          HD11      LEU  32  -7.744  -6.345   7.347
  215   HD12  LEU  32          HD12      LEU  32  -9.301  -6.057   6.573
  216   HD13  LEU  32          HD13      LEU  32  -8.436  -4.723   7.337
  217   HD21  LEU  32          HD21      LEU  32  -5.657  -5.486   6.288
  218   HD22  LEU  32          HD22      LEU  32  -6.350  -3.862   6.300
  219   HD23  LEU  32          HD23      LEU  32  -5.758  -4.544   4.800
  220    H    GLN  33           H        GLN  33  -4.637  -7.319   2.890
  221    HA   GLN  33           HA       GLN  33  -3.589  -9.060   1.953
  222    HB2  GLN  33           HB2      GLN  33  -5.734 -10.617   3.388
  223    HB3  GLN  33           HB1      GLN  33  -4.215 -11.280   2.809
  224    HG2  GLN  33           HG2      GLN  33  -3.009  -9.759   4.344
  225    HG3  GLN  33           HG1      GLN  33  -4.561  -9.191   4.951
  226   HE21  GLN  33          1HE2      GLN  33  -4.214  -9.924   7.027
  227   HE22  GLN  33          2HE2      GLN  33  -4.204 -11.609   7.425
  228    HA   PRO  34           HA       PRO  34  -6.496 -10.000  -1.490
  229    HB2  PRO  34           HB2      PRO  34  -6.110  -7.989  -3.173
  230    HB3  PRO  34           HB1      PRO  34  -7.087  -7.747  -1.724
  231    HG2  PRO  34           HG2      PRO  34  -4.320  -6.826  -2.298
  232    HG3  PRO  34           HG1      PRO  34  -5.571  -6.073  -1.297
  233    HD2  PRO  34           HD2      PRO  34  -3.412  -7.734  -0.427
  234    HD3  PRO  34           HD1      PRO  34  -4.727  -7.068   0.559
  235    HA   PRO  35           HA       PRO  35  -3.305 -11.830  -4.057
  236    HB2  PRO  35           HB2      PRO  35  -4.395 -11.639  -6.573
  237    HB3  PRO  35           HB1      PRO  35  -4.876 -12.853  -5.384
  238    HG2  PRO  35           HG2      PRO  35  -6.184 -10.261  -6.082
  239    HG3  PRO  35           HG1      PRO  35  -6.925 -11.840  -5.775
  240    HD2  PRO  35           HD2      PRO  35  -6.914  -9.911  -3.920
  241    HD3  PRO  35           HD1      PRO  35  -6.745 -11.623  -3.490
  242    HA   PRO  36           HA       PRO  36  -0.291  -8.933  -5.526
  243    HB2  PRO  36           HB2      PRO  36  -0.080 -10.094  -8.159
  244    HB3  PRO  36           HB1      PRO  36   1.071 -10.202  -6.835
  245    HG2  PRO  36           HG2      PRO  36  -0.963 -12.107  -7.724
  246    HG3  PRO  36           HG1      PRO  36   0.431 -12.380  -6.670
  247    HD2  PRO  36           HD2      PRO  36  -2.123 -12.435  -5.807
  248    HD3  PRO  36           HD1      PRO  36  -0.779 -11.910  -4.764
  249    H    TRP  37           H        TRP  37  -2.759  -9.665  -7.966
  250    HA   TRP  37           HA       TRP  37  -2.235  -7.314  -9.488
  251    HB2  TRP  37           HB2      TRP  37  -4.323  -7.951 -10.755
  252    HB3  TRP  37           HB1      TRP  37  -3.030  -9.137 -10.736
  253    HD1  TRP  37           HD       TRP  37  -6.569  -8.554  -9.245
  254    HE1  TRP  37           HE1      TRP  37  -7.545 -10.853  -8.632
  255    HE3  TRP  37          3HE       TRP  37  -2.441 -11.473 -10.078
  256    HZ2  TRP  37           HZ2      TRP  37  -6.694 -13.529  -8.492
  257    HZ3  TRP  37           HZ3      TRP  37  -2.619 -13.891  -9.657
  258    HH2  TRP  37           HH       TRP  37  -4.701 -14.889  -8.886
  259    H    GLU  38           H        GLU  38  -3.856  -7.654  -6.639
  260    HA   GLU  38           HA       GLU  38  -5.739  -5.522  -7.236
  261    HB2  GLU  38           HB2      GLU  38  -5.377  -7.307  -4.864
  262    HB3  GLU  38           HB1      GLU  38  -6.601  -6.038  -4.951
  263    HG2  GLU  38           HG2      GLU  38  -6.360  -8.313  -6.892
  264    HG3  GLU  38           HG1      GLU  38  -7.460  -8.335  -5.523
  265    H    CYS  39           H        CYS  39  -2.615  -5.846  -6.122
  266    HA   CYS  39           HA       CYS  39  -2.793  -3.414  -4.522
  267    HB2  CYS  39           HB2      CYS  39  -0.499  -5.332  -4.927
  268    HB3  CYS  39           HB1      CYS  39  -0.401  -3.850  -3.986
  269    H    TYR  40           H        TYR  40  -1.597  -1.616  -5.026
  270    HA   TYR  40           HA       TYR  40  -0.781  -1.464  -7.835
  271    HB2  TYR  40           HB2      TYR  40  -1.688   0.787  -6.027
  272    HB3  TYR  40           HB1      TYR  40  -1.465   0.843  -7.775
  273    HD1  TYR  40           HD1      TYR  40  -3.767   0.185  -5.109
  274    HD2  TYR  40           HD2      TYR  40  -2.996  -0.601  -9.211
  275    HE1  TYR  40           HE1      TYR  40  -6.100  -0.503  -5.406
  276    HE2  TYR  40           HE2      TYR  40  -5.316  -1.279  -9.525
  277    HH   TYR  40           HH       TYR  40  -7.147  -2.163  -8.135
  278    H    GLN  41           H        GLN  41   1.169  -0.424  -8.244
  279    HA   GLN  41           HA       GLN  41   2.940  -0.355  -5.932
  280    HB2  GLN  41           HB2      GLN  41   3.506  -0.671  -8.879
  281    HB3  GLN  41           HB1      GLN  41   4.758  -0.522  -7.652
  282    HG2  GLN  41           HG2      GLN  41   3.973  -2.541  -6.566
  283    HG3  GLN  41           HG1      GLN  41   2.662  -2.681  -7.724
  284   HE21  GLN  41          1HE2      GLN  41   4.338  -1.971 -10.049
  285   HE22  GLN  41          2HE2      GLN  41   5.351  -3.348 -10.284
  286    H    CYS  42           H        CYS  42   4.356   1.355  -5.617
  287    HA   CYS  42           HA       CYS  42   3.360   3.831  -6.696
  288    HB2  CYS  42           HB2      CYS  42   5.257   3.281  -4.397
  289    HB3  CYS  42           HB1      CYS  42   4.701   4.879  -4.881
  Start of MODEL   15
    1    H    PCA   1           H        PGL   1  -9.771   4.572   1.323
    2    HA   PCA   1           HA       PGL   1 -10.704   5.991   3.183
    3    HB2  PCA   1           HB1      PGL   1 -12.170   4.876   4.536
    4    HB3  PCA   1           HB2      PGL   1 -10.837   3.842   5.117
    5    HG2  PCA   1           HG1      PGL   1 -12.927   3.224   3.143
    6    HG3  PCA   1           HG2      PGL   1 -11.726   2.127   3.906
    7    H    GLU   2           H        GLU   2  -8.543   3.305   3.119
    8    HA   GLU   2           HA       GLU   2  -6.401   4.877   4.248
    9    HB2  GLU   2           HB2      GLU   2  -7.144   2.122   5.272
   10    HB3  GLU   2           HB1      GLU   2  -5.657   2.978   5.620
   11    HG2  GLU   2           HG2      GLU   2  -6.919   4.652   6.858
   12    HG3  GLU   2           HG1      GLU   2  -8.415   3.783   6.505
   13    H    ALA   3           H        ALA   3  -4.429   4.091   3.394
   14    HA   ALA   3           HA       ALA   3  -4.799   2.105   1.315
   15    HB1  ALA   3           HB1      ALA   3  -2.472   3.938   1.951
   16    HB2  ALA   3           HB2      ALA   3  -3.654   4.182   0.667
   17    HB3  ALA   3           HB3      ALA   3  -2.537   2.821   0.589
   18    H    PHE   4           H        PHE   4  -4.351   0.118   1.822
   19    HA   PHE   4           HA       PHE   4  -3.040  -0.522   4.304
   20    HB2  PHE   4           HB2      PHE   4  -4.130  -2.309   2.119
   21    HB3  PHE   4           HB1      PHE   4  -3.599  -2.868   3.692
   22    HD1  PHE   4           HD1      PHE   4  -6.354  -2.035   1.787
   23    HD2  PHE   4           HD2      PHE   4  -4.849  -1.577   5.717
   24    HE1  PHE   4           HE1      PHE   4  -8.645  -1.690   2.621
   25    HE2  PHE   4           HE2      PHE   4  -7.139  -1.228   6.557
   26    HZ   PHE   4           HZ       PHE   4  -9.039  -1.294   4.989
   27    H    CYS   5           H        CYS   5  -0.930  -0.635   4.414
   28    HA   CYS   5           HA       CYS   5   0.599  -0.739   1.965
   29    HB2  CYS   5           HB2      CYS   5   1.416  -0.178   4.802
   30    HB3  CYS   5           HB1      CYS   5   2.482  -0.105   3.404
   31    H    TYR   6           H        TYR   6   1.636  -2.412   1.306
   32    HA   TYR   6           HA       TYR   6   2.431  -4.517   3.196
   33    HB2  TYR   6           HB2      TYR   6   1.778  -4.960   0.248
   34    HB3  TYR   6           HB1      TYR   6   2.138  -6.152   1.463
   35    HD1  TYR   6           HD1      TYR   6  -0.462  -3.816   0.296
   36    HD2  TYR   6           HD2      TYR   6   0.472  -7.013   2.930
   37    HE1  TYR   6           HE1      TYR   6  -2.828  -4.095   0.779
   38    HE2  TYR   6           HE2      TYR   6  -1.872  -7.305   3.434
   39    HH   TYR   6           HH       TYR   6  -4.382  -5.654   1.643
   40    H    SER   7           H        SER   7   4.493  -4.751   3.292
   41    HA   SER   7           HA       SER   7   6.183  -3.067   1.746
   42    HB2  SER   7           HB2      SER   7   7.953  -4.288   3.064
   43    HB3  SER   7           HB1      SER   7   6.663  -3.523   4.015
   44    HG   SER   7           HG       SER   7   7.387  -5.948   4.262
   45    H    ASP   8           H        ASP   8   5.280  -6.356   1.819
   46    HA   ASP   8           HA       ASP   8   6.989  -7.318  -0.241
   47    HB2  ASP   8           HB2      ASP   8   6.140  -8.901   1.322
   48    HB3  ASP   8           HB1      ASP   8   4.484  -8.377   1.054
   49    H    ARG   9           H        ARG   9   6.648  -7.397  -2.400
   50    HA   ARG   9           HA       ARG   9   4.609  -5.631  -3.377
   51    HB2  ARG   9           HB2      ARG   9   6.972  -6.907  -4.721
   52    HB3  ARG   9           HB1      ARG   9   5.721  -6.111  -5.660
   53    HG2  ARG   9           HG2      ARG   9   7.514  -4.552  -5.334
   54    HG3  ARG   9           HG1      ARG   9   6.150  -4.023  -4.361
   55    HD2  ARG   9           HD2      ARG   9   8.166  -3.758  -3.077
   56    HD3  ARG   9           HD1      ARG   9   7.230  -5.078  -2.384
   57    HE   ARG   9           HE       ARG   9   9.150  -5.923  -4.318
   58   HH11  ARG   9          HH11      ARG   9   8.675  -5.198  -0.852
   59   HH12  ARG   9          HH12      ARG   9  10.046  -6.057  -0.342
   60   HH21  ARG   9          HH21      ARG   9  11.039  -7.121  -3.586
   61   HH22  ARG   9          HH22      ARG   9  11.412  -7.199  -1.931
   62    H    PHE  10           H        PHE  10   4.292  -8.704  -2.555
   63    HA   PHE  10           HA       PHE  10   2.519  -9.260  -4.799
   64    HB2  PHE  10           HB2      PHE  10   3.867 -11.184  -2.883
   65    HB3  PHE  10           HB1      PHE  10   2.740 -11.643  -4.151
   66    HD1  PHE  10           HD1      PHE  10   3.382 -11.260  -6.540
   67    HD2  PHE  10           HD2      PHE  10   6.139 -10.841  -3.333
   68    HE1  PHE  10           HE1      PHE  10   5.242 -11.425  -8.125
   69    HE2  PHE  10           HE2      PHE  10   8.015 -11.008  -4.917
   70    HZ   PHE  10           HZ       PHE  10   7.564 -11.299  -7.317
   71    H    CYS  11           H        CYS  11   2.382  -7.791  -2.049
   72    HA   CYS  11           HA       CYS  11   0.635  -7.177  -0.679
   73    HB2  CYS  11           HB2      CYS  11  -1.015  -9.402  -1.928
   74    HB3  CYS  11           HB1      CYS  11  -1.595  -8.011  -1.025
   75    H    GLN  12           H        GLN  12   2.559  -9.621  -0.216
   76    HA   GLN  12           HA       GLN  12   0.883 -11.186   1.575
   77    HB2  GLN  12           HB2      GLN  12   3.718 -11.656   0.678
   78    HB3  GLN  12           HB1      GLN  12   2.770 -12.752   1.678
   79    HG2  GLN  12           HG2      GLN  12   1.154 -12.996  -0.108
   80    HG3  GLN  12           HG1      GLN  12   2.087 -11.899  -1.124
   81   HE21  GLN  12          1HE2      GLN  12   2.379 -13.421  -2.683
   82   HE22  GLN  12          2HE2      GLN  12   3.442 -14.771  -2.526
   83    H    ASN  13           H        ASN  13   2.748  -8.469   2.026
   84    HA   ASN  13           HA       ASN  13   3.120  -9.254   4.840
   85    HB2  ASN  13           HB2      ASN  13   5.216  -7.849   3.176
   86    HB3  ASN  13           HB1      ASN  13   5.228  -7.799   4.927
   87   HD21  ASN  13          HD21      ASN  13   7.200  -8.877   3.104
   88   HD22  ASN  13          HD22      ASN  13   7.382 -10.546   3.494
   89    H    TYR  14           H        TYR  14   1.290  -8.197   5.406
   90    HA   TYR  14           HA       TYR  14   0.782  -5.467   4.837
   91    HB2  TYR  14           HB2      TYR  14  -1.005  -7.057   5.370
   92    HB3  TYR  14           HB1      TYR  14  -0.325  -7.283   6.974
   93    HD1  TYR  14           HD1      TYR  14  -0.882  -5.842   8.737
   94    HD2  TYR  14           HD2      TYR  14  -2.000  -4.814   4.776
   95    HE1  TYR  14           HE1      TYR  14  -2.300  -4.059   9.614
   96    HE2  TYR  14           HE2      TYR  14  -3.418  -3.019   5.645
   97    HH   TYR  14           HH       TYR  14  -4.627  -2.483   7.821
   98    H    ILE  15           H        ILE  15   1.762  -3.755   5.780
   99    HA   ILE  15           HA       ILE  15   3.097  -4.201   8.365
  100    HB   ILE  15           HB       ILE  15   4.521  -2.228   7.840
  101   HG12  ILE  15          HG12      ILE  15   3.245  -2.434   5.099
  102   HG13  ILE  15          HG11      ILE  15   3.000  -1.123   6.243
  103   HG21  ILE  15          HG21      ILE  15   5.338  -4.468   7.467
  104   HG22  ILE  15          HG22      ILE  15   5.936  -3.386   6.208
  105   HG23  ILE  15          HG23      ILE  15   4.608  -4.494   5.862
  106   HD11  ILE  15          HD11      ILE  15   5.603  -1.846   4.914
  107   HD12  ILE  15          HD12      ILE  15   5.358  -0.520   6.051
  108   HD13  ILE  15          HD13      ILE  15   4.549  -0.499   4.484
  109    H    GLY  16           H        GLY  16   0.491  -2.518   6.983
  110    HA2  GLY  16           HA2      GLY  16  -0.743  -1.640   9.146
  111    HA3  GLY  16           HA1      GLY  16   0.512  -0.414   8.984
  112    H    SER  17           H        SER  17  -1.732   0.761   8.816
  113    HA   SER  17           HA       SER  17  -2.236   1.074   5.962
  114    HB2  SER  17           HB2      SER  17  -4.658   1.426   6.510
  115    HB3  SER  17           HB1      SER  17  -4.077  -0.206   6.827
  116    HG   SER  17           HG       SER  17  -5.057   1.690   8.523
  117    H    ILE  18           H        ILE  18  -2.190   3.136   5.285
  118    HA   ILE  18           HA       ILE  18  -2.496   5.338   7.136
  119    HB   ILE  18           HB       ILE  18  -0.336   6.379   6.289
  120   HG12  ILE  18          HG12      ILE  18   0.250   3.520   5.487
  121   HG13  ILE  18          HG11      ILE  18   0.098   4.900   4.408
  122   HG21  ILE  18          HG21      ILE  18   1.110   5.251   7.932
  123   HG22  ILE  18          HG22      ILE  18  -0.125   4.000   8.107
  124   HG23  ILE  18          HG23      ILE  18  -0.485   5.663   8.562
  125   HD11  ILE  18          HD11      ILE  18   2.418   4.281   4.729
  126   HD12  ILE  18          HD12      ILE  18   2.244   4.483   6.473
  127   HD13  ILE  18          HD13      ILE  18   2.103   5.882   5.404
  128    HA   PRO  19           HA       PRO  19  -4.148   7.292   3.521
  129    HB2  PRO  19           HB2      PRO  19  -2.614   9.751   4.058
  130    HB3  PRO  19           HB1      PRO  19  -4.366   9.525   3.990
  131    HG2  PRO  19           HG2      PRO  19  -3.106   9.925   6.310
  132    HG3  PRO  19           HG1      PRO  19  -4.482   8.818   6.196
  133    HD2  PRO  19           HD2      PRO  19  -1.561   8.206   6.327
  134    HD3  PRO  19           HD1      PRO  19  -2.929   7.381   7.105
  135    H    ASP  20           H        ASP  20  -0.814   8.503   3.889
  136    HA   ASP  20           HA       ASP  20  -0.453   8.184   0.991
  137    HB2  ASP  20           HB2      ASP  20   1.302   9.660   2.986
  138    HB3  ASP  20           HB1      ASP  20   1.557   9.589   1.253
  139    H    CYS  21           H        CYS  21   0.246   6.236   0.550
  140    HA   CYS  21           HA       CYS  21   1.974   4.859   2.476
  141    HB2  CYS  21           HB2      CYS  21  -0.170   3.806   1.830
  142    HB3  CYS  21           HB1      CYS  21   0.392   3.727   0.167
  143    H    CYS  22           H        CYS  22   2.216   6.463  -0.522
  144    HA   CYS  22           HA       CYS  22   4.205   4.609  -1.465
  145    HB2  CYS  22           HB2      CYS  22   2.840   6.889  -2.845
  146    HB3  CYS  22           HB1      CYS  22   4.229   6.061  -3.551
  147    H    PHE  23           H        PHE  23   4.616   6.667   0.753
  148    HA   PHE  23           HA       PHE  23   6.966   8.008  -0.239
  149    HB2  PHE  23           HB2      PHE  23   5.810   7.656   2.521
  150    HB3  PHE  23           HB1      PHE  23   7.421   8.314   2.307
  151    HD1  PHE  23           HD1      PHE  23   3.846   8.959   2.023
  152    HD2  PHE  23           HD2      PHE  23   7.741  10.477   1.229
  153    HE1  PHE  23           HE1      PHE  23   2.910  11.218   1.718
  154    HE2  PHE  23           HE2      PHE  23   6.811  12.728   0.923
  155    HZ   PHE  23           HZ       PHE  23   4.388  13.100   1.170
  156    H    GLY  24           H        GLY  24   6.148   4.951   0.913
  157    HA2  GLY  24           HA2      GLY  24   8.983   4.179   0.982
  158    HA3  GLY  24           HA1      GLY  24   7.729   3.387   1.943
  159    H    ARG  25           H        ARG  25   9.521   2.340  -0.200
  160    HA   ARG  25           HA       ARG  25   7.767   1.823  -2.404
  161    HB2  ARG  25           HB2      ARG  25  10.417   0.543  -1.712
  162    HB3  ARG  25           HB1      ARG  25   9.499   0.260  -3.181
  163    HG2  ARG  25           HG2      ARG  25   9.715   2.687  -3.700
  164    HG3  ARG  25           HG1      ARG  25  10.816   2.817  -2.327
  165    HD2  ARG  25           HD2      ARG  25  11.185   0.992  -4.702
  166    HD3  ARG  25           HD1      ARG  25  12.013   2.525  -4.463
  167    HE   ARG  25           HE       ARG  25  12.931   1.458  -2.396
  168   HH11  ARG  25          HH11      ARG  25  11.989  -0.584  -5.163
  169   HH12  ARG  25          HH12      ARG  25  13.211  -1.732  -4.910
  170   HH21  ARG  25          HH21      ARG  25  14.613  -0.159  -2.071
  171   HH22  ARG  25          HH22      ARG  25  14.728  -1.475  -3.144
  172    H    GLY  26           H        GLY  26   6.312   0.311  -2.578
  173    HA2  GLY  26           HA2      GLY  26   6.446  -2.281  -1.702
  174    HA3  GLY  26           HA1      GLY  26   5.634  -1.358  -0.436
  175    H    SER  27           H        SER  27   3.645  -2.314  -0.805
  176    HA   SER  27           HA       SER  27   2.342  -1.488  -3.302
  177    HB2  SER  27           HB2      SER  27   1.784  -4.075  -1.855
  178    HB3  SER  27           HB1      SER  27   1.297  -3.602  -3.483
  179    HG   SER  27           HG       SER  27   3.698  -4.506  -2.504
  180    H    TYR  28           H        TYR  28   0.158  -0.880  -2.980
  181    HA   TYR  28           HA       TYR  28  -0.850  -1.134  -0.263
  182    HB2  TYR  28           HB2      TYR  28  -1.658   1.123  -0.165
  183    HB3  TYR  28           HB1      TYR  28   0.051   1.193  -0.548
  184    HD1  TYR  28           HD1      TYR  28  -3.328   1.928  -1.684
  185    HD2  TYR  28           HD2      TYR  28   0.773   1.913  -2.832
  186    HE1  TYR  28           HE1      TYR  28  -3.861   3.365  -3.578
  187    HE2  TYR  28           HE2      TYR  28   0.267   3.342  -4.720
  188    HH   TYR  28           HH       TYR  28  -1.709   3.921  -6.134
  189    H    SER  29           H        SER  29  -3.066  -1.280  -0.122
  190    HA   SER  29           HA       SER  29  -4.571  -1.250  -2.606
  191    HB2  SER  29           HB2      SER  29  -5.625  -3.430  -1.958
  192    HB3  SER  29           HB1      SER  29  -3.913  -3.577  -2.357
  193    HG   SER  29           HG       SER  29  -5.159  -4.220  -0.078
  194    H    PHE  30           H        PHE  30  -6.969  -1.489  -2.025
  195    HA   PHE  30           HA       PHE  30  -7.468  -0.137   0.523
  196    HB2  PHE  30           HB2      PHE  30  -9.038   0.002  -2.077
  197    HB3  PHE  30           HB1      PHE  30  -9.512   0.787  -0.571
  198    HD1  PHE  30           HD1      PHE  30  -7.789   2.423   0.459
  199    HD2  PHE  30           HD2      PHE  30  -7.716   1.165  -3.600
  200    HE1  PHE  30           HE1      PHE  30  -6.427   4.376  -0.115
  201    HE2  PHE  30           HE2      PHE  30  -6.346   3.122  -4.181
  202    HZ   PHE  30           HZ       PHE  30  -5.697   4.730  -2.426
  203    H    GLU  31           H        GLU  31  -7.118  -2.898  -0.134
  204    HA   GLU  31           HA       GLU  31  -9.544  -4.020   1.013
  205    HB2  GLU  31           HB2      GLU  31  -9.710  -4.226  -1.451
  206    HB3  GLU  31           HB1      GLU  31  -8.157  -5.037  -1.473
  207    HG2  GLU  31           HG2      GLU  31  -9.104  -6.881  -0.199
  208    HG3  GLU  31           HG1      GLU  31 -10.667  -6.057  -0.177
  209    H    LEU  32           H        LEU  32  -9.032  -5.803   2.328
  210    HA   LEU  32           HA       LEU  32  -6.206  -6.140   2.894
  211    HB2  LEU  32           HB2      LEU  32  -8.675  -7.140   4.312
  212    HB3  LEU  32           HB1      LEU  32  -7.047  -7.538   4.806
  213    HG   LEU  32           HG       LEU  32  -8.184  -4.737   4.746
  214   HD11  LEU  32          HD11      LEU  32  -9.247  -6.123   6.441
  215   HD12  LEU  32          HD12      LEU  32  -8.170  -4.928   7.175
  216   HD13  LEU  32          HD13      LEU  32  -7.660  -6.612   7.039
  217   HD21  LEU  32          HD21      LEU  32  -5.757  -4.812   4.428
  218   HD22  LEU  32          HD22      LEU  32  -5.602  -5.822   5.866
  219   HD23  LEU  32          HD23      LEU  32  -6.181  -4.166   6.009
  220    H    GLN  33           H        GLN  33  -5.097  -7.932   2.600
  221    HA   GLN  33           HA       GLN  33  -4.377  -9.709   1.461
  222    HB2  GLN  33           HB2      GLN  33  -6.912 -10.866   2.624
  223    HB3  GLN  33           HB1      GLN  33  -5.643 -11.829   1.877
  224    HG2  GLN  33           HG2      GLN  33  -5.298 -10.050   4.280
  225    HG3  GLN  33           HG1      GLN  33  -5.470 -11.805   4.312
  226   HE21  GLN  33          1HE2      GLN  33  -3.254  -9.989   5.088
  227   HE22  GLN  33          2HE2      GLN  33  -1.875 -10.601   4.255
  228    HA   PRO  34           HA       PRO  34  -6.898  -9.512  -2.327
  229    HB2  PRO  34           HB2      PRO  34  -5.563  -7.492  -3.602
  230    HB3  PRO  34           HB1      PRO  34  -6.934  -7.219  -2.526
  231    HG2  PRO  34           HG2      PRO  34  -4.168  -6.484  -2.120
  232    HG3  PRO  34           HG1      PRO  34  -5.560  -6.132  -1.090
  233    HD2  PRO  34           HD2      PRO  34  -3.550  -8.291  -0.864
  234    HD3  PRO  34           HD1      PRO  34  -4.593  -7.583   0.392
  235    HA   PRO  35           HA       PRO  35  -3.896 -11.762  -4.864
  236    HB2  PRO  35           HB2      PRO  35  -4.832 -10.242  -7.219
  237    HB3  PRO  35           HB1      PRO  35  -4.834 -11.984  -6.947
  238    HG2  PRO  35           HG2      PRO  35  -7.075 -10.500  -6.906
  239    HG3  PRO  35           HG1      PRO  35  -6.879 -11.950  -5.899
  240    HD2  PRO  35           HD2      PRO  35  -6.790  -9.073  -5.142
  241    HD3  PRO  35           HD1      PRO  35  -7.314 -10.481  -4.200
  242    HA   PRO  36           HA       PRO  36  -0.360  -9.100  -5.013
  243    HB2  PRO  36           HB2      PRO  36   1.011 -10.252  -7.147
  244    HB3  PRO  36           HB1      PRO  36   1.079 -10.792  -5.468
  245    HG2  PRO  36           HG2      PRO  36  -0.546 -11.856  -7.733
  246    HG3  PRO  36           HG1      PRO  36   0.269 -12.722  -6.418
  247    HD2  PRO  36           HD2      PRO  36  -2.377 -12.341  -6.405
  248    HD3  PRO  36           HD1      PRO  36  -1.435 -12.276  -4.901
  249    H    TRP  37           H        TRP  37  -2.003  -9.684  -8.031
  250    HA   TRP  37           HA       TRP  37  -0.755  -7.472  -9.381
  251    HB2  TRP  37           HB2      TRP  37  -2.365  -8.036 -11.223
  252    HB3  TRP  37           HB1      TRP  37  -1.291  -9.343 -10.752
  253    HD1  TRP  37           HD       TRP  37  -5.004  -8.257 -10.342
  254    HE1  TRP  37           HE1      TRP  37  -6.415 -10.376 -10.036
  255    HE3  TRP  37          3HE       TRP  37  -1.253 -11.738 -10.052
  256    HZ2  TRP  37           HZ2      TRP  37  -6.022 -13.126  -9.690
  257    HZ3  TRP  37           HZ3      TRP  37  -1.871 -14.092  -9.719
  258    HH2  TRP  37           HH       TRP  37  -4.206 -14.771  -9.543
  259    H    GLU  38           H        GLU  38  -3.239  -7.688  -7.169
  260    HA   GLU  38           HA       GLU  38  -4.832  -5.611  -8.390
  261    HB2  GLU  38           HB2      GLU  38  -5.233  -7.255  -5.908
  262    HB3  GLU  38           HB1      GLU  38  -6.331  -5.979  -6.418
  263    HG2  GLU  38           HG2      GLU  38  -5.610  -8.340  -8.128
  264    HG3  GLU  38           HG1      GLU  38  -7.015  -8.316  -7.079
  265    H    CYS  39           H        CYS  39  -2.481  -5.991  -5.835
  266    HA   CYS  39           HA       CYS  39  -3.057  -3.520  -4.532
  267    HB2  CYS  39           HB2      CYS  39  -0.465  -5.089  -4.608
  268    HB3  CYS  39           HB1      CYS  39  -0.779  -3.700  -3.578
  269    H    TYR  40           H        TYR  40  -2.165  -1.524  -4.831
  270    HA   TYR  40           HA       TYR  40  -1.046  -0.997  -7.454
  271    HB2  TYR  40           HB2      TYR  40  -1.619   0.917  -5.176
  272    HB3  TYR  40           HB1      TYR  40  -1.355   1.328  -6.860
  273    HD1  TYR  40           HD1      TYR  40  -3.749   0.091  -4.399
  274    HD2  TYR  40           HD2      TYR  40  -3.152   1.022  -8.499
  275    HE1  TYR  40           HE1      TYR  40  -6.177   0.063  -4.748
  276    HE2  TYR  40           HE2      TYR  40  -5.567   0.997  -8.865
  277    HH   TYR  40           HH       TYR  40  -7.552  -0.012  -7.811
  278    H    GLN  41           H        GLN  41   1.112  -0.307  -7.658
  279    HA   GLN  41           HA       GLN  41   2.691  -0.884  -5.272
  280    HB2  GLN  41           HB2      GLN  41   3.617  -0.813  -8.134
  281    HB3  GLN  41           HB1      GLN  41   4.538  -1.371  -6.744
  282    HG2  GLN  41           HG2      GLN  41   2.816  -3.142  -6.407
  283    HG3  GLN  41           HG1      GLN  41   2.082  -2.638  -7.927
  284   HE21  GLN  41          1HE2      GLN  41   4.685  -4.220  -6.417
  285   HE22  GLN  41          2HE2      GLN  41   5.414  -4.878  -7.837
  286    H    CYS  42           H        CYS  42   4.226   0.439  -4.529
  287    HA   CYS  42           HA       CYS  42   4.070   3.170  -5.458
  288    HB2  CYS  42           HB2      CYS  42   5.186   1.990  -2.906
  289    HB3  CYS  42           HB1      CYS  42   5.195   3.707  -3.300
  Start of MODEL   16
    1    H    PCA   1           H        PGL   1 -10.159   4.314   2.838
    2    HA   PCA   1           HA       PGL   1  -9.689   6.397   1.385
    3    HB2  PCA   1           HB1      PGL   1 -10.058   8.364   2.470
    4    HB3  PCA   1           HB2      PGL   1  -8.827   7.944   3.693
    5    HG2  PCA   1           HG1      PGL   1 -11.745   7.759   3.889
    6    HG3  PCA   1           HG2      PGL   1 -10.508   7.541   5.172
    7    H    GLU   2           H        GLU   2  -8.229   4.884   4.138
    8    HA   GLU   2           HA       GLU   2  -5.582   5.657   3.275
    9    HB2  GLU   2           HB2      GLU   2  -6.534   4.036   5.637
   10    HB3  GLU   2           HB1      GLU   2  -4.841   4.312   5.261
   11    HG2  GLU   2           HG2      GLU   2  -5.088   6.670   5.544
   12    HG3  GLU   2           HG1      GLU   2  -6.829   6.513   5.745
   13    H    ALA   3           H        ALA   3  -3.984   4.152   2.751
   14    HA   ALA   3           HA       ALA   3  -5.129   1.869   1.367
   15    HB1  ALA   3           HB1      ALA   3  -2.500   3.274   0.907
   16    HB2  ALA   3           HB2      ALA   3  -3.980   3.552  -0.006
   17    HB3  ALA   3           HB3      ALA   3  -3.199   1.974  -0.068
   18    H    PHE   4           H        PHE   4  -4.324  -0.098   1.695
   19    HA   PHE   4           HA       PHE   4  -2.852  -0.489   4.146
   20    HB2  PHE   4           HB2      PHE   4  -4.111  -2.494   2.249
   21    HB3  PHE   4           HB1      PHE   4  -3.455  -2.867   3.837
   22    HD1  PHE   4           HD1      PHE   4  -4.589  -1.893   5.882
   23    HD2  PHE   4           HD2      PHE   4  -6.308  -1.681   2.000
   24    HE1  PHE   4           HE1      PHE   4  -6.776  -1.411   6.882
   25    HE2  PHE   4           HE2      PHE   4  -8.507  -1.201   3.003
   26    HZ   PHE   4           HZ       PHE   4  -8.740  -1.065   5.443
   27    H    CYS   5           H        CYS   5  -0.780  -0.874   4.192
   28    HA   CYS   5           HA       CYS   5   0.662  -0.904   1.677
   29    HB2  CYS   5           HB2      CYS   5   1.455  -0.263   4.501
   30    HB3  CYS   5           HB1      CYS   5   2.571  -0.229   3.146
   31    H    TYR   6           H        TYR   6   1.679  -2.597   0.994
   32    HA   TYR   6           HA       TYR   6   2.529  -4.680   2.877
   33    HB2  TYR   6           HB2      TYR   6   1.660  -5.256   0.032
   34    HB3  TYR   6           HB1      TYR   6   2.026  -6.386   1.304
   35    HD1  TYR   6           HD1      TYR   6  -0.522  -4.104   0.019
   36    HD2  TYR   6           HD2      TYR   6   0.427  -6.942   3.024
   37    HE1  TYR   6           HE1      TYR   6  -2.864  -4.215   0.631
   38    HE2  TYR   6           HE2      TYR   6  -1.921  -7.062   3.666
   39    HH   TYR   6           HH       TYR   6  -4.408  -5.570   1.732
   40    H    SER   7           H        SER   7   4.565  -4.767   2.886
   41    HA   SER   7           HA       SER   7   6.216  -3.295   1.150
   42    HB2  SER   7           HB2      SER   7   7.962  -4.555   2.481
   43    HB3  SER   7           HB1      SER   7   6.778  -3.603   3.399
   44    HG   SER   7           HG       SER   7   7.280  -6.065   3.827
   45    H    ASP   8           H        ASP   8   5.337  -6.608   1.476
   46    HA   ASP   8           HA       ASP   8   6.966  -7.615  -0.643
   47    HB2  ASP   8           HB2      ASP   8   6.223  -9.167   1.023
   48    HB3  ASP   8           HB1      ASP   8   4.544  -8.710   0.783
   49    H    ARG   9           H        ARG   9   6.538  -7.669  -2.781
   50    HA   ARG   9           HA       ARG   9   4.431  -6.002  -3.732
   51    HB2  ARG   9           HB2      ARG   9   6.758  -7.345  -5.021
   52    HB3  ARG   9           HB1      ARG   9   5.447  -6.774  -6.034
   53    HG2  ARG   9           HG2      ARG   9   7.210  -5.115  -5.939
   54    HG3  ARG   9           HG1      ARG   9   5.760  -4.505  -5.167
   55    HD2  ARG   9           HD2      ARG   9   6.748  -4.972  -2.960
   56    HD3  ARG   9           HD1      ARG   9   8.201  -5.589  -3.752
   57    HE   ARG   9           HE       ARG   9   7.751  -3.056  -4.754
   58   HH11  ARG   9          HH11      ARG   9   8.539  -4.410  -1.568
   59   HH12  ARG   9          HH12      ARG   9   9.428  -3.060  -1.051
   60   HH21  ARG   9          HH21      ARG   9   8.922  -1.178  -4.013
   61   HH22  ARG   9          HH22      ARG   9   9.631  -1.162  -2.463
   62    H    PHE  10           H        PHE  10   4.213  -9.105  -2.815
   63    HA   PHE  10           HA       PHE  10   2.274  -9.744  -4.900
   64    HB2  PHE  10           HB2      PHE  10   3.563 -11.568  -2.863
   65    HB3  PHE  10           HB1      PHE  10   2.501 -12.069  -4.169
   66    HD1  PHE  10           HD1      PHE  10   3.287 -11.921  -6.502
   67    HD2  PHE  10           HD2      PHE  10   5.861 -11.175  -3.200
   68    HE1  PHE  10           HE1      PHE  10   5.226 -12.185  -7.954
   69    HE2  PHE  10           HE2      PHE  10   7.811 -11.441  -4.654
   70    HZ   PHE  10           HZ       PHE  10   7.493 -11.948  -7.048
   71    H    CYS  11           H        CYS  11   2.385  -8.114  -2.239
   72    HA   CYS  11           HA       CYS  11   0.810  -7.328  -0.775
   73    HB2  CYS  11           HB2      CYS  11  -1.069  -9.458  -1.838
   74    HB3  CYS  11           HB1      CYS  11  -1.504  -7.991  -0.974
   75    H    GLN  12           H        GLN  12   2.576  -9.864  -0.322
   76    HA   GLN  12           HA       GLN  12   0.964 -11.405   1.547
   77    HB2  GLN  12           HB2      GLN  12   3.867 -11.710   0.845
   78    HB3  GLN  12           HB1      GLN  12   2.872 -12.865   1.718
   79    HG2  GLN  12           HG2      GLN  12   1.564 -13.297  -0.220
   80    HG3  GLN  12           HG1      GLN  12   2.352 -11.989  -1.104
   81   HE21  GLN  12          1HE2      GLN  12   4.555 -12.218  -1.609
   82   HE22  GLN  12          2HE2      GLN  12   5.246 -13.786  -1.825
   83    H    ASN  13           H        ASN  13   2.901  -8.634   1.888
   84    HA   ASN  13           HA       ASN  13   3.296  -9.354   4.717
   85    HB2  ASN  13           HB2      ASN  13   5.350  -7.937   3.006
   86    HB3  ASN  13           HB1      ASN  13   5.423  -7.994   4.754
   87   HD21  ASN  13          HD21      ASN  13   7.329  -8.942   2.839
   88   HD22  ASN  13          HD22      ASN  13   7.538 -10.626   3.063
   89    H    TYR  14           H        TYR  14   1.578  -8.250   5.414
   90    HA   TYR  14           HA       TYR  14   1.066  -5.541   4.745
   91    HB2  TYR  14           HB2      TYR  14  -0.723  -7.025   5.467
   92    HB3  TYR  14           HB1      TYR  14   0.071  -7.274   7.013
   93    HD1  TYR  14           HD1      TYR  14  -1.491  -4.618   4.912
   94    HD2  TYR  14           HD2      TYR  14  -0.459  -5.924   8.822
   95    HE1  TYR  14           HE1      TYR  14  -2.755  -2.756   5.863
   96    HE2  TYR  14           HE2      TYR  14  -1.729  -4.079   9.782
   97    HH   TYR  14           HH       TYR  14  -3.919  -2.243   8.100
   98    H    ILE  15           H        ILE  15   2.091  -3.800   5.556
   99    HA   ILE  15           HA       ILE  15   3.567  -4.154   8.065
  100    HB   ILE  15           HB       ILE  15   4.944  -2.168   7.420
  101   HG12  ILE  15          HG12      ILE  15   3.623  -2.525   4.709
  102   HG13  ILE  15          HG11      ILE  15   3.354  -1.170   5.796
  103   HG21  ILE  15          HG21      ILE  15   5.028  -4.532   5.559
  104   HG22  ILE  15          HG22      ILE  15   5.804  -4.402   7.137
  105   HG23  ILE  15          HG23      ILE  15   6.341  -3.381   5.805
  106   HD11  ILE  15          HD11      ILE  15   5.697  -0.512   5.547
  107   HD12  ILE  15          HD12      ILE  15   4.873  -0.579   3.989
  108   HD13  ILE  15          HD13      ILE  15   5.965  -1.879   4.466
  109    H    GLY  16           H        GLY  16   1.140  -2.187   6.519
  110    HA2  GLY  16           HA2      GLY  16  -0.048  -1.368   8.822
  111    HA3  GLY  16           HA1      GLY  16   1.157  -0.131   8.460
  112    H    SER  17           H        SER  17  -0.975   1.100   8.296
  113    HA   SER  17           HA       SER  17  -1.645   1.194   5.489
  114    HB2  SER  17           HB2      SER  17  -4.104   1.503   6.212
  115    HB3  SER  17           HB1      SER  17  -3.446  -0.133   6.227
  116    HG   SER  17           HG       SER  17  -4.254   1.495   8.288
  117    H    ILE  18           H        ILE  18  -1.796   3.214   4.738
  118    HA   ILE  18           HA       ILE  18  -2.124   5.459   6.535
  119    HB   ILE  18           HB       ILE  18  -0.100   6.609   5.499
  120   HG12  ILE  18          HG12      ILE  18   0.606   3.777   4.690
  121   HG13  ILE  18          HG11      ILE  18   0.278   5.125   3.610
  122   HG21  ILE  18          HG21      ILE  18   1.528   5.633   7.026
  123   HG22  ILE  18          HG22      ILE  18   0.460   4.254   7.270
  124   HG23  ILE  18          HG23      ILE  18  -0.048   5.862   7.791
  125   HD11  ILE  18          HD11      ILE  18   2.602   4.929   5.518
  126   HD12  ILE  18          HD12      ILE  18   2.300   6.251   4.389
  127   HD13  ILE  18          HD13      ILE  18   2.673   4.639   3.782
  128    HA   PRO  19           HA       PRO  19  -4.398   7.301   3.194
  129    HB2  PRO  19           HB2      PRO  19  -2.562   9.647   3.420
  130    HB3  PRO  19           HB1      PRO  19  -4.329   9.607   3.398
  131    HG2  PRO  19           HG2      PRO  19  -3.067   9.970   5.690
  132    HG3  PRO  19           HG1      PRO  19  -4.472   8.895   5.609
  133    HD2  PRO  19           HD2      PRO  19  -1.571   8.200   5.774
  134    HD3  PRO  19           HD1      PRO  19  -2.980   7.415   6.519
  135    H    ASP  20           H        ASP  20  -1.041   8.454   2.812
  136    HA   ASP  20           HA       ASP  20  -1.165   7.458   0.061
  137    HB2  ASP  20           HB2      ASP  20  -0.725   9.903   0.235
  138    HB3  ASP  20           HB1      ASP  20   0.709   9.548   1.199
  139    H    CYS  21           H        CYS  21  -0.205   5.611  -0.138
  140    HA   CYS  21           HA       CYS  21   1.569   4.722   1.953
  141    HB2  CYS  21           HB2      CYS  21  -0.288   3.310   1.135
  142    HB3  CYS  21           HB1      CYS  21   0.485   3.238  -0.440
  143    H    CYS  22           H        CYS  22   2.159   6.567  -0.650
  144    HA   CYS  22           HA       CYS  22   4.302   5.016  -1.706
  145    HB2  CYS  22           HB2      CYS  22   3.468   7.859  -2.289
  146    HB3  CYS  22           HB1      CYS  22   4.730   6.979  -3.155
  147    H    PHE  23           H        PHE  23   3.911   7.002   0.930
  148    HA   PHE  23           HA       PHE  23   6.656   7.797   1.193
  149    HB2  PHE  23           HB2      PHE  23   4.425   7.631   3.231
  150    HB3  PHE  23           HB1      PHE  23   6.031   8.246   3.589
  151    HD1  PHE  23           HD1      PHE  23   6.809  10.340   2.520
  152    HD2  PHE  23           HD2      PHE  23   2.798   8.968   2.134
  153    HE1  PHE  23           HE1      PHE  23   6.105  12.594   1.835
  154    HE2  PHE  23           HE2      PHE  23   2.098  11.217   1.447
  155    HZ   PHE  23           HZ       PHE  23   3.745  13.034   1.298
  156    H    GLY  24           H        GLY  24   4.828   4.960   1.770
  157    HA2  GLY  24           HA2      GLY  24   7.107   3.713   3.135
  158    HA3  GLY  24           HA1      GLY  24   5.424   3.239   3.407
  159    H    ARG  25           H        ARG  25   7.922   3.504   1.008
  160    HA   ARG  25           HA       ARG  25   6.732   2.585  -1.247
  161    HB2  ARG  25           HB2      ARG  25   9.545   2.240  -0.331
  162    HB3  ARG  25           HB1      ARG  25   9.030   1.732  -1.926
  163    HG2  ARG  25           HG2      ARG  25   8.300   4.065  -2.361
  164    HG3  ARG  25           HG1      ARG  25   8.965   4.520  -0.789
  165    HD2  ARG  25           HD2      ARG  25  10.562   4.998  -2.567
  166    HD3  ARG  25           HD1      ARG  25  11.162   3.729  -1.497
  167    HE   ARG  25           HE       ARG  25   9.813   2.549  -3.646
  168   HH11  ARG  25          HH11      ARG  25  12.842   4.286  -2.995
  169   HH12  ARG  25          HH12      ARG  25  13.667   3.631  -4.328
  170   HH21  ARG  25          HH21      ARG  25  10.968   1.644  -5.465
  171   HH22  ARG  25          HH22      ARG  25  12.585   2.099  -5.757
  172    H    GLY  26           H        GLY  26   5.864   0.904  -1.979
  173    HA2  GLY  26           HA2      GLY  26   6.623  -1.656  -1.963
  174    HA3  GLY  26           HA1      GLY  26   5.668  -1.489  -0.487
  175    H    SER  27           H        SER  27   3.872  -2.562  -1.121
  176    HA   SER  27           HA       SER  27   2.506  -1.672  -3.562
  177    HB2  SER  27           HB2      SER  27   1.833  -4.135  -1.969
  178    HB3  SER  27           HB1      SER  27   1.597  -3.770  -3.686
  179    HG   SER  27           HG       SER  27   3.821  -4.697  -2.349
  180    H    TYR  28           H        TYR  28   0.262  -1.115  -3.312
  181    HA   TYR  28           HA       TYR  28  -0.766  -1.210  -0.589
  182    HB2  TYR  28           HB2      TYR  28  -1.567   1.061  -0.609
  183    HB3  TYR  28           HB1      TYR  28   0.158   1.047  -0.889
  184    HD1  TYR  28           HD1      TYR  28   1.061   1.660  -3.142
  185    HD2  TYR  28           HD2      TYR  28  -3.106   1.924  -2.270
  186    HE1  TYR  28           HE1      TYR  28   0.748   3.088  -5.071
  187    HE2  TYR  28           HE2      TYR  28  -3.418   3.365  -4.227
  188    HH   TYR  28           HH       TYR  28  -0.966   3.747  -6.572
  189    H    SER  29           H        SER  29  -2.899  -1.523  -0.392
  190    HA   SER  29           HA       SER  29  -4.524  -1.478  -2.820
  191    HB2  SER  29           HB2      SER  29  -5.625  -3.568  -2.040
  192    HB3  SER  29           HB1      SER  29  -3.914  -3.816  -2.404
  193    HG   SER  29           HG       SER  29  -5.206  -4.208  -0.062
  194    H    PHE  30           H        PHE  30  -6.914  -1.590  -2.093
  195    HA   PHE  30           HA       PHE  30  -7.140   0.033   0.323
  196    HB2  PHE  30           HB2      PHE  30  -8.832   0.041  -2.185
  197    HB3  PHE  30           HB1      PHE  30  -9.248   0.919  -0.714
  198    HD1  PHE  30           HD1      PHE  30  -7.846   2.800   0.051
  199    HD2  PHE  30           HD2      PHE  30  -7.142   0.855  -3.667
  200    HE1  PHE  30           HE1      PHE  30  -6.461   4.693  -0.672
  201    HE2  PHE  30           HE2      PHE  30  -5.752   2.746  -4.397
  202    HZ   PHE  30           HZ       PHE  30  -5.409   4.671  -2.894
  203    H    GLU  31           H        GLU  31  -7.099  -2.866  -0.013
  204    HA   GLU  31           HA       GLU  31  -9.263  -3.416   1.777
  205    HB2  GLU  31           HB2      GLU  31 -10.114  -5.346   0.527
  206    HB3  GLU  31           HB1      GLU  31 -10.336  -3.867  -0.391
  207    HG2  GLU  31           HG2      GLU  31  -8.403  -4.417  -1.762
  208    HG3  GLU  31           HG1      GLU  31  -8.150  -5.887  -0.822
  209    H    LEU  32           H        LEU  32  -8.921  -5.435   2.869
  210    HA   LEU  32           HA       LEU  32  -6.115  -6.124   3.028
  211    HB2  LEU  32           HB2      LEU  32  -8.501  -6.904   4.679
  212    HB3  LEU  32           HB1      LEU  32  -6.895  -7.539   4.950
  213    HG   LEU  32           HG       LEU  32  -7.635  -4.617   5.144
  214   HD11  LEU  32          HD11      LEU  32  -7.411  -4.949   7.546
  215   HD12  LEU  32          HD12      LEU  32  -7.133  -6.668   7.286
  216   HD13  LEU  32          HD13      LEU  32  -8.700  -5.960   6.890
  217   HD21  LEU  32          HD21      LEU  32  -5.436  -4.418   6.217
  218   HD22  LEU  32          HD22      LEU  32  -5.299  -4.963   4.552
  219   HD23  LEU  32          HD23      LEU  32  -5.117  -6.118   5.873
  220    H    GLN  33           H        GLN  33  -5.374  -8.268   3.014
  221    HA   GLN  33           HA       GLN  33  -4.978 -10.208   1.984
  222    HB2  GLN  33           HB2      GLN  33  -7.945 -10.624   2.392
  223    HB3  GLN  33           HB1      GLN  33  -6.788 -11.885   2.005
  224    HG2  GLN  33           HG2      GLN  33  -5.654 -11.558   4.108
  225    HG3  GLN  33           HG1      GLN  33  -6.693 -10.186   4.484
  226   HE21  GLN  33          1HE2      GLN  33  -7.868 -13.128   2.991
  227   HE22  GLN  33          2HE2      GLN  33  -8.796 -13.647   4.341
  228    HA   PRO  34           HA       PRO  34  -6.512  -9.248  -2.234
  229    HB2  PRO  34           HB2      PRO  34  -4.719  -7.391  -3.032
  230    HB3  PRO  34           HB1      PRO  34  -6.178  -6.977  -2.128
  231    HG2  PRO  34           HG2      PRO  34  -3.408  -6.819  -1.257
  232    HG3  PRO  34           HG1      PRO  34  -4.860  -6.239  -0.432
  233    HD2  PRO  34           HD2      PRO  34  -3.368  -8.764  -0.049
  234    HD3  PRO  34           HD1      PRO  34  -4.493  -7.940   1.055
  235    HA   PRO  35           HA       PRO  35  -3.195 -11.616  -4.153
  236    HB2  PRO  35           HB2      PRO  35  -4.075 -11.581  -6.718
  237    HB3  PRO  35           HB1      PRO  35  -4.855 -12.572  -5.482
  238    HG2  PRO  35           HG2      PRO  35  -5.702  -9.964  -6.635
  239    HG3  PRO  35           HG1      PRO  35  -6.690 -11.349  -6.149
  240    HD2  PRO  35           HD2      PRO  35  -6.332  -9.060  -4.637
  241    HD3  PRO  35           HD1      PRO  35  -6.823 -10.636  -3.990
  242    HA   PRO  36           HA       PRO  36   0.032  -8.866  -5.417
  243    HB2  PRO  36           HB2      PRO  36   0.169 -10.276  -8.021
  244    HB3  PRO  36           HB1      PRO  36   1.454  -9.935  -6.867
  245    HG2  PRO  36           HG2      PRO  36   0.276 -12.370  -7.140
  246    HG3  PRO  36           HG1      PRO  36   1.011 -11.804  -5.639
  247    HD2  PRO  36           HD2      PRO  36  -1.803 -12.261  -6.268
  248    HD3  PRO  36           HD1      PRO  36  -1.037 -11.997  -4.695
  249    H    TRP  37           H        TRP  37  -2.128  -9.612  -8.076
  250    HA   TRP  37           HA       TRP  37  -1.466  -7.271  -9.534
  251    HB2  TRP  37           HB2      TRP  37  -3.368  -8.061 -11.049
  252    HB3  TRP  37           HB1      TRP  37  -1.951  -9.090 -10.894
  253    HD1  TRP  37           HD       TRP  37  -5.680  -8.983 -10.087
  254    HE1  TRP  37           HE1      TRP  37  -6.435 -11.372  -9.386
  255    HE3  TRP  37          3HE       TRP  37  -1.100 -11.273  -9.770
  256    HZ2  TRP  37           HZ2      TRP  37  -5.255 -13.847  -8.797
  257    HZ3  TRP  37           HZ3      TRP  37  -1.016 -13.642  -9.138
  258    HH2  TRP  37           HH       TRP  37  -3.052 -14.897  -8.660
  259    H    GLU  38           H        GLU  38  -3.455  -7.567  -6.875
  260    HA   GLU  38           HA       GLU  38  -5.004  -5.342  -7.886
  261    HB2  GLU  38           HB2      GLU  38  -5.643  -7.197  -5.609
  262    HB3  GLU  38           HB1      GLU  38  -6.534  -5.709  -5.917
  263    HG2  GLU  38           HG2      GLU  38  -6.986  -6.561  -8.225
  264    HG3  GLU  38           HG1      GLU  38  -6.294  -8.100  -7.726
  265    H    CYS  39           H        CYS  39  -2.305  -5.832  -6.193
  266    HA   CYS  39           HA       CYS  39  -2.710  -3.466  -4.533
  267    HB2  CYS  39           HB2      CYS  39  -0.315  -5.316  -4.767
  268    HB3  CYS  39           HB1      CYS  39  -0.390  -3.880  -3.752
  269    H    TYR  40           H        TYR  40  -1.922  -1.546  -5.091
  270    HA   TYR  40           HA       TYR  40  -0.758  -1.242  -7.738
  271    HB2  TYR  40           HB2      TYR  40  -1.420   0.865  -5.662
  272    HB3  TYR  40           HB1      TYR  40  -1.068   1.141  -7.357
  273    HD1  TYR  40           HD1      TYR  40  -2.758   0.611  -9.071
  274    HD2  TYR  40           HD2      TYR  40  -3.601   0.157  -4.925
  275    HE1  TYR  40           HE1      TYR  40  -5.154   0.539  -9.566
  276    HE2  TYR  40           HE2      TYR  40  -5.998   0.077  -5.415
  277    HH   TYR  40           HH       TYR  40  -7.204  -0.373  -8.515
  278    H    GLN  41           H        GLN  41   1.298  -0.101  -7.981
  279    HA   GLN  41           HA       GLN  41   3.020  -0.575  -5.657
  280    HB2  GLN  41           HB2      GLN  41   3.669  -0.492  -8.600
  281    HB3  GLN  41           HB1      GLN  41   4.876  -0.615  -7.330
  282    HG2  GLN  41           HG2      GLN  41   2.698  -2.609  -7.890
  283    HG3  GLN  41           HG1      GLN  41   4.399  -2.772  -8.333
  284   HE21  GLN  41          1HE2      GLN  41   2.780  -4.462  -6.628
  285   HE22  GLN  41          2HE2      GLN  41   3.542  -4.419  -5.068
  286    H    CYS  42           H        CYS  42   3.990   1.172  -4.732
  287    HA   CYS  42           HA       CYS  42   3.689   3.722  -6.043
  288    HB2  CYS  42           HB2      CYS  42   4.685   2.961  -3.310
  289    HB3  CYS  42           HB1      CYS  42   4.925   4.582  -3.948
  Start of MODEL   17
    1    H    PCA   1           H        PGL   1  -8.648   6.502   1.543
    2    HA   PCA   1           HA       PGL   1  -8.272   8.093   3.482
    3    HB2  PCA   1           HB1      PGL   1 -10.072   8.132   4.881
    4    HB3  PCA   1           HB2      PGL   1  -9.577   6.527   5.485
    5    HG2  PCA   1           HG1      PGL   1 -11.824   7.166   3.771
    6    HG3  PCA   1           HG2      PGL   1 -11.294   5.557   4.375
    7    H    GLU   2           H        GLU   2  -8.314   4.645   3.208
    8    HA   GLU   2           HA       GLU   2  -5.776   4.564   4.622
    9    HB2  GLU   2           HB2      GLU   2  -8.044   2.633   5.042
   10    HB3  GLU   2           HB1      GLU   2  -6.393   2.313   5.534
   11    HG2  GLU   2           HG2      GLU   2  -6.521   4.378   6.939
   12    HG3  GLU   2           HG1      GLU   2  -8.245   4.435   6.565
   13    H    ALA   3           H        ALA   3  -4.354   3.987   3.234
   14    HA   ALA   3           HA       ALA   3  -4.965   1.946   1.260
   15    HB1  ALA   3           HB1      ALA   3  -2.624   3.842   1.580
   16    HB2  ALA   3           HB2      ALA   3  -3.924   3.994   0.400
   17    HB3  ALA   3           HB3      ALA   3  -2.785   2.654   0.289
   18    H    PHE   4           H        PHE   4  -4.315  -0.032   1.733
   19    HA   PHE   4           HA       PHE   4  -2.887  -0.507   4.188
   20    HB2  PHE   4           HB2      PHE   4  -4.081  -2.413   2.156
   21    HB3  PHE   4           HB1      PHE   4  -3.367  -2.903   3.688
   22    HD1  PHE   4           HD1      PHE   4  -4.630  -2.837   5.682
   23    HD2  PHE   4           HD2      PHE   4  -6.135  -0.979   2.180
   24    HE1  PHE   4           HE1      PHE   4  -6.798  -2.523   6.785
   25    HE2  PHE   4           HE2      PHE   4  -8.308  -0.668   3.276
   26    HZ   PHE   4           HZ       PHE   4  -8.639  -1.444   5.579
   27    H    CYS   5           H        CYS   5  -0.786  -0.510   4.231
   28    HA   CYS   5           HA       CYS   5   0.705  -0.713   1.774
   29    HB2  CYS   5           HB2      CYS   5   1.580  -0.056   4.585
   30    HB3  CYS   5           HB1      CYS   5   2.587   0.049   3.146
   31    H    TYR   6           H        TYR   6   1.590  -2.479   1.131
   32    HA   TYR   6           HA       TYR   6   2.470  -4.551   3.054
   33    HB2  TYR   6           HB2      TYR   6   1.794  -4.907   0.136
   34    HB3  TYR   6           HB1      TYR   6   2.178  -6.158   1.290
   35    HD1  TYR   6           HD1      TYR   6  -0.453  -3.835   0.192
   36    HD2  TYR   6           HD2      TYR   6   0.539  -7.020   2.810
   37    HE1  TYR   6           HE1      TYR   6  -2.815  -4.151   0.695
   38    HE2  TYR   6           HE2      TYR   6  -1.799  -7.338   3.332
   39    HH   TYR   6           HH       TYR   6  -4.337  -5.698   1.591
   40    H    SER   7           H        SER   7   4.525  -4.504   3.227
   41    HA   SER   7           HA       SER   7   6.311  -3.095   1.545
   42    HB2  SER   7           HB2      SER   7   6.778  -5.356   3.456
   43    HB3  SER   7           HB1      SER   7   8.061  -4.287   2.844
   44    HG   SER   7           HG       SER   7   6.922  -2.564   3.847
   45    H    ASP   8           H        ASP   8   5.139  -6.303   1.642
   46    HA   ASP   8           HA       ASP   8   6.850  -7.460  -0.333
   47    HB2  ASP   8           HB2      ASP   8   5.794  -8.855   1.347
   48    HB3  ASP   8           HB1      ASP   8   4.206  -8.287   0.866
   49    H    ARG   9           H        ARG   9   6.589  -7.385  -2.490
   50    HA   ARG   9           HA       ARG   9   4.689  -5.541  -3.552
   51    HB2  ARG   9           HB2      ARG   9   6.661  -7.313  -4.994
   52    HB3  ARG   9           HB1      ARG   9   5.762  -5.987  -5.707
   53    HG2  ARG   9           HG2      ARG   9   7.800  -5.712  -3.500
   54    HG3  ARG   9           HG1      ARG   9   8.095  -5.400  -5.208
   55    HD2  ARG   9           HD2      ARG   9   6.398  -3.599  -5.135
   56    HD3  ARG   9           HD1      ARG   9   6.164  -3.911  -3.416
   57    HE   ARG   9           HE       ARG   9   8.801  -3.512  -3.549
   58   HH11  ARG   9          HH11      ARG   9   6.136  -1.511  -4.761
   59   HH12  ARG   9          HH12      ARG   9   6.964  -0.031  -4.669
   60   HH21  ARG   9          HH21      ARG   9   9.955  -1.541  -3.421
   61   HH22  ARG   9          HH22      ARG   9   9.267  -0.055  -3.918
   62    H    PHE  10           H        PHE  10   4.267  -8.723  -2.699
   63    HA   PHE  10           HA       PHE  10   2.475  -9.241  -4.934
   64    HB2  PHE  10           HB2      PHE  10   3.759 -11.179  -2.994
   65    HB3  PHE  10           HB1      PHE  10   2.712 -11.615  -4.338
   66    HD1  PHE  10           HD1      PHE  10   6.060 -10.720  -3.317
   67    HD2  PHE  10           HD2      PHE  10   3.501 -11.255  -6.677
   68    HE1  PHE  10           HE1      PHE  10   8.019 -10.815  -4.789
   69    HE2  PHE  10           HE2      PHE  10   5.449 -11.359  -8.154
   70    HZ   PHE  10           HZ       PHE  10   7.726 -11.137  -7.213
   71    H    CYS  11           H        CYS  11   2.291  -7.774  -2.199
   72    HA   CYS  11           HA       CYS  11   0.520  -7.119  -0.873
   73    HB2  CYS  11           HB2      CYS  11  -1.149  -9.285  -2.175
   74    HB3  CYS  11           HB1      CYS  11  -1.685  -7.843  -1.320
   75    H    GLN  12           H        GLN  12   2.342  -9.562  -0.294
   76    HA   GLN  12           HA       GLN  12   0.514 -11.028   1.445
   77    HB2  GLN  12           HB2      GLN  12   3.269 -11.685   0.477
   78    HB3  GLN  12           HB1      GLN  12   2.365 -12.673   1.618
   79    HG2  GLN  12           HG2      GLN  12   0.645 -13.074   0.001
   80    HG3  GLN  12           HG1      GLN  12   1.389 -11.944  -1.127
   81   HE21  GLN  12          1HE2      GLN  12   1.529 -13.526  -2.678
   82   HE22  GLN  12          2HE2      GLN  12   2.711 -14.778  -2.615
   83    H    ASN  13           H        ASN  13   2.588  -8.453   1.915
   84    HA   ASN  13           HA       ASN  13   2.864  -9.299   4.720
   85    HB2  ASN  13           HB2      ASN  13   5.071  -7.898   3.181
   86    HB3  ASN  13           HB1      ASN  13   5.054  -8.079   4.920
   87   HD21  ASN  13          HD21      ASN  13   3.981 -10.870   4.742
   88   HD22  ASN  13          HD22      ASN  13   5.309 -11.826   4.239
   89    H    TYR  14           H        TYR  14   1.068  -8.138   5.231
   90    HA   TYR  14           HA       TYR  14   0.766  -5.378   4.737
   91    HB2  TYR  14           HB2      TYR  14  -1.167  -6.743   5.192
   92    HB3  TYR  14           HB1      TYR  14  -0.521  -7.222   6.753
   93    HD1  TYR  14           HD1      TYR  14  -1.309  -6.157   8.619
   94    HD2  TYR  14           HD2      TYR  14  -1.527  -4.136   4.897
   95    HE1  TYR  14           HE1      TYR  14  -2.518  -4.329   9.708
   96    HE2  TYR  14           HE2      TYR  14  -2.728  -2.290   5.962
   97    HH   TYR  14           HH       TYR  14  -4.144  -1.896   7.997
   98    H    ILE  15           H        ILE  15   1.623  -3.690   5.831
   99    HA   ILE  15           HA       ILE  15   2.863  -4.281   8.430
  100    HB   ILE  15           HB       ILE  15   4.369  -2.353   8.072
  101   HG12  ILE  15          HG12      ILE  15   3.303  -2.397   5.232
  102   HG13  ILE  15          HG11      ILE  15   2.969  -1.144   6.418
  103   HG21  ILE  15          HG21      ILE  15   5.850  -3.496   6.465
  104   HG22  ILE  15          HG22      ILE  15   4.510  -4.549   6.012
  105   HG23  ILE  15          HG23      ILE  15   5.150  -4.593   7.655
  106   HD11  ILE  15          HD11      ILE  15   5.665  -1.828   5.276
  107   HD12  ILE  15          HD12      ILE  15   5.339  -0.564   6.461
  108   HD13  ILE  15          HD13      ILE  15   4.663  -0.446   4.834
  109    H    GLY  16           H        GLY  16   0.678  -2.110   6.762
  110    HA2  GLY  16           HA2      GLY  16  -0.670  -1.319   9.012
  111    HA3  GLY  16           HA1      GLY  16   0.615  -0.133   8.780
  112    H    SER  17           H        SER  17  -1.771   0.936   8.571
  113    HA   SER  17           HA       SER  17  -2.102   1.225   5.691
  114    HB2  SER  17           HB2      SER  17  -4.576   1.489   6.100
  115    HB3  SER  17           HB1      SER  17  -3.958  -0.141   6.347
  116    HG   SER  17           HG       SER  17  -5.310   1.353   8.046
  117    H    ILE  18           H        ILE  18  -2.146   3.244   4.994
  118    HA   ILE  18           HA       ILE  18  -2.706   5.452   6.788
  119    HB   ILE  18           HB       ILE  18  -0.619   6.607   5.816
  120   HG12  ILE  18          HG12      ILE  18   0.135   3.721   5.289
  121   HG13  ILE  18          HG11      ILE  18  -0.038   5.002   4.099
  122   HG21  ILE  18          HG21      ILE  18  -0.776   6.081   8.164
  123   HG22  ILE  18          HG22      ILE  18   0.862   5.768   7.592
  124   HG23  ILE  18          HG23      ILE  18  -0.249   4.425   7.859
  125   HD11  ILE  18          HD11      ILE  18   1.912   6.135   5.042
  126   HD12  ILE  18          HD12      ILE  18   2.297   4.487   4.538
  127   HD13  ILE  18          HD13      ILE  18   2.061   4.855   6.247
  128    HA   PRO  19           HA       PRO  19  -4.674   7.060   3.164
  129    HB2  PRO  19           HB2      PRO  19  -3.293   9.673   3.454
  130    HB3  PRO  19           HB1      PRO  19  -5.024   9.319   3.458
  131    HG2  PRO  19           HG2      PRO  19  -3.775   9.955   5.722
  132    HG3  PRO  19           HG1      PRO  19  -5.031   8.705   5.698
  133    HD2  PRO  19           HD2      PRO  19  -2.051   8.390   5.759
  134    HD3  PRO  19           HD1      PRO  19  -3.293   7.498   6.662
  135    H    ASP  20           H        ASP  20  -1.507   8.654   3.232
  136    HA   ASP  20           HA       ASP  20  -1.056   7.929   0.451
  137    HB2  ASP  20           HB2      ASP  20   0.838   9.560   0.597
  138    HB3  ASP  20           HB1      ASP  20  -0.705  10.294   1.002
  139    H    CYS  21           H        CYS  21   0.266   6.307  -0.024
  140    HA   CYS  21           HA       CYS  21   1.773   5.071   2.194
  141    HB2  CYS  21           HB2      CYS  21  -0.256   3.836   1.594
  142    HB3  CYS  21           HB1      CYS  21   0.276   3.749  -0.076
  143    H    CYS  22           H        CYS  22   2.046   6.428  -0.941
  144    HA   CYS  22           HA       CYS  22   4.055   4.575  -1.781
  145    HB2  CYS  22           HB2      CYS  22   2.854   6.930  -3.202
  146    HB3  CYS  22           HB1      CYS  22   4.142   5.935  -3.872
  147    H    PHE  23           H        PHE  23   4.554   6.604   0.445
  148    HA   PHE  23           HA       PHE  23   7.006   7.666  -0.710
  149    HB2  PHE  23           HB2      PHE  23   5.694   8.263   1.960
  150    HB3  PHE  23           HB1      PHE  23   7.248   8.909   1.460
  151    HD1  PHE  23           HD1      PHE  23   7.404  10.511  -0.379
  152    HD2  PHE  23           HD2      PHE  23   3.631   9.160   1.059
  153    HE1  PHE  23           HE1      PHE  23   6.298  12.386  -1.519
  154    HE2  PHE  23           HE2      PHE  23   2.523  11.022  -0.072
  155    HZ   PHE  23           HZ       PHE  23   3.850  12.647  -1.370
  156    H    GLY  24           H        GLY  24   6.144   4.866   0.250
  157    HA2  GLY  24           HA2      GLY  24   8.765   4.234   1.362
  158    HA3  GLY  24           HA1      GLY  24   7.311   3.584   2.120
  159    H    ARG  25           H        ARG  25   9.158   1.866   1.149
  160    HA   ARG  25           HA       ARG  25   8.508   1.023  -1.528
  161    HB2  ARG  25           HB2      ARG  25  10.257  -0.083   0.653
  162    HB3  ARG  25           HB1      ARG  25   9.835  -1.087  -0.717
  163    HG2  ARG  25           HG2      ARG  25  12.041  -0.054  -0.978
  164    HG3  ARG  25           HG1      ARG  25  10.929   0.470  -2.233
  165    HD2  ARG  25           HD2      ARG  25  12.289   2.323  -1.421
  166    HD3  ARG  25           HD1      ARG  25  10.585   2.574  -1.051
  167    HE   ARG  25           HE       ARG  25  11.880   1.338   1.125
  168   HH11  ARG  25          HH11      ARG  25  11.676   4.475  -0.521
  169   HH12  ARG  25          HH12      ARG  25  11.977   5.400   0.871
  170   HH21  ARG  25          HH21      ARG  25  12.296   2.610   3.076
  171   HH22  ARG  25          HH22      ARG  25  12.355   4.315   2.949
  172    H    GLY  26           H        GLY  26   6.567   0.102  -1.935
  173    HA2  GLY  26           HA2      GLY  26   5.874  -2.320  -0.847
  174    HA3  GLY  26           HA1      GLY  26   5.040  -1.086   0.081
  175    H    SER  27           H        SER  27   3.352  -2.504  -0.888
  176    HA   SER  27           HA       SER  27   2.350  -1.327  -3.393
  177    HB2  SER  27           HB2      SER  27   1.686  -4.082  -2.365
  178    HB3  SER  27           HB1      SER  27   1.563  -3.456  -4.010
  179    HG   SER  27           HG       SER  27   3.679  -4.510  -2.641
  180    H    TYR  28           H        TYR  28   0.066  -0.819  -3.172
  181    HA   TYR  28           HA       TYR  28  -0.987  -1.413  -0.515
  182    HB2  TYR  28           HB2      TYR  28  -1.917   0.767  -0.210
  183    HB3  TYR  28           HB1      TYR  28  -0.208   0.940  -0.557
  184    HD1  TYR  28           HD1      TYR  28  -3.595   1.675  -1.649
  185    HD2  TYR  28           HD2      TYR  28   0.509   1.895  -2.755
  186    HE1  TYR  28           HE1      TYR  28  -4.152   3.303  -3.369
  187    HE2  TYR  28           HE2      TYR  28  -0.016   3.506  -4.466
  188    HH   TYR  28           HH       TYR  28  -2.006   4.179  -5.804
  189    H    SER  29           H        SER  29  -3.147  -1.612  -0.284
  190    HA   SER  29           HA       SER  29  -4.810  -1.527  -2.670
  191    HB2  SER  29           HB2      SER  29  -5.845  -3.691  -1.901
  192    HB3  SER  29           HB1      SER  29  -4.177  -3.862  -2.454
  193    HG   SER  29           HG       SER  29  -5.230  -4.293   0.052
  194    H    PHE  30           H        PHE  30  -7.189  -1.736  -1.878
  195    HA   PHE  30           HA       PHE  30  -7.386  -0.107   0.540
  196    HB2  PHE  30           HB2      PHE  30  -9.336  -0.443  -1.747
  197    HB3  PHE  30           HB1      PHE  30  -9.604   0.570  -0.331
  198    HD1  PHE  30           HD1      PHE  30  -8.498   0.564  -3.650
  199    HD2  PHE  30           HD2      PHE  30  -7.644   2.307   0.143
  200    HE1  PHE  30           HE1      PHE  30  -7.338   2.427  -4.764
  201    HE2  PHE  30           HE2      PHE  30  -6.496   4.168  -0.966
  202    HZ   PHE  30           HZ       PHE  30  -6.342   4.231  -3.425
  203    H    GLU  31           H        GLU  31  -7.157  -3.066   0.291
  204    HA   GLU  31           HA       GLU  31  -9.196  -3.773   2.203
  205    HB2  GLU  31           HB2      GLU  31  -9.913  -5.753   0.953
  206    HB3  GLU  31           HB1      GLU  31 -10.263  -4.295   0.037
  207    HG2  GLU  31           HG2      GLU  31  -8.292  -4.667  -1.340
  208    HG3  GLU  31           HG1      GLU  31  -7.907  -6.112  -0.406
  209    H    LEU  32           H        LEU  32  -8.676  -6.020   3.049
  210    HA   LEU  32           HA       LEU  32  -5.785  -6.345   3.178
  211    HB2  LEU  32           HB2      LEU  32  -8.024  -7.336   4.913
  212    HB3  LEU  32           HB1      LEU  32  -6.396  -7.962   5.057
  213    HG   LEU  32           HG       LEU  32  -7.100  -5.044   5.405
  214   HD11  LEU  32          HD11      LEU  32  -8.154  -6.419   7.133
  215   HD12  LEU  32          HD12      LEU  32  -6.822  -5.462   7.790
  216   HD13  LEU  32          HD13      LEU  32  -6.599  -7.184   7.465
  217   HD21  LEU  32          HD21      LEU  32  -4.787  -5.449   4.744
  218   HD22  LEU  32          HD22      LEU  32  -4.623  -6.644   6.028
  219   HD23  LEU  32          HD23      LEU  32  -4.877  -4.949   6.431
  220    H    GLN  33           H        GLN  33  -4.738  -8.206   2.846
  221    HA   GLN  33           HA       GLN  33  -4.100  -9.932   1.584
  222    HB2  GLN  33           HB2      GLN  33  -6.637 -11.155   2.663
  223    HB3  GLN  33           HB1      GLN  33  -5.318 -12.055   1.925
  224    HG2  GLN  33           HG2      GLN  33  -3.830 -11.198   3.708
  225    HG3  GLN  33           HG1      GLN  33  -5.237 -10.452   4.459
  226   HE21  GLN  33          1HE2      GLN  33  -3.445 -12.458   5.443
  227   HE22  GLN  33          2HE2      GLN  33  -4.389 -13.833   5.880
  228    HA   PRO  34           HA       PRO  34  -6.661  -9.571  -2.173
  229    HB2  PRO  34           HB2      PRO  34  -5.459  -7.527  -3.403
  230    HB3  PRO  34           HB1      PRO  34  -6.615  -7.250  -2.096
  231    HG2  PRO  34           HG2      PRO  34  -3.681  -6.934  -2.098
  232    HG3  PRO  34           HG1      PRO  34  -4.888  -6.188  -1.044
  233    HD2  PRO  34           HD2      PRO  34  -3.257  -8.548  -0.523
  234    HD3  PRO  34           HD1      PRO  34  -4.379  -7.710   0.564
  235    HA   PRO  35           HA       PRO  35  -3.751 -11.746  -4.872
  236    HB2  PRO  35           HB2      PRO  35  -4.563 -10.821  -7.347
  237    HB3  PRO  35           HB1      PRO  35  -5.379 -12.113  -6.467
  238    HG2  PRO  35           HG2      PRO  35  -6.082  -9.221  -6.670
  239    HG3  PRO  35           HG1      PRO  35  -7.147 -10.637  -6.676
  240    HD2  PRO  35           HD2      PRO  35  -6.833  -9.090  -4.495
  241    HD3  PRO  35           HD1      PRO  35  -7.091 -10.842  -4.373
  242    HA   PRO  36           HA       PRO  36  -0.270  -9.074  -5.186
  243    HB2  PRO  36           HB2      PRO  36   0.976 -10.214  -7.406
  244    HB3  PRO  36           HB1      PRO  36   1.146 -10.746  -5.732
  245    HG2  PRO  36           HG2      PRO  36  -0.653 -11.801  -7.874
  246    HG3  PRO  36           HG1      PRO  36   0.280 -12.690  -6.656
  247    HD2  PRO  36           HD2      PRO  36  -2.329 -12.348  -6.357
  248    HD3  PRO  36           HD1      PRO  36  -1.248 -12.182  -4.954
  249    H    TRP  37           H        TRP  37  -1.984  -9.614  -8.214
  250    HA   TRP  37           HA       TRP  37  -0.727  -7.381  -9.484
  251    HB2  TRP  37           HB2      TRP  37  -2.290  -7.828 -11.373
  252    HB3  TRP  37           HB1      TRP  37  -1.308  -9.207 -10.912
  253    HD1  TRP  37           HD       TRP  37  -4.935  -7.910 -10.581
  254    HE1  TRP  37           HE1      TRP  37  -6.503  -9.950 -10.354
  255    HE3  TRP  37          3HE       TRP  37  -1.427 -11.614 -10.340
  256    HZ2  TRP  37           HZ2      TRP  37  -6.276 -12.744 -10.120
  257    HZ3  TRP  37           HZ3      TRP  37  -2.181 -13.944 -10.122
  258    HH2  TRP  37           HH       TRP  37  -4.564 -14.493 -10.015
  259    H    GLU  38           H        GLU  38  -3.245  -7.508  -7.258
  260    HA   GLU  38           HA       GLU  38  -4.539  -5.203  -8.469
  261    HB2  GLU  38           HB2      GLU  38  -5.469  -7.022  -6.267
  262    HB3  GLU  38           HB1      GLU  38  -6.286  -5.519  -6.671
  263    HG2  GLU  38           HG2      GLU  38  -5.866  -7.862  -8.516
  264    HG3  GLU  38           HG1      GLU  38  -7.379  -7.401  -7.736
  265    H    CYS  39           H        CYS  39  -2.085  -5.654  -6.394
  266    HA   CYS  39           HA       CYS  39  -2.802  -3.387  -4.736
  267    HB2  CYS  39           HB2      CYS  39  -0.288  -5.050  -4.811
  268    HB3  CYS  39           HB1      CYS  39  -0.537  -3.665  -3.754
  269    H    TYR  40           H        TYR  40  -2.218  -1.425  -5.098
  270    HA   TYR  40           HA       TYR  40  -1.018  -0.702  -7.566
  271    HB2  TYR  40           HB2      TYR  40  -1.663   0.966  -5.123
  272    HB3  TYR  40           HB1      TYR  40  -1.213   1.601  -6.696
  273    HD1  TYR  40           HD1      TYR  40  -2.816   1.740  -8.469
  274    HD2  TYR  40           HD2      TYR  40  -3.869  -0.115  -4.791
  275    HE1  TYR  40           HE1      TYR  40  -5.159   1.789  -9.132
  276    HE2  TYR  40           HE2      TYR  40  -6.230  -0.082  -5.438
  277    HH   TYR  40           HH       TYR  40  -7.719   1.110  -6.944
  278    H    GLN  41           H        GLN  41   1.047  -0.747  -7.900
  279    HA   GLN  41           HA       GLN  41   2.897  -1.150  -5.769
  280    HB2  GLN  41           HB2      GLN  41   3.186  -0.975  -8.749
  281    HB3  GLN  41           HB1      GLN  41   4.558  -1.177  -7.670
  282    HG2  GLN  41           HG2      GLN  41   3.659  -3.262  -6.851
  283    HG3  GLN  41           HG1      GLN  41   2.202  -3.039  -7.817
  284   HE21  GLN  41          1HE2      GLN  41   5.614  -3.704  -7.920
  285   HE22  GLN  41          2HE2      GLN  41   5.625  -4.400  -9.491
  286    H    CYS  42           H        CYS  42   3.657   0.432  -4.594
  287    HA   CYS  42           HA       CYS  42   3.708   3.083  -5.544
  288    HB2  CYS  42           HB2      CYS  42   4.645   1.803  -2.987
  289    HB3  CYS  42           HB1      CYS  42   4.871   3.516  -3.332
  Start of MODEL   18
    1    H    PCA   1           H        PGL   1 -10.539   4.454   3.825
    2    HA   PCA   1           HA       PGL   1  -9.819   6.728   2.828
    3    HB2  PCA   1           HB1      PGL   1  -9.950   8.427   4.337
    4    HB3  PCA   1           HB2      PGL   1  -8.672   7.652   5.310
    5    HG2  PCA   1           HG1      PGL   1 -11.531   7.736   5.833
    6    HG3  PCA   1           HG2      PGL   1 -10.220   7.027   6.838
    7    H    GLU   2           H        GLU   2  -8.531   4.461   5.058
    8    HA   GLU   2           HA       GLU   2  -5.767   5.162   4.572
    9    HB2  GLU   2           HB2      GLU   2  -6.964   2.818   6.049
   10    HB3  GLU   2           HB1      GLU   2  -5.264   3.247   5.996
   11    HG2  GLU   2           HG2      GLU   2  -5.738   5.321   7.175
   12    HG3  GLU   2           HG1      GLU   2  -7.455   4.910   7.210
   13    H    ALA   3           H        ALA   3  -4.371   4.056   3.270
   14    HA   ALA   3           HA       ALA   3  -5.488   1.948   1.617
   15    HB1  ALA   3           HB1      ALA   3  -2.931   3.565   1.366
   16    HB2  ALA   3           HB2      ALA   3  -4.403   3.817   0.430
   17    HB3  ALA   3           HB3      ALA   3  -3.475   2.332   0.227
   18    H    PHE   4           H        PHE   4  -4.530  -0.064   1.688
   19    HA   PHE   4           HA       PHE   4  -3.133  -0.568   4.170
   20    HB2  PHE   4           HB2      PHE   4  -4.192  -2.516   2.115
   21    HB3  PHE   4           HB1      PHE   4  -3.693  -2.902   3.758
   22    HD1  PHE   4           HD1      PHE   4  -6.426  -2.285   1.713
   23    HD2  PHE   4           HD2      PHE   4  -4.984  -1.448   5.620
   24    HE1  PHE   4           HE1      PHE   4  -8.729  -1.843   2.468
   25    HE2  PHE   4           HE2      PHE   4  -7.290  -1.011   6.373
   26    HZ   PHE   4           HZ       PHE   4  -9.156  -1.212   4.793
   27    H    CYS   5           H        CYS   5  -1.017  -0.872   4.255
   28    HA   CYS   5           HA       CYS   5   0.426  -0.898   1.727
   29    HB2  CYS   5           HB2      CYS   5   1.321  -0.154   4.504
   30    HB3  CYS   5           HB1      CYS   5   2.321  -0.084   3.058
   31    H    TYR   6           H        TYR   6   1.620  -2.511   1.150
   32    HA   TYR   6           HA       TYR   6   2.437  -4.589   3.077
   33    HB2  TYR   6           HB2      TYR   6   1.632  -5.100   0.180
   34    HB3  TYR   6           HB1      TYR   6   2.016  -6.283   1.415
   35    HD1  TYR   6           HD1      TYR   6  -0.496  -3.871   0.272
   36    HD2  TYR   6           HD2      TYR   6   0.344  -7.023   2.989
   37    HE1  TYR   6           HE1      TYR   6  -2.835  -3.983   0.840
   38    HE2  TYR   6           HE2      TYR   6  -2.035  -7.140   3.579
   39    HH   TYR   6           HH       TYR   6  -4.429  -5.280   1.822
   40    H    SER   7           H        SER   7   4.503  -4.984   3.066
   41    HA   SER   7           HA       SER   7   6.208  -3.447   1.403
   42    HB2  SER   7           HB2      SER   7   7.954  -4.794   2.658
   43    HB3  SER   7           HB1      SER   7   6.789  -3.879   3.639
   44    HG   SER   7           HG       SER   7   7.158  -6.065   4.319
   45    H    ASP   8           H        ASP   8   5.109  -6.670   1.654
   46    HA   ASP   8           HA       ASP   8   6.736  -7.790  -0.366
   47    HB2  ASP   8           HB2      ASP   8   5.869  -9.250   1.287
   48    HB3  ASP   8           HB1      ASP   8   4.214  -8.741   0.956
   49    H    ARG   9           H        ARG   9   6.341  -8.210  -2.413
   50    HA   ARG   9           HA       ARG   9   4.702  -6.352  -3.827
   51    HB2  ARG   9           HB2      ARG   9   6.572  -8.545  -4.715
   52    HB3  ARG   9           HB1      ARG   9   5.628  -7.617  -5.858
   53    HG2  ARG   9           HG2      ARG   9   7.905  -6.781  -5.734
   54    HG3  ARG   9           HG1      ARG   9   6.779  -5.567  -5.145
   55    HD2  ARG   9           HD2      ARG   9   8.798  -5.683  -3.767
   56    HD3  ARG   9           HD1      ARG   9   7.368  -6.135  -2.841
   57    HE   ARG   9           HE       ARG   9   8.789  -8.347  -4.024
   58   HH11  ARG   9          HH11      ARG   9   8.635  -6.259  -1.141
   59   HH12  ARG   9          HH12      ARG   9   9.359  -7.419  -0.130
   60   HH21  ARG   9          HH21      ARG   9   9.738  -9.901  -2.603
   61   HH22  ARG   9          HH22      ARG   9   9.957  -9.538  -0.943
   62    H    PHE  10           H        PHE  10   4.141  -9.505  -2.613
   63    HA   PHE  10           HA       PHE  10   2.144 -10.002  -4.660
   64    HB2  PHE  10           HB2      PHE  10   3.340 -11.890  -2.618
   65    HB3  PHE  10           HB1      PHE  10   2.209 -12.330  -3.894
   66    HD1  PHE  10           HD1      PHE  10   5.652 -11.622  -3.056
   67    HD2  PHE  10           HD2      PHE  10   2.930 -12.241  -6.262
   68    HE1  PHE  10           HE1      PHE  10   7.543 -11.984  -4.581
   69    HE2  PHE  10           HE2      PHE  10   4.810 -12.609  -7.792
   70    HZ   PHE  10           HZ       PHE  10   7.127 -12.478  -6.956
   71    H    CYS  11           H        CYS  11   2.218  -8.289  -2.071
   72    HA   CYS  11           HA       CYS  11   0.632  -7.452  -0.633
   73    HB2  CYS  11           HB2      CYS  11  -1.300  -9.495  -1.756
   74    HB3  CYS  11           HB1      CYS  11  -1.682  -7.993  -0.927
   75    H    GLN  12           H        GLN  12   2.295  -9.981  -0.097
   76    HA   GLN  12           HA       GLN  12   0.535 -11.302   1.803
   77    HB2  GLN  12           HB2      GLN  12   3.224 -12.095   0.716
   78    HB3  GLN  12           HB1      GLN  12   2.282 -13.049   1.856
   79    HG2  GLN  12           HG2      GLN  12   0.496 -13.275   0.223
   80    HG3  GLN  12           HG1      GLN  12   1.386 -12.268  -0.912
   81   HE21  GLN  12          1HE2      GLN  12   3.948 -13.500  -0.269
   82   HE22  GLN  12          2HE2      GLN  12   3.930 -15.070  -0.958
   83    H    ASN  13           H        ASN  13   2.312  -8.646   2.115
   84    HA   ASN  13           HA       ASN  13   2.908  -9.350   4.882
   85    HB2  ASN  13           HB2      ASN  13   4.970  -8.221   3.022
   86    HB3  ASN  13           HB1      ASN  13   5.029  -7.858   4.735
   87   HD21  ASN  13          HD21      ASN  13   5.427  -9.525   6.183
   88   HD22  ASN  13          HD22      ASN  13   6.110 -11.034   5.699
   89    H    TYR  14           H        TYR  14   1.320  -8.218   5.672
   90    HA   TYR  14           HA       TYR  14   0.746  -5.533   4.896
   91    HB2  TYR  14           HB2      TYR  14  -0.984  -7.096   5.711
   92    HB3  TYR  14           HB1      TYR  14  -0.173  -7.185   7.264
   93    HD1  TYR  14           HD1      TYR  14  -1.860  -4.772   4.967
   94    HD2  TYR  14           HD2      TYR  14  -0.797  -5.730   8.973
   95    HE1  TYR  14           HE1      TYR  14  -3.254  -2.929   5.778
   96    HE2  TYR  14           HE2      TYR  14  -2.186  -3.885   9.785
   97    HH   TYR  14           HH       TYR  14  -3.109  -1.793   8.973
   98    H    ILE  15           H        ILE  15   1.795  -3.792   5.581
   99    HA   ILE  15           HA       ILE  15   3.393  -4.017   8.043
  100    HB   ILE  15           HB       ILE  15   4.857  -2.227   7.138
  101   HG12  ILE  15          HG12      ILE  15   3.351  -2.718   4.551
  102   HG13  ILE  15          HG11      ILE  15   3.231  -1.265   5.528
  103   HG21  ILE  15          HG21      ILE  15   5.508  -4.545   7.018
  104   HG22  ILE  15          HG22      ILE  15   6.072  -3.667   5.598
  105   HG23  ILE  15          HG23      ILE  15   4.665  -4.725   5.478
  106   HD11  ILE  15          HD11      ILE  15   5.710  -2.242   4.123
  107   HD12  ILE  15          HD12      ILE  15   5.570  -0.759   5.070
  108   HD13  ILE  15          HD13      ILE  15   4.650  -0.945   3.579
  109    H    GLY  16           H        GLY  16   0.645  -2.623   6.901
  110    HA2  GLY  16           HA2      GLY  16  -0.250  -1.360   8.973
  111    HA3  GLY  16           HA1      GLY  16   0.983  -0.196   8.490
  112    H    SER  17           H        SER  17  -1.178   1.002   8.487
  113    HA   SER  17           HA       SER  17  -2.087   1.075   5.723
  114    HB2  SER  17           HB2      SER  17  -4.418   1.454   6.582
  115    HB3  SER  17           HB1      SER  17  -3.796  -0.162   6.908
  116    HG   SER  17           HG       SER  17  -4.298   1.962   8.648
  117    H    ILE  18           H        ILE  18  -2.093   3.100   4.960
  118    HA   ILE  18           HA       ILE  18  -2.439   5.366   6.691
  119    HB   ILE  18           HB       ILE  18  -0.433   6.533   5.619
  120   HG12  ILE  18          HG12      ILE  18   0.427   3.685   5.065
  121   HG13  ILE  18          HG11      ILE  18   0.058   4.917   3.867
  122   HG21  ILE  18          HG21      ILE  18   0.138   4.379   7.633
  123   HG22  ILE  18          HG22      ILE  18  -0.402   6.025   7.960
  124   HG23  ILE  18          HG23      ILE  18   1.199   5.743   7.277
  125   HD11  ILE  18          HD11      ILE  18   2.342   4.998   5.831
  126   HD12  ILE  18          HD12      ILE  18   1.991   6.215   4.602
  127   HD13  ILE  18          HD13      ILE  18   2.462   4.587   4.121
  128    HA   PRO  19           HA       PRO  19  -4.692   6.780   3.168
  129    HB2  PRO  19           HB2      PRO  19  -3.464   9.463   3.541
  130    HB3  PRO  19           HB1      PRO  19  -5.169   9.012   3.499
  131    HG2  PRO  19           HG2      PRO  19  -4.000   9.637   5.807
  132    HG3  PRO  19           HG1      PRO  19  -5.185   8.321   5.715
  133    HD2  PRO  19           HD2      PRO  19  -2.201   8.179   5.875
  134    HD3  PRO  19           HD1      PRO  19  -3.429   7.161   6.658
  135    H    ASP  20           H        ASP  20  -1.579   8.474   3.248
  136    HA   ASP  20           HA       ASP  20  -1.245   7.916   0.382
  137    HB2  ASP  20           HB2      ASP  20   0.371   9.715   2.220
  138    HB3  ASP  20           HB1      ASP  20   0.676   9.501   0.507
  139    H    CYS  21           H        CYS  21  -0.311   5.996   0.079
  140    HA   CYS  21           HA       CYS  21   1.392   4.939   2.185
  141    HB2  CYS  21           HB2      CYS  21  -0.473   3.576   1.269
  142    HB3  CYS  21           HB1      CYS  21   0.329   3.576  -0.294
  143    H    CYS  22           H        CYS  22   1.830   6.637  -0.673
  144    HA   CYS  22           HA       CYS  22   4.146   5.209  -1.636
  145    HB2  CYS  22           HB2      CYS  22   2.982   7.854  -2.495
  146    HB3  CYS  22           HB1      CYS  22   4.301   7.017  -3.300
  147    H    PHE  23           H        PHE  23   4.195   6.514   1.075
  148    HA   PHE  23           HA       PHE  23   6.559   8.148   0.679
  149    HB2  PHE  23           HB2      PHE  23   5.131   7.382   3.245
  150    HB3  PHE  23           HB1      PHE  23   6.519   8.456   3.154
  151    HD1  PHE  23           HD1      PHE  23   3.323   8.635   3.911
  152    HD2  PHE  23           HD2      PHE  23   5.907  10.172   0.912
  153    HE1  PHE  23           HE1      PHE  23   1.809  10.547   3.578
  154    HE2  PHE  23           HE2      PHE  23   4.403  12.071   0.573
  155    HZ   PHE  23           HZ       PHE  23   2.344  12.264   1.907
  156    H    GLY  24           H        GLY  24   7.728   6.508  -0.254
  157    HA2  GLY  24           HA2      GLY  24   9.719   5.242   0.307
  158    HA3  GLY  24           HA1      GLY  24   8.834   4.582   1.686
  159    H    ARG  25           H        ARG  25   9.688   2.567   0.490
  160    HA   ARG  25           HA       ARG  25   8.202   1.850  -1.865
  161    HB2  ARG  25           HB2      ARG  25   9.869   0.101  -0.054
  162    HB3  ARG  25           HB1      ARG  25   9.214  -0.377  -1.610
  163    HG2  ARG  25           HG2      ARG  25  10.584   1.427  -2.650
  164    HG3  ARG  25           HG1      ARG  25  11.330   1.685  -1.071
  165    HD2  ARG  25           HD2      ARG  25  12.722   0.221  -2.384
  166    HD3  ARG  25           HD1      ARG  25  12.009  -0.686  -1.048
  167    HE   ARG  25           HE       ARG  25  10.507  -0.804  -3.487
  168   HH11  ARG  25          HH11      ARG  25  13.090  -2.360  -1.622
  169   HH12  ARG  25          HH12      ARG  25  13.006  -3.820  -2.493
  170   HH21  ARG  25          HH21      ARG  25  10.419  -2.869  -4.674
  171   HH22  ARG  25          HH22      ARG  25  11.519  -4.087  -4.248
  172    H    GLY  26           H        GLY  26   6.461   0.465  -2.017
  173    HA2  GLY  26           HA2      GLY  26   5.469  -1.179  -0.073
  174    HA3  GLY  26           HA1      GLY  26   4.761   0.400   0.236
  175    H    SER  27           H        SER  27   3.748  -2.237  -0.755
  176    HA   SER  27           HA       SER  27   2.469  -1.428  -3.242
  177    HB2  SER  27           HB2      SER  27   2.105  -3.975  -1.639
  178    HB3  SER  27           HB1      SER  27   1.768  -3.711  -3.348
  179    HG   SER  27           HG       SER  27   3.851  -4.754  -2.359
  180    H    TYR  28           H        TYR  28   0.309  -0.788  -3.114
  181    HA   TYR  28           HA       TYR  28  -0.908  -0.985  -0.466
  182    HB2  TYR  28           HB2      TYR  28  -1.825   1.234  -0.584
  183    HB3  TYR  28           HB1      TYR  28  -0.102   1.347  -0.870
  184    HD1  TYR  28           HD1      TYR  28   0.745   2.020  -3.166
  185    HD2  TYR  28           HD2      TYR  28  -3.438   1.840  -2.271
  186    HE1  TYR  28           HE1      TYR  28   0.265   3.328  -5.136
  187    HE2  TYR  28           HE2      TYR  28  -3.912   3.151  -4.270
  188    HH   TYR  28           HH       TYR  28  -1.637   3.697  -6.704
  189    H    SER  29           H        SER  29  -3.023  -1.412  -0.378
  190    HA   SER  29           HA       SER  29  -4.470  -1.577  -2.895
  191    HB2  SER  29           HB2      SER  29  -5.418  -3.765  -2.157
  192    HB3  SER  29           HB1      SER  29  -3.679  -3.841  -2.441
  193    HG   SER  29           HG       SER  29  -5.093  -4.241  -0.134
  194    H    PHE  30           H        PHE  30  -6.830  -1.774  -2.463
  195    HA   PHE  30           HA       PHE  30  -7.509  -0.177  -0.113
  196    HB2  PHE  30           HB2      PHE  30  -9.127  -0.729  -2.613
  197    HB3  PHE  30           HB1      PHE  30  -9.593   0.354  -1.306
  198    HD1  PHE  30           HD1      PHE  30  -7.889   2.267  -0.776
  199    HD2  PHE  30           HD2      PHE  30  -8.033   0.140  -4.452
  200    HE1  PHE  30           HE1      PHE  30  -6.724   4.121  -1.889
  201    HE2  PHE  30           HE2      PHE  30  -6.869   1.990  -5.570
  202    HZ   PHE  30           HZ       PHE  30  -6.215   3.987  -4.283
  203    H    GLU  31           H        GLU  31  -7.153  -3.221  -0.707
  204    HA   GLU  31           HA       GLU  31  -9.432  -4.092   0.926
  205    HB2  GLU  31           HB2      GLU  31  -8.254  -5.568  -1.441
  206    HB3  GLU  31           HB1      GLU  31  -9.473  -6.215  -0.358
  207    HG2  GLU  31           HG2      GLU  31 -11.000  -4.409  -1.061
  208    HG3  GLU  31           HG1      GLU  31  -9.773  -3.859  -2.198
  209    H    LEU  32           H        LEU  32  -8.938  -6.014   2.202
  210    HA   LEU  32           HA       LEU  32  -6.176  -5.978   3.056
  211    HB2  LEU  32           HB2      LEU  32  -8.611  -7.319   4.198
  212    HB3  LEU  32           HB1      LEU  32  -7.002  -7.574   4.838
  213    HG   LEU  32           HG       LEU  32  -8.439  -4.916   4.749
  214   HD11  LEU  32          HD11      LEU  32  -7.819  -6.764   7.039
  215   HD12  LEU  32          HD12      LEU  32  -9.414  -6.486   6.339
  216   HD13  LEU  32          HD13      LEU  32  -8.570  -5.172   7.166
  217   HD21  LEU  32          HD21      LEU  32  -6.587  -4.168   6.186
  218   HD22  LEU  32          HD22      LEU  32  -6.035  -4.626   4.583
  219   HD23  LEU  32          HD23      LEU  32  -5.785  -5.720   5.946
  220    H    GLN  33           H        GLN  33  -4.751  -7.186   2.340
  221    HA   GLN  33           HA       GLN  33  -3.697  -8.627   1.027
  222    HB2  GLN  33           HB2      GLN  33  -5.091 -10.552   2.877
  223    HB3  GLN  33           HB1      GLN  33  -3.726 -10.973   1.853
  224    HG2  GLN  33           HG2      GLN  33  -2.408  -9.196   3.005
  225    HG3  GLN  33           HG1      GLN  33  -3.761  -8.981   4.113
  226   HE21  GLN  33          1HE2      GLN  33  -2.660 -12.082   2.832
  227   HE22  GLN  33          2HE2      GLN  33  -2.092 -12.689   4.328
  228    HA   PRO  34           HA       PRO  34  -6.674 -10.029  -2.017
  229    HB2  PRO  34           HB2      PRO  34  -6.351  -8.073  -3.837
  230    HB3  PRO  34           HB1      PRO  34  -7.379  -7.835  -2.423
  231    HG2  PRO  34           HG2      PRO  34  -4.726  -6.691  -3.024
  232    HG3  PRO  34           HG1      PRO  34  -5.990  -6.090  -1.942
  233    HD2  PRO  34           HD2      PRO  34  -3.637  -7.619  -1.279
  234    HD3  PRO  34           HD1      PRO  34  -4.863  -6.959  -0.179
  235    HA   PRO  35           HA       PRO  35  -3.600 -11.907  -4.740
  236    HB2  PRO  35           HB2      PRO  35  -4.510 -11.166  -7.283
  237    HB3  PRO  35           HB1      PRO  35  -5.026 -12.596  -6.389
  238    HG2  PRO  35           HG2      PRO  35  -6.353  -9.938  -6.642
  239    HG3  PRO  35           HG1      PRO  35  -7.079 -11.553  -6.581
  240    HD2  PRO  35           HD2      PRO  35  -7.135  -9.935  -4.463
  241    HD3  PRO  35           HD1      PRO  35  -6.893 -11.683  -4.276
  242    HA   PRO  36           HA       PRO  36  -0.289  -9.073  -5.354
  243    HB2  PRO  36           HB2      PRO  36   0.648  -9.995  -7.851
  244    HB3  PRO  36           HB1      PRO  36   1.179 -10.540  -6.265
  245    HG2  PRO  36           HG2      PRO  36  -0.846 -11.735  -8.094
  246    HG3  PRO  36           HG1      PRO  36   0.310 -12.542  -7.018
  247    HD2  PRO  36           HD2      PRO  36  -2.248 -12.422  -6.370
  248    HD3  PRO  36           HD1      PRO  36  -1.006 -12.139  -5.127
  249    H    TRP  37           H        TRP  37  -2.340  -9.447  -8.199
  250    HA   TRP  37           HA       TRP  37  -1.350  -7.089  -9.456
  251    HB2  TRP  37           HB2      TRP  37  -3.223  -7.392 -11.067
  252    HB3  TRP  37           HB1      TRP  37  -2.183  -8.794 -10.896
  253    HD1  TRP  37           HD       TRP  37  -5.741  -7.593  -9.874
  254    HE1  TRP  37           HE1      TRP  37  -7.205  -9.682  -9.562
  255    HE3  TRP  37          3HE       TRP  37  -2.167 -11.186 -10.425
  256    HZ2  TRP  37           HZ2      TRP  37  -6.890 -12.476  -9.561
  257    HZ3  TRP  37           HZ3      TRP  37  -2.829 -13.553 -10.246
  258    HH2  TRP  37           HH       TRP  37  -5.146 -14.175  -9.820
  259    H    GLU  38           H        GLU  38  -3.573  -7.551  -6.956
  260    HA   GLU  38           HA       GLU  38  -5.101  -5.187  -7.605
  261    HB2  GLU  38           HB2      GLU  38  -5.273  -7.197  -5.388
  262    HB3  GLU  38           HB1      GLU  38  -6.309  -5.774  -5.474
  263    HG2  GLU  38           HG2      GLU  38  -6.098  -7.840  -7.641
  264    HG3  GLU  38           HG1      GLU  38  -7.336  -7.880  -6.396
  265    H    CYS  39           H        CYS  39  -2.212  -5.809  -6.116
  266    HA   CYS  39           HA       CYS  39  -2.485  -3.467  -4.409
  267    HB2  CYS  39           HB2      CYS  39  -0.214  -5.447  -4.650
  268    HB3  CYS  39           HB1      CYS  39  -0.211  -4.024  -3.611
  269    H    TYR  40           H        TYR  40  -1.919  -1.621  -5.098
  270    HA   TYR  40           HA       TYR  40  -0.509  -1.325  -7.621
  271    HB2  TYR  40           HB2      TYR  40  -1.632   0.837  -5.811
  272    HB3  TYR  40           HB1      TYR  40  -1.320   0.943  -7.538
  273    HD1  TYR  40           HD1      TYR  40  -2.849  -0.302  -9.138
  274    HD2  TYR  40           HD2      TYR  40  -3.701   0.042  -4.985
  275    HE1  TYR  40           HE1      TYR  40  -5.185  -0.942  -9.564
  276    HE2  TYR  40           HE2      TYR  40  -6.027  -0.594  -5.398
  277    HH   TYR  40           HH       TYR  40  -7.098  -1.923  -8.341
  278    H    GLN  41           H        GLN  41   1.603  -0.458  -7.625
  279    HA   GLN  41           HA       GLN  41   2.779  -0.438  -4.940
  280    HB2  GLN  41           HB2      GLN  41   4.095  -1.014  -7.588
  281    HB3  GLN  41           HB1      GLN  41   4.862  -1.089  -6.004
  282    HG2  GLN  41           HG2      GLN  41   3.475  -2.916  -5.338
  283    HG3  GLN  41           HG1      GLN  41   2.510  -2.777  -6.804
  284   HE21  GLN  41          1HE2      GLN  41   3.390  -3.401  -8.729
  285   HE22  GLN  41          2HE2      GLN  41   4.732  -4.474  -8.848
  286    H    CYS  42           H        CYS  42   3.995   1.217  -4.247
  287    HA   CYS  42           HA       CYS  42   3.907   3.578  -5.878
  288    HB2  CYS  42           HB2      CYS  42   4.760   3.150  -3.013
  289    HB3  CYS  42           HB1      CYS  42   4.766   4.711  -3.827
  Start of MODEL   19
    1    H    PCA   1           H        PGL   1 -10.662  -0.359   1.980
    2    HA   PCA   1           HA       PGL   1 -11.851   1.458   0.697
    3    HB2  PCA   1           HB1      PGL   1 -13.503   2.435   1.921
    4    HB3  PCA   1           HB2      PGL   1 -12.249   3.235   2.908
    5    HG2  PCA   1           HG1      PGL   1 -13.933   0.959   3.620
    6    HG3  PCA   1           HG2      PGL   1 -12.758   1.860   4.637
    7    H    GLU   2           H        GLU   2  -9.634   1.528   3.309
    8    HA   GLU   2           HA       GLU   2  -8.323   3.953   2.373
    9    HB2  GLU   2           HB2      GLU   2  -8.001   2.208   4.795
   10    HB3  GLU   2           HB1      GLU   2  -6.819   3.435   4.370
   11    HG2  GLU   2           HG2      GLU   2  -9.737   3.959   4.872
   12    HG3  GLU   2           HG1      GLU   2  -8.440   4.207   6.047
   13    H    ALA   3           H        ALA   3  -5.881   3.824   2.284
   14    HA   ALA   3           HA       ALA   3  -5.187   1.599   0.590
   15    HB1  ALA   3           HB1      ALA   3  -3.071   2.838   0.285
   16    HB2  ALA   3           HB2      ALA   3  -3.605   4.012   1.488
   17    HB3  ALA   3           HB3      ALA   3  -4.481   3.846  -0.033
   18    H    PHE   4           H        PHE   4  -4.433  -0.169   1.411
   19    HA   PHE   4           HA       PHE   4  -3.200  -0.158   4.055
   20    HB2  PHE   4           HB2      PHE   4  -4.154  -2.474   2.357
   21    HB3  PHE   4           HB1      PHE   4  -3.585  -2.589   4.016
   22    HD1  PHE   4           HD1      PHE   4  -6.410  -2.434   2.008
   23    HD2  PHE   4           HD2      PHE   4  -4.902  -0.950   5.697
   24    HE1  PHE   4           HE1      PHE   4  -8.710  -2.028   2.781
   25    HE2  PHE   4           HE2      PHE   4  -7.207  -0.544   6.475
   26    HZ   PHE   4           HZ       PHE   4  -9.111  -1.089   5.009
   27    H    CYS   5           H        CYS   5  -1.108  -0.722   4.336
   28    HA   CYS   5           HA       CYS   5   0.470  -0.630   1.896
   29    HB2  CYS   5           HB2      CYS   5   1.299  -0.164   4.749
   30    HB3  CYS   5           HB1      CYS   5   2.238   0.186   3.300
   31    H    TYR   6           H        TYR   6   1.445  -2.329   1.214
   32    HA   TYR   6           HA       TYR   6   2.186  -4.476   3.086
   33    HB2  TYR   6           HB2      TYR   6   1.592  -4.784   0.132
   34    HB3  TYR   6           HB1      TYR   6   1.961  -6.047   1.239
   35    HD1  TYR   6           HD1      TYR   6  -0.652  -3.669   0.235
   36    HD2  TYR   6           HD2      TYR   6   0.315  -6.899   2.817
   37    HE1  TYR   6           HE1      TYR   6  -3.001  -3.914   0.794
   38    HE2  TYR   6           HE2      TYR   6  -2.041  -7.150   3.390
   39    HH   TYR   6           HH       TYR   6  -4.552  -5.445   1.696
   40    H    SER   7           H        SER   7   4.194  -4.760   3.299
   41    HA   SER   7           HA       SER   7   6.151  -3.315   1.735
   42    HB2  SER   7           HB2      SER   7   6.386  -5.240   4.033
   43    HB3  SER   7           HB1      SER   7   7.697  -4.213   3.423
   44    HG   SER   7           HG       SER   7   5.826  -2.546   3.823
   45    H    ASP   8           H        ASP   8   4.757  -5.246   0.247
   46    HA   ASP   8           HA       ASP   8   6.878  -6.795  -0.829
   47    HB2  ASP   8           HB2      ASP   8   6.205  -8.369   0.907
   48    HB3  ASP   8           HB1      ASP   8   4.517  -8.208   0.439
   49    H    ARG   9           H        ARG   9   6.460  -7.274  -2.939
   50    HA   ARG   9           HA       ARG   9   4.421  -5.717  -4.162
   51    HB2  ARG   9           HB2      ARG   9   6.448  -7.620  -5.320
   52    HB3  ARG   9           HB1      ARG   9   5.313  -6.708  -6.302
   53    HG2  ARG   9           HG2      ARG   9   7.398  -5.528  -4.468
   54    HG3  ARG   9           HG1      ARG   9   7.492  -5.620  -6.231
   55    HD2  ARG   9           HD2      ARG   9   5.461  -4.260  -6.395
   56    HD3  ARG   9           HD1      ARG   9   5.400  -4.130  -4.643
   57    HE   ARG   9           HE       ARG   9   7.768  -3.183  -6.022
   58   HH11  ARG   9          HH11      ARG   9   4.848  -2.474  -4.152
   59   HH12  ARG   9          HH12      ARG   9   5.150  -0.812  -4.011
   60   HH21  ARG   9          HH21      ARG   9   8.162  -0.825  -5.881
   61   HH22  ARG   9          HH22      ARG   9   7.043   0.184  -5.112
   62    H    PHE  10           H        PHE  10   4.343  -8.887  -2.968
   63    HA   PHE  10           HA       PHE  10   2.190  -9.544  -4.807
   64    HB2  PHE  10           HB2      PHE  10   3.749 -11.323  -2.924
   65    HB3  PHE  10           HB1      PHE  10   2.491 -11.861  -4.032
   66    HD1  PHE  10           HD1      PHE  10   2.897 -11.920  -6.429
   67    HD2  PHE  10           HD2      PHE  10   5.938 -10.743  -3.704
   68    HE1  PHE  10           HE1      PHE  10   4.573 -12.199  -8.191
   69    HE2  PHE  10           HE2      PHE  10   7.629 -11.023  -5.464
   70    HZ   PHE  10           HZ       PHE  10   6.943 -11.756  -7.718
   71    H    CYS  11           H        CYS  11   2.329  -7.788  -2.321
   72    HA   CYS  11           HA       CYS  11   0.809  -7.029  -0.765
   73    HB2  CYS  11           HB2      CYS  11  -1.040  -9.240  -1.666
   74    HB3  CYS  11           HB1      CYS  11  -1.450  -7.707  -0.909
   75    H    GLN  12           H        GLN  12   2.639  -9.456  -0.267
   76    HA   GLN  12           HA       GLN  12   1.079 -11.078   1.530
   77    HB2  GLN  12           HB2      GLN  12   4.025 -11.147   0.958
   78    HB3  GLN  12           HB1      GLN  12   3.113 -12.362   1.844
   79    HG2  GLN  12           HG2      GLN  12   1.846 -12.907  -0.123
   80    HG3  GLN  12           HG1      GLN  12   2.624 -11.605  -1.021
   81   HE21  GLN  12          1HE2      GLN  12   4.809 -11.779  -1.467
   82   HE22  GLN  12          2HE2      GLN  12   5.586 -13.320  -1.591
   83    H    ASN  13           H        ASN  13   2.977  -8.219   1.945
   84    HA   ASN  13           HA       ASN  13   3.378  -9.008   4.757
   85    HB2  ASN  13           HB2      ASN  13   5.091  -7.107   3.140
   86    HB3  ASN  13           HB1      ASN  13   5.276  -7.399   4.863
   87   HD21  ASN  13          HD21      ASN  13   7.191  -7.820   2.720
   88   HD22  ASN  13          HD22      ASN  13   7.589  -9.491   2.774
   89    H    TYR  14           H        TYR  14   1.357  -8.256   5.357
   90    HA   TYR  14           HA       TYR  14   0.667  -5.522   4.908
   91    HB2  TYR  14           HB2      TYR  14  -1.114  -7.160   5.128
   92    HB3  TYR  14           HB1      TYR  14  -0.533  -7.608   6.724
   93    HD1  TYR  14           HD1      TYR  14  -1.743  -4.571   4.889
   94    HD2  TYR  14           HD2      TYR  14  -1.558  -6.713   8.549
   95    HE1  TYR  14           HE1      TYR  14  -3.181  -2.887   5.953
   96    HE2  TYR  14           HE2      TYR  14  -2.987  -5.059   9.608
   97    HH   TYR  14           HH       TYR  14  -3.589  -2.728   9.318
   98    H    ILE  15           H        ILE  15   1.635  -3.921   5.955
   99    HA   ILE  15           HA       ILE  15   2.620  -4.450   8.664
  100    HB   ILE  15           HB       ILE  15   3.882  -2.341   8.474
  101   HG12  ILE  15          HG12      ILE  15   2.977  -2.334   5.577
  102   HG13  ILE  15          HG11      ILE  15   2.417  -1.214   6.811
  103   HG21  ILE  15          HG21      ILE  15   5.573  -3.188   6.895
  104   HG22  ILE  15          HG22      ILE  15   4.396  -4.357   6.297
  105   HG23  ILE  15          HG23      ILE  15   4.953  -4.444   7.967
  106   HD11  ILE  15          HD11      ILE  15   5.241  -1.467   5.798
  107   HD12  ILE  15          HD12      ILE  15   4.689  -0.337   7.035
  108   HD13  ILE  15          HD13      ILE  15   4.094  -0.195   5.381
  109    H    GLY  16           H        GLY  16   0.238  -2.744   6.938
  110    HA2  GLY  16           HA2      GLY  16  -1.578  -2.128   8.621
  111    HA3  GLY  16           HA1      GLY  16  -0.328  -1.027   9.213
  112    H    SER  17           H        SER  17  -1.556   0.758   8.640
  113    HA   SER  17           HA       SER  17  -1.298   1.380   5.819
  114    HB2  SER  17           HB2      SER  17  -3.530   2.633   6.094
  115    HB3  SER  17           HB1      SER  17  -3.620   0.877   5.982
  116    HG   SER  17           HG       SER  17  -3.340   1.951   8.533
  117    H    ILE  18           H        ILE  18  -0.367   3.356   5.537
  118    HA   ILE  18           HA       ILE  18  -0.290   5.224   7.733
  119    HB   ILE  18           HB       ILE  18   2.222   5.493   7.411
  120   HG12  ILE  18          HG12      ILE  18   1.964   2.735   6.178
  121   HG13  ILE  18          HG11      ILE  18   2.484   4.198   5.356
  122   HG21  ILE  18          HG21      ILE  18   1.372   4.599   9.460
  123   HG22  ILE  18          HG22      ILE  18   2.834   3.724   9.003
  124   HG23  ILE  18          HG23      ILE  18   1.250   2.991   8.747
  125   HD11  ILE  18          HD11      ILE  18   4.367   2.762   5.873
  126   HD12  ILE  18          HD12      ILE  18   3.931   2.790   7.581
  127   HD13  ILE  18          HD13      ILE  18   4.477   4.269   6.789
  128    HA   PRO  19           HA       PRO  19  -0.510   8.132   4.353
  129    HB2  PRO  19           HB2      PRO  19   1.315   9.834   5.972
  130    HB3  PRO  19           HB1      PRO  19  -0.280  10.217   5.317
  131    HG2  PRO  19           HG2      PRO  19   0.008   9.758   7.914
  132    HG3  PRO  19           HG1      PRO  19  -1.394   9.119   7.040
  133    HD2  PRO  19           HD2      PRO  19   1.088   7.696   7.923
  134    HD3  PRO  19           HD1      PRO  19  -0.610   7.169   7.979
  135    H    ASP  20           H        ASP  20   2.449   7.009   5.623
  136    HA   ASP  20           HA       ASP  20   4.147   8.104   3.509
  137    HB2  ASP  20           HB2      ASP  20   4.758   6.249   5.821
  138    HB3  ASP  20           HB1      ASP  20   5.952   6.811   4.665
  139    H    CYS  21           H        CYS  21   1.962   6.126   2.962
  140    HA   CYS  21           HA       CYS  21   2.924   3.528   2.698
  141    HB2  CYS  21           HB2      CYS  21   0.495   4.541   2.562
  142    HB3  CYS  21           HB1      CYS  21   0.823   4.539   0.829
  143    H    CYS  22           H        CYS  22   2.557   5.967   0.079
  144    HA   CYS  22           HA       CYS  22   4.296   4.299  -1.549
  145    HB2  CYS  22           HB2      CYS  22   2.624   6.696  -2.242
  146    HB3  CYS  22           HB1      CYS  22   3.738   5.944  -3.374
  147    H    PHE  23           H        PHE  23   5.007   6.164   0.740
  148    HA   PHE  23           HA       PHE  23   6.936   7.823  -0.654
  149    HB2  PHE  23           HB2      PHE  23   6.068   7.753   2.241
  150    HB3  PHE  23           HB1      PHE  23   7.417   8.730   1.676
  151    HD1  PHE  23           HD1      PHE  23   7.054  10.810   0.597
  152    HD2  PHE  23           HD2      PHE  23   3.738   8.249   1.381
  153    HE1  PHE  23           HE1      PHE  23   5.511  12.621   0.011
  154    HE2  PHE  23           HE2      PHE  23   2.206  10.059   0.797
  155    HZ   PHE  23           HZ       PHE  23   3.087  12.252   0.109
  156    H    GLY  24           H        GLY  24   6.709   4.785   0.389
  157    HA2  GLY  24           HA2      GLY  24   9.597   4.472   0.542
  158    HA3  GLY  24           HA1      GLY  24   8.610   3.773   1.829
  159    H    ARG  25           H        ARG  25   9.760   1.819   0.791
  160    HA   ARG  25           HA       ARG  25   8.637   0.901  -1.696
  161    HB2  ARG  25           HB2      ARG  25  10.333  -0.475   0.394
  162    HB3  ARG  25           HB1      ARG  25   9.800  -1.253  -1.087
  163    HG2  ARG  25           HG2      ARG  25  11.052   0.302  -2.415
  164    HG3  ARG  25           HG1      ARG  25  11.477   1.240  -0.983
  165    HD2  ARG  25           HD2      ARG  25  13.315  -0.207  -1.740
  166    HD3  ARG  25           HD1      ARG  25  12.775  -0.603  -0.118
  167    HE   ARG  25           HE       ARG  25  11.490  -2.455  -1.210
  168   HH11  ARG  25          HH11      ARG  25  14.370  -1.185  -2.837
  169   HH12  ARG  25          HH12      ARG  25  14.854  -2.698  -3.448
  170   HH21  ARG  25          HH21      ARG  25  12.169  -4.527  -2.079
  171   HH22  ARG  25          HH22      ARG  25  13.599  -4.624  -2.984
  172    H    GLY  26           H        GLY  26   6.561   0.333  -1.748
  173    HA2  GLY  26           HA2      GLY  26   5.588  -1.792  -0.181
  174    HA3  GLY  26           HA1      GLY  26   4.970  -0.251   0.402
  175    H    SER  27           H        SER  27   3.371  -2.211  -0.637
  176    HA   SER  27           HA       SER  27   2.414  -0.981  -3.136
  177    HB2  SER  27           HB2      SER  27   1.841  -3.782  -2.128
  178    HB3  SER  27           HB1      SER  27   1.553  -3.126  -3.741
  179    HG   SER  27           HG       SER  27   3.794  -4.175  -2.620
  180    H    TYR  28           H        TYR  28   0.112  -0.560  -3.121
  181    HA   TYR  28           HA       TYR  28  -1.106  -0.978  -0.497
  182    HB2  TYR  28           HB2      TYR  28  -2.170   1.168  -0.519
  183    HB3  TYR  28           HB1      TYR  28  -0.447   1.409  -0.739
  184    HD1  TYR  28           HD1      TYR  28  -3.759   1.910  -2.147
  185    HD2  TYR  28           HD2      TYR  28   0.405   2.063  -3.016
  186    HE1  TYR  28           HE1      TYR  28  -4.216   3.300  -4.117
  187    HE2  TYR  28           HE2      TYR  28  -0.040   3.431  -4.960
  188    HH   TYR  28           HH       TYR  28  -1.838   3.905  -6.475
  189    H    SER  29           H        SER  29  -3.237  -1.382  -0.443
  190    HA   SER  29           HA       SER  29  -4.709  -1.477  -2.951
  191    HB2  SER  29           HB2      SER  29  -5.634  -3.689  -2.241
  192    HB3  SER  29           HB1      SER  29  -3.900  -3.761  -2.566
  193    HG   SER  29           HG       SER  29  -5.230  -4.263  -0.250
  194    H    PHE  30           H        PHE  30  -7.104  -1.674  -2.374
  195    HA   PHE  30           HA       PHE  30  -7.541  -0.153   0.084
  196    HB2  PHE  30           HB2      PHE  30  -9.361  -0.542  -2.304
  197    HB3  PHE  30           HB1      PHE  30  -9.731   0.451  -0.897
  198    HD1  PHE  30           HD1      PHE  30  -8.091   2.366  -0.376
  199    HD2  PHE  30           HD2      PHE  30  -8.284   0.383  -4.128
  200    HE1  PHE  30           HE1      PHE  30  -6.987   4.286  -1.440
  201    HE2  PHE  30           HE2      PHE  30  -7.176   2.300  -5.205
  202    HZ   PHE  30           HZ       PHE  30  -6.527   4.259  -3.855
  203    H    GLU  31           H        GLU  31  -7.259  -3.131  -0.557
  204    HA   GLU  31           HA       GLU  31  -9.438  -4.001   1.171
  205    HB2  GLU  31           HB2      GLU  31  -9.976  -4.499  -1.220
  206    HB3  GLU  31           HB1      GLU  31  -8.520  -5.480  -1.303
  207    HG2  GLU  31           HG2      GLU  31 -10.586  -6.787  -0.993
  208    HG3  GLU  31           HG1      GLU  31  -9.407  -7.023   0.302
  209    H    LEU  32           H        LEU  32  -8.925  -5.744   2.491
  210    HA   LEU  32           HA       LEU  32  -6.107  -5.970   3.111
  211    HB2  LEU  32           HB2      LEU  32  -8.567  -7.008   4.497
  212    HB3  LEU  32           HB1      LEU  32  -6.934  -7.310   5.054
  213    HG   LEU  32           HG       LEU  32  -8.136  -4.552   4.788
  214   HD11  LEU  32          HD11      LEU  32  -9.289  -5.862   6.498
  215   HD12  LEU  32          HD12      LEU  32  -8.283  -4.606   7.223
  216   HD13  LEU  32          HD13      LEU  32  -7.737  -6.285   7.219
  217   HD21  LEU  32          HD21      LEU  32  -5.610  -5.559   6.093
  218   HD22  LEU  32          HD22      LEU  32  -6.213  -3.905   6.155
  219   HD23  LEU  32          HD23      LEU  32  -5.704  -4.594   4.618
  220    H    GLN  33           H        GLN  33  -4.882  -7.714   3.054
  221    HA   GLN  33           HA       GLN  33  -3.952  -9.535   2.092
  222    HB2  GLN  33           HB2      GLN  33  -6.505 -10.774   3.126
  223    HB3  GLN  33           HB1      GLN  33  -5.158 -11.716   2.513
  224    HG2  GLN  33           HG2      GLN  33  -3.733 -10.817   4.290
  225    HG3  GLN  33           HG1      GLN  33  -5.087  -9.862   4.886
  226   HE21  GLN  33          1HE2      GLN  33  -3.524 -11.951   6.219
  227   HE22  GLN  33          2HE2      GLN  33  -4.673 -13.141   6.723
  228    HA   PRO  34           HA       PRO  34  -6.406  -9.635  -1.822
  229    HB2  PRO  34           HB2      PRO  34  -5.429  -7.582  -3.181
  230    HB3  PRO  34           HB1      PRO  34  -6.559  -7.301  -1.848
  231    HG2  PRO  34           HG2      PRO  34  -3.617  -6.901  -1.952
  232    HG3  PRO  34           HG1      PRO  34  -4.843  -5.996  -1.054
  233    HD2  PRO  34           HD2      PRO  34  -3.187  -8.106  -0.066
  234    HD3  PRO  34           HD1      PRO  34  -4.514  -7.292   0.777
  235    HA   PRO  35           HA       PRO  35  -3.073 -11.494  -4.219
  236    HB2  PRO  35           HB2      PRO  35  -4.060 -11.410  -6.727
  237    HB3  PRO  35           HB1      PRO  35  -4.748 -12.473  -5.496
  238    HG2  PRO  35           HG2      PRO  35  -5.730  -9.835  -6.485
  239    HG3  PRO  35           HG1      PRO  35  -6.652 -11.295  -6.090
  240    HD2  PRO  35           HD2      PRO  35  -6.405  -9.135  -4.419
  241    HD3  PRO  35           HD1      PRO  35  -6.720 -10.789  -3.864
  242    HA   PRO  36           HA       PRO  36  -0.015  -8.560  -5.465
  243    HB2  PRO  36           HB2      PRO  36   0.479  -9.660  -8.063
  244    HB3  PRO  36           HB1      PRO  36   1.435  -9.875  -6.603
  245    HG2  PRO  36           HG2      PRO  36  -0.640 -11.623  -7.780
  246    HG3  PRO  36           HG1      PRO  36   0.720 -12.047  -6.730
  247    HD2  PRO  36           HD2      PRO  36  -1.781 -12.088  -5.822
  248    HD3  PRO  36           HD1      PRO  36  -0.453 -11.505  -4.793
  249    H    TRP  37           H        TRP  37  -2.192  -9.330  -8.155
  250    HA   TRP  37           HA       TRP  37  -1.560  -6.967  -9.572
  251    HB2  TRP  37           HB2      TRP  37  -3.464  -7.589 -11.071
  252    HB3  TRP  37           HB1      TRP  37  -2.237  -8.829 -10.881
  253    HD1  TRP  37           HD       TRP  37  -5.900  -8.099 -10.192
  254    HE1  TRP  37           HE1      TRP  37  -7.078 -10.287  -9.488
  255    HE3  TRP  37          3HE       TRP  37  -1.807 -11.116  -9.685
  256    HZ2  TRP  37           HZ2      TRP  37  -6.366 -12.932  -8.818
  257    HZ3  TRP  37           HZ3      TRP  37  -2.141 -13.458  -9.009
  258    HH2  TRP  37           HH       TRP  37  -4.375 -14.341  -8.584
  259    H    GLU  38           H        GLU  38  -3.766  -7.507  -7.001
  260    HA   GLU  38           HA       GLU  38  -5.248  -5.144  -7.759
  261    HB2  GLU  38           HB2      GLU  38  -5.703  -7.102  -5.513
  262    HB3  GLU  38           HB1      GLU  38  -6.645  -5.629  -5.714
  263    HG2  GLU  38           HG2      GLU  38  -7.210  -6.442  -8.027
  264    HG3  GLU  38           HG1      GLU  38  -6.487  -7.981  -7.578
  265    H    CYS  39           H        CYS  39  -2.447  -5.739  -6.232
  266    HA   CYS  39           HA       CYS  39  -2.726  -3.428  -4.492
  267    HB2  CYS  39           HB2      CYS  39  -0.443  -5.365  -4.873
  268    HB3  CYS  39           HB1      CYS  39  -0.341  -3.910  -3.890
  269    H    TYR  40           H        TYR  40  -1.975  -1.556  -4.991
  270    HA   TYR  40           HA       TYR  40  -0.877  -1.221  -7.629
  271    HB2  TYR  40           HB2      TYR  40  -1.760   0.863  -5.613
  272    HB3  TYR  40           HB1      TYR  40  -1.425   1.127  -7.324
  273    HD1  TYR  40           HD1      TYR  40  -2.892  -0.172  -9.015
  274    HD2  TYR  40           HD2      TYR  40  -3.949   0.345  -4.927
  275    HE1  TYR  40           HE1      TYR  40  -5.223  -0.697  -9.559
  276    HE2  TYR  40           HE2      TYR  40  -6.286  -0.179  -5.460
  277    HH   TYR  40           HH       TYR  40  -7.788  -0.104  -7.479
  278    H    GLN  41           H        GLN  41   1.179  -1.046  -7.865
  279    HA   GLN  41           HA       GLN  41   2.930  -1.192  -5.604
  280    HB2  GLN  41           HB2      GLN  41   3.499  -1.052  -8.556
  281    HB3  GLN  41           HB1      GLN  41   4.697  -1.369  -7.313
  282    HG2  GLN  41           HG2      GLN  41   3.558  -3.435  -6.714
  283    HG3  GLN  41           HG1      GLN  41   2.309  -3.101  -7.905
  284   HE21  GLN  41          1HE2      GLN  41   4.152  -2.089  -9.920
  285   HE22  GLN  41          2HE2      GLN  41   4.994  -3.453 -10.530
  286    H    CYS  42           H        CYS  42   3.585   0.603  -4.538
  287    HA   CYS  42           HA       CYS  42   3.641   3.142  -5.798
  288    HB2  CYS  42           HB2      CYS  42   4.982   2.270  -3.222
  289    HB3  CYS  42           HB1      CYS  42   4.591   3.915  -3.703
  Start of MODEL   20
    1    H    PCA   1           H        PGL   1  -9.014   6.675   3.875
    2    HA   PCA   1           HA       PGL   1  -7.630   8.264   2.387
    3    HB2  PCA   1           HB1      PGL   1  -7.008  10.152   3.486
    4    HB3  PCA   1           HB2      PGL   1  -5.962   9.168   4.546
    5    HG2  PCA   1           HG1      PGL   1  -8.464  10.425   5.239
    6    HG3  PCA   1           HG2      PGL   1  -7.453   9.340   6.251
    7    H    GLU   2           H        GLU   2  -6.981   6.254   5.126
    8    HA   GLU   2           HA       GLU   2  -4.283   5.656   4.391
    9    HB2  GLU   2           HB2      GLU   2  -6.125   4.157   6.262
   10    HB3  GLU   2           HB1      GLU   2  -4.407   3.896   6.093
   11    HG2  GLU   2           HG2      GLU   2  -4.792   5.118   8.105
   12    HG3  GLU   2           HG1      GLU   2  -4.025   6.198   6.950
   13    H    ALA   3           H        ALA   3  -3.601   4.167   2.995
   14    HA   ALA   3           HA       ALA   3  -5.546   2.236   1.976
   15    HB1  ALA   3           HB1      ALA   3  -4.477   3.663   0.280
   16    HB2  ALA   3           HB2      ALA   3  -3.987   1.981   0.099
   17    HB3  ALA   3           HB3      ALA   3  -2.886   3.143   0.844
   18    H    PHE   4           H        PHE   4  -4.807   0.007   1.848
   19    HA   PHE   4           HA       PHE   4  -3.238  -0.658   4.165
   20    HB2  PHE   4           HB2      PHE   4  -4.460  -2.469   2.064
   21    HB3  PHE   4           HB1      PHE   4  -3.785  -2.989   3.601
   22    HD1  PHE   4           HD1      PHE   4  -6.704  -2.039   1.898
   23    HD2  PHE   4           HD2      PHE   4  -4.888  -1.951   5.734
   24    HE1  PHE   4           HE1      PHE   4  -8.914  -1.742   2.931
   25    HE2  PHE   4           HE2      PHE   4  -7.097  -1.658   6.775
   26    HZ   PHE   4           HZ       PHE   4  -9.113  -1.555   5.375
   27    H    CYS   5           H        CYS   5  -1.139  -0.889   4.143
   28    HA   CYS   5           HA       CYS   5   0.137  -0.970   1.531
   29    HB2  CYS   5           HB2      CYS   5   1.147   0.074   4.160
   30    HB3  CYS   5           HB1      CYS   5   2.086   0.012   2.670
   31    H    TYR   6           H        TYR   6   1.328  -2.504   0.952
   32    HA   TYR   6           HA       TYR   6   2.316  -4.491   2.892
   33    HB2  TYR   6           HB2      TYR   6   1.519  -4.933   0.032
   34    HB3  TYR   6           HB1      TYR   6   1.955  -6.178   1.206
   35    HD1  TYR   6           HD1      TYR   6  -0.713  -4.008  -0.006
   36    HD2  TYR   6           HD2      TYR   6   0.375  -6.802   3.003
   37    HE1  TYR   6           HE1      TYR   6  -3.044  -4.228   0.615
   38    HE2  TYR   6           HE2      TYR   6  -1.967  -7.031   3.641
   39    HH   TYR   6           HH       TYR   6  -4.552  -5.621   1.743
   40    H    SER   7           H        SER   7   4.385  -4.417   2.971
   41    HA   SER   7           HA       SER   7   6.012  -2.980   1.045
   42    HB2  SER   7           HB2      SER   7   6.651  -4.520   3.523
   43    HB3  SER   7           HB1      SER   7   7.875  -3.606   2.612
   44    HG   SER   7           HG       SER   7   6.224  -1.825   2.896
   45    H    ASP   8           H        ASP   8   4.694  -5.434   0.253
   46    HA   ASP   8           HA       ASP   8   6.916  -6.749  -1.032
   47    HB2  ASP   8           HB2      ASP   8   6.454  -8.206   0.868
   48    HB3  ASP   8           HB1      ASP   8   4.728  -8.133   0.548
   49    H    ARG   9           H        ARG   9   6.386  -7.053  -3.122
   50    HA   ARG   9           HA       ARG   9   3.998  -5.830  -3.999
   51    HB2  ARG   9           HB2      ARG   9   6.296  -7.028  -5.464
   52    HB3  ARG   9           HB1      ARG   9   4.840  -6.518  -6.315
   53    HG2  ARG   9           HG2      ARG   9   5.087  -4.273  -5.271
   54    HG3  ARG   9           HG1      ARG   9   6.631  -4.801  -4.613
   55    HD2  ARG   9           HD2      ARG   9   7.540  -5.076  -6.796
   56    HD3  ARG   9           HD1      ARG   9   5.940  -4.840  -7.520
   57    HE   ARG   9           HE       ARG   9   6.457  -2.579  -6.040
   58   HH11  ARG   9          HH11      ARG   9   8.071  -4.123  -8.779
   59   HH12  ARG   9          HH12      ARG   9   8.544  -2.680  -9.515
   60   HH21  ARG   9          HH21      ARG   9   7.087  -0.509  -7.088
   61   HH22  ARG   9          HH22      ARG   9   7.950  -0.605  -8.542
   62    H    PHE  10           H        PHE  10   4.535  -8.980  -3.035
   63    HA   PHE  10           HA       PHE  10   2.428 -10.010  -4.752
   64    HB2  PHE  10           HB2      PHE  10   4.049 -11.376  -2.597
   65    HB3  PHE  10           HB1      PHE  10   2.892 -12.166  -3.659
   66    HD1  PHE  10           HD1      PHE  10   3.384 -12.300  -6.098
   67    HD2  PHE  10           HD2      PHE  10   6.253 -10.989  -3.258
   68    HE1  PHE  10           HE1      PHE  10   5.169 -12.744  -7.708
   69    HE2  PHE  10           HE2      PHE  10   8.054 -11.430  -4.863
   70    HZ   PHE  10           HZ       PHE  10   7.511 -12.315  -7.101
   71    H    CYS  11           H        CYS  11   2.550  -8.079  -2.254
   72    HA   CYS  11           HA       CYS  11   0.995  -7.255  -0.813
   73    HB2  CYS  11           HB2      CYS  11  -0.774  -9.558  -1.645
   74    HB3  CYS  11           HB1      CYS  11  -1.272  -8.083  -0.827
   75    H    GLN  12           H        GLN  12   2.885  -9.674  -0.199
   76    HA   GLN  12           HA       GLN  12   1.296 -10.920   1.874
   77    HB2  GLN  12           HB2      GLN  12   4.076 -11.599   0.973
   78    HB3  GLN  12           HB1      GLN  12   3.107 -12.521   2.112
   79    HG2  GLN  12           HG2      GLN  12   2.531 -12.064  -0.803
   80    HG3  GLN  12           HG1      GLN  12   3.000 -13.577  -0.035
   81   HE21  GLN  12          1HE2      GLN  12   0.682 -12.803  -1.597
   82   HE22  GLN  12          2HE2      GLN  12  -0.707 -13.219  -0.686
   83    H    ASN  13           H        ASN  13   3.071  -8.189   1.893
   84    HA   ASN  13           HA       ASN  13   3.845  -8.741   4.673
   85    HB2  ASN  13           HB2      ASN  13   5.375  -7.113   2.668
   86    HB3  ASN  13           HB1      ASN  13   5.577  -6.843   4.387
   87   HD21  ASN  13          HD21      ASN  13   7.666  -7.486   4.413
   88   HD22  ASN  13          HD22      ASN  13   8.190  -9.110   4.178
   89    H    TYR  14           H        TYR  14   1.873  -8.044   5.422
   90    HA   TYR  14           HA       TYR  14   0.887  -5.426   4.854
   91    HB2  TYR  14           HB2      TYR  14  -0.631  -7.249   5.536
   92    HB3  TYR  14           HB1      TYR  14   0.181  -7.350   7.091
   93    HD1  TYR  14           HD1      TYR  14  -1.815  -5.019   4.964
   94    HD2  TYR  14           HD2      TYR  14  -0.604  -6.081   8.905
   95    HE1  TYR  14           HE1      TYR  14  -3.389  -3.395   5.872
   96    HE2  TYR  14           HE2      TYR  14  -2.188  -4.458   9.835
   97    HH   TYR  14           HH       TYR  14  -4.653  -3.014   8.090
   98    H    ILE  15           H        ILE  15   1.629  -3.586   5.693
   99    HA   ILE  15           HA       ILE  15   3.167  -3.747   8.209
  100    HB   ILE  15           HB       ILE  15   4.323  -1.685   7.534
  101   HG12  ILE  15          HG12      ILE  15   2.805  -1.984   4.923
  102   HG13  ILE  15          HG11      ILE  15   2.514  -0.738   6.126
  103   HG21  ILE  15          HG21      ILE  15   5.671  -2.668   5.731
  104   HG22  ILE  15          HG22      ILE  15   4.417  -3.879   5.475
  105   HG23  ILE  15          HG23      ILE  15   5.301  -3.839   6.999
  106   HD11  ILE  15          HD11      ILE  15   4.771   0.136   5.732
  107   HD12  ILE  15          HD12      ILE  15   3.785   0.134   4.273
  108   HD13  ILE  15          HD13      ILE  15   5.020  -1.104   4.502
  109    H    GLY  16           H        GLY  16   0.291  -2.809   6.981
  110    HA2  GLY  16           HA2      GLY  16  -1.190  -1.925   8.777
  111    HA3  GLY  16           HA1      GLY  16  -0.002  -0.627   8.916
  112    H    SER  17           H        SER  17  -1.878   0.727   8.414
  113    HA   SER  17           HA       SER  17  -2.128   0.952   5.526
  114    HB2  SER  17           HB2      SER  17  -4.523   1.718   6.002
  115    HB3  SER  17           HB1      SER  17  -4.197  -0.004   6.169
  116    HG   SER  17           HG       SER  17  -3.989   1.720   8.388
  117    H    ILE  18           H        ILE  18  -1.735   2.941   4.783
  118    HA   ILE  18           HA       ILE  18  -1.954   5.245   6.497
  119    HB   ILE  18           HB       ILE  18   0.410   5.983   5.755
  120   HG12  ILE  18          HG12      ILE  18   0.691   2.993   5.391
  121   HG13  ILE  18          HG11      ILE  18   0.867   4.225   4.151
  122   HG21  ILE  18          HG21      ILE  18  -0.100   5.607   8.070
  123   HG22  ILE  18          HG22      ILE  18   1.504   4.970   7.706
  124   HG23  ILE  18          HG23      ILE  18   0.135   3.870   7.874
  125   HD11  ILE  18          HD11      ILE  18   2.670   3.835   6.528
  126   HD12  ILE  18          HD12      ILE  18   2.863   5.063   5.274
  127   HD13  ILE  18          HD13      ILE  18   3.011   3.352   4.866
  128    HA   PRO  19           HA       PRO  19  -2.915   7.027   2.507
  129    HB2  PRO  19           HB2      PRO  19  -1.952   9.647   3.406
  130    HB3  PRO  19           HB1      PRO  19  -3.608   9.135   3.071
  131    HG2  PRO  19           HG2      PRO  19  -2.753   9.663   5.577
  132    HG3  PRO  19           HG1      PRO  19  -3.964   8.414   5.234
  133    HD2  PRO  19           HD2      PRO  19  -1.026   8.114   5.729
  134    HD3  PRO  19           HD1      PRO  19  -2.373   7.165   6.394
  135    H    ASP  20           H        ASP  20   0.143   7.682   4.013
  136    HA   ASP  20           HA       ASP  20   1.456   8.447   1.523
  137    HB2  ASP  20           HB2      ASP  20   2.556   8.079   4.325
  138    HB3  ASP  20           HB1      ASP  20   3.487   8.644   2.952
  139    H    CYS  21           H        CYS  21   1.107   6.394   0.483
  140    HA   CYS  21           HA       CYS  21   2.401   4.175   1.870
  141    HB2  CYS  21           HB2      CYS  21   0.004   4.035   0.987
  142    HB3  CYS  21           HB1      CYS  21   0.738   3.895  -0.610
  143    H    CYS  22           H        CYS  22   2.462   5.872  -1.230
  144    HA   CYS  22           HA       CYS  22   4.524   4.128  -2.237
  145    HB2  CYS  22           HB2      CYS  22   3.194   6.550  -3.434
  146    HB3  CYS  22           HB1      CYS  22   4.366   5.540  -4.276
  147    H    PHE  23           H        PHE  23   4.983   6.042   0.068
  148    HA   PHE  23           HA       PHE  23   7.323   7.377  -1.095
  149    HB2  PHE  23           HB2      PHE  23   5.818   8.044   1.448
  150    HB3  PHE  23           HB1      PHE  23   7.290   8.847   0.914
  151    HD1  PHE  23           HD1      PHE  23   3.770   8.918   0.852
  152    HD2  PHE  23           HD2      PHE  23   7.196   9.912  -1.464
  153    HE1  PHE  23           HE1      PHE  23   2.425  10.490  -0.455
  154    HE2  PHE  23           HE2      PHE  23   5.855  11.498  -2.776
  155    HZ   PHE  23           HZ       PHE  23   3.460  11.790  -2.272
  156    H    GLY  24           H        GLY  24   6.524   4.658   0.222
  157    HA2  GLY  24           HA2      GLY  24   9.116   4.228   1.418
  158    HA3  GLY  24           HA1      GLY  24   7.700   3.896   2.420
  159    H    ARG  25           H        ARG  25   8.813   1.702   2.186
  160    HA   ARG  25           HA       ARG  25   8.480   0.354  -0.278
  161    HB2  ARG  25           HB2      ARG  25   8.940  -0.659   2.517
  162    HB3  ARG  25           HB1      ARG  25   8.818  -1.727   1.128
  163    HG2  ARG  25           HG2      ARG  25  10.745  -0.633   0.111
  164    HG3  ARG  25           HG1      ARG  25  10.851   0.455   1.497
  165    HD2  ARG  25           HD2      ARG  25  11.310  -1.364   2.969
  166    HD3  ARG  25           HD1      ARG  25  11.021  -2.541   1.690
  167    HE   ARG  25           HE       ARG  25  13.027  -0.896   0.786
  168   HH11  ARG  25          HH11      ARG  25  12.561  -3.002   3.584
  169   HH12  ARG  25          HH12      ARG  25  14.175  -3.532   3.650
  170   HH21  ARG  25          HH21      ARG  25  15.306  -1.634   0.870
  171   HH22  ARG  25          HH22      ARG  25  15.752  -2.738   2.088
  172    H    GLY  26           H        GLY  26   6.515  -0.094  -1.152
  173    HA2  GLY  26           HA2      GLY  26   4.654  -1.596   0.297
  174    HA3  GLY  26           HA1      GLY  26   4.192   0.086   0.354
  175    H    SER  27           H        SER  27   2.994  -2.235  -0.720
  176    HA   SER  27           HA       SER  27   2.220  -1.178  -3.332
  177    HB2  SER  27           HB2      SER  27   1.761  -3.975  -2.215
  178    HB3  SER  27           HB1      SER  27   1.550  -3.431  -3.878
  179    HG   SER  27           HG       SER  27   3.735  -4.375  -2.622
  180    H    TYR  28           H        TYR  28  -0.003  -0.644  -3.246
  181    HA   TYR  28           HA       TYR  28  -1.174  -1.048  -0.589
  182    HB2  TYR  28           HB2      TYR  28  -2.170   1.145  -0.603
  183    HB3  TYR  28           HB1      TYR  28  -0.442   1.270  -0.838
  184    HD1  TYR  28           HD1      TYR  28  -3.712   2.005  -2.168
  185    HD2  TYR  28           HD2      TYR  28   0.448   1.933  -3.182
  186    HE1  TYR  28           HE1      TYR  28  -4.140   3.479  -4.068
  187    HE2  TYR  28           HE2      TYR  28   0.016   3.387  -5.057
  188    HH   TYR  28           HH       TYR  28  -1.957   3.976  -6.534
  189    H    SER  29           H        SER  29  -3.300  -1.409  -0.359
  190    HA   SER  29           HA       SER  29  -4.917  -1.526  -2.773
  191    HB2  SER  29           HB2      SER  29  -5.842  -3.722  -2.009
  192    HB3  SER  29           HB1      SER  29  -4.127  -3.816  -2.403
  193    HG   SER  29           HG       SER  29  -5.379  -4.298  -0.052
  194    H    PHE  30           H        PHE  30  -7.278  -1.833  -2.073
  195    HA   PHE  30           HA       PHE  30  -7.719  -0.210   0.322
  196    HB2  PHE  30           HB2      PHE  30  -9.443  -0.521  -2.153
  197    HB3  PHE  30           HB1      PHE  30  -9.875   0.430  -0.734
  198    HD1  PHE  30           HD1      PHE  30  -8.593   2.453  -0.166
  199    HD2  PHE  30           HD2      PHE  30  -7.936   0.325  -3.788
  200    HE1  PHE  30           HE1      PHE  30  -7.425   4.399  -1.093
  201    HE2  PHE  30           HE2      PHE  30  -6.761   2.275  -4.722
  202    HZ   PHE  30           HZ       PHE  30  -6.505   4.315  -3.371
  203    H    GLU  31           H        GLU  31  -7.637  -3.229  -0.560
  204    HA   GLU  31           HA       GLU  31  -9.732  -4.090   1.316
  205    HB2  GLU  31           HB2      GLU  31  -8.883  -5.387  -1.264
  206    HB3  GLU  31           HB1      GLU  31  -9.871  -6.185  -0.059
  207    HG2  GLU  31           HG2      GLU  31 -10.687  -3.614  -1.338
  208    HG3  GLU  31           HG1      GLU  31 -11.024  -5.182  -2.080
  209    H    LEU  32           H        LEU  32  -9.217  -6.255   2.138
  210    HA   LEU  32           HA       LEU  32  -6.349  -6.512   2.672
  211    HB2  LEU  32           HB2      LEU  32  -8.749  -7.586   4.159
  212    HB3  LEU  32           HB1      LEU  32  -7.088  -7.945   4.584
  213    HG   LEU  32           HG       LEU  32  -8.302  -5.176   4.617
  214   HD11  LEU  32          HD11      LEU  32  -9.295  -6.618   6.316
  215   HD12  LEU  32          HD12      LEU  32  -8.246  -5.401   7.039
  216   HD13  LEU  32          HD13      LEU  32  -7.686  -7.066   6.877
  217   HD21  LEU  32          HD21      LEU  32  -5.892  -5.168   4.235
  218   HD22  LEU  32          HD22      LEU  32  -5.658  -6.228   5.623
  219   HD23  LEU  32          HD23      LEU  32  -6.271  -4.592   5.857
  220    H    GLN  33           H        GLN  33  -5.546  -8.752   2.886
  221    HA   GLN  33           HA       GLN  33  -4.894 -10.591   1.804
  222    HB2  GLN  33           HB2      GLN  33  -7.858 -11.154   1.873
  223    HB3  GLN  33           HB1      GLN  33  -6.629 -12.354   1.517
  224    HG2  GLN  33           HG2      GLN  33  -5.694 -12.062   3.744
  225    HG3  GLN  33           HG1      GLN  33  -6.907 -10.830   4.095
  226   HE21  GLN  33          1HE2      GLN  33  -9.034 -11.443   4.329
  227   HE22  GLN  33          2HE2      GLN  33  -9.491 -13.069   4.667
  228    HA   PRO  34           HA       PRO  34  -6.104  -9.424  -2.475
  229    HB2  PRO  34           HB2      PRO  34  -4.200  -7.515  -2.966
  230    HB3  PRO  34           HB1      PRO  34  -5.802  -7.176  -2.313
  231    HG2  PRO  34           HG2      PRO  34  -3.277  -6.867  -0.988
  232    HG3  PRO  34           HG1      PRO  34  -4.890  -6.567  -0.330
  233    HD2  PRO  34           HD2      PRO  34  -3.156  -8.970  -0.060
  234    HD3  PRO  34           HD1      PRO  34  -4.396  -8.336   1.048
  235    HA   PRO  35           HA       PRO  35  -2.547 -11.576  -4.262
  236    HB2  PRO  35           HB2      PRO  35  -3.447 -11.714  -6.805
  237    HB3  PRO  35           HB1      PRO  35  -4.108 -12.748  -5.534
  238    HG2  PRO  35           HG2      PRO  35  -5.245 -10.277  -6.750
  239    HG3  PRO  35           HG1      PRO  35  -6.071 -11.752  -6.225
  240    HD2  PRO  35           HD2      PRO  35  -5.959  -9.406  -4.771
  241    HD3  PRO  35           HD1      PRO  35  -6.266 -11.018  -4.095
  242    HA   PRO  36           HA       PRO  36   0.287  -8.476  -5.639
  243    HB2  PRO  36           HB2      PRO  36   0.826  -9.575  -8.237
  244    HB3  PRO  36           HB1      PRO  36   1.828  -9.646  -6.792
  245    HG2  PRO  36           HG2      PRO  36  -0.054 -11.646  -7.877
  246    HG3  PRO  36           HG1      PRO  36   1.337 -11.881  -6.809
  247    HD2  PRO  36           HD2      PRO  36  -1.176 -12.134  -5.923
  248    HD3  PRO  36           HD1      PRO  36   0.092 -11.428  -4.896
  249    H    TRP  37           H        TRP  37  -1.962  -9.393  -8.228
  250    HA   TRP  37           HA       TRP  37  -1.573  -6.975  -9.650
  251    HB2  TRP  37           HB2      TRP  37  -3.595  -7.713 -11.013
  252    HB3  TRP  37           HB1      TRP  37  -2.186  -8.760 -11.020
  253    HD1  TRP  37           HD       TRP  37  -5.830  -8.652  -9.896
  254    HE1  TRP  37           HE1      TRP  37  -6.549 -11.036  -9.229
  255    HE3  TRP  37          3HE       TRP  37  -1.274 -10.943 -10.091
  256    HZ2  TRP  37           HZ2      TRP  37  -5.317 -13.559  -8.841
  257    HZ3  TRP  37           HZ3      TRP  37  -1.125 -13.340  -9.560
  258    HH2  TRP  37           HH       TRP  37  -3.107 -14.615  -8.950
  259    H    GLU  38           H        GLU  38  -3.635  -7.693  -6.992
  260    HA   GLU  38           HA       GLU  38  -5.286  -5.415  -7.635
  261    HB2  GLU  38           HB2      GLU  38  -5.388  -7.323  -5.312
  262    HB3  GLU  38           HB1      GLU  38  -6.361  -5.863  -5.382
  263    HG2  GLU  38           HG2      GLU  38  -7.281  -6.718  -7.567
  264    HG3  GLU  38           HG1      GLU  38  -6.483  -8.247  -7.204
  265    H    CYS  39           H        CYS  39  -2.483  -6.092  -5.811
  266    HA   CYS  39           HA       CYS  39  -2.723  -3.678  -4.269
  267    HB2  CYS  39           HB2      CYS  39  -0.374  -5.524  -4.688
  268    HB3  CYS  39           HB1      CYS  39  -0.365  -4.107  -3.646
  269    H    TYR  40           H        TYR  40  -2.223  -1.764  -4.931
  270    HA   TYR  40           HA       TYR  40  -1.050  -1.344  -7.491
  271    HB2  TYR  40           HB2      TYR  40  -1.679   0.616  -5.274
  272    HB3  TYR  40           HB1      TYR  40  -1.245   1.035  -6.924
  273    HD1  TYR  40           HD1      TYR  40  -2.831   0.607  -8.760
  274    HD2  TYR  40           HD2      TYR  40  -3.888  -0.074  -4.707
  275    HE1  TYR  40           HE1      TYR  40  -5.181   0.577  -9.389
  276    HE2  TYR  40           HE2      TYR  40  -6.258  -0.111  -5.322
  277    HH   TYR  40           HH       TYR  40  -7.297  -0.243  -8.576
  278    H    GLN  41           H        GLN  41   0.892  -2.051  -7.505
  279    HA   GLN  41           HA       GLN  41   2.769  -1.871  -5.380
  280    HB2  GLN  41           HB2      GLN  41   3.229  -2.421  -8.313
  281    HB3  GLN  41           HB1      GLN  41   4.306  -2.832  -6.987
  282    HG2  GLN  41           HG2      GLN  41   2.725  -4.433  -6.132
  283    HG3  GLN  41           HG1      GLN  41   1.534  -3.951  -7.336
  284   HE21  GLN  41          1HE2      GLN  41   2.654  -6.583  -6.854
  285   HE22  GLN  41          2HE2      GLN  41   3.415  -7.043  -8.315
  286    H    CYS  42           H        CYS  42   3.436   0.116  -4.806
  287    HA   CYS  42           HA       CYS  42   3.464   2.329  -6.421
  288    HB2  CYS  42           HB2      CYS  42   5.102   1.740  -3.950
  289    HB3  CYS  42           HB1      CYS  42   4.886   3.341  -4.655