*HEADER    RIBOSOME                                14-JUL-99   1C05              
*TITLE     SOLUTION STRUCTURE OF RIBOSOMAL PROTEIN S4 DELTA 41,                  
*TITLE    2 REFINED WITH DIPOLAR COUPLINGS (MINIMIZED AVERAGE STRUCTURE)         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RIBOSOMAL PROTEIN S4 DELTA 41;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: S4 DELTA 41 (S4 RESIDUES 42-200);                          
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS STEAROTHERMOPHILUS;                    
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PET13A                                    
*KEYWDS    TWO SUBDOMAINS, UNIQUE TOPOLOGY, POSSIBLE HELIX-TURN-HELIX            
*KEYWDS   2 MOTIF                                                                
*EXPDTA    NMR, MINIMIZED AVERAGE STRUCTURE                                      
*AUTHOR    M.A.MARKUS, R.B.GERSTNER, D.E.DRAPER, D.A.TORCHIA                     
*REVDAT   1   24-SEP-99 1C05    0                                                

!! NOE restraints
!Intraresidue restraints:    700
!Sequential restraints:      604
!Short range restraints:     353
!Long range restraints:      513
!___________________________________
!Grand total:               2170

! M1  
assign (resid   1 and name   HA) (resid   1 and name  HG#)  3.0  1.2  1.3 ! A.11 at 7.81e+05
assign (resid   1 and name   HA) (resid   1 and name  HE#)  3.0  1.2  1.3 ! A.1395 at 5.81e+05
assign (resid   1 and name  HB#) (resid   1 and name  HE#)  2.5  0.7  2.2 

! K2  
assign (resid   2 and name   HA) (resid   2 and name  HG#)  2.5  0.7  1.2 ! A.16 at 1.94e+06
assign (resid   2 and name   HA) (resid   2 and name  HD#)  3.0  1.2  1.3 ! B.410 at 2.88e+05
assign (resid   2 and name  HB#) (resid   2 and name  HD#)  2.5  0.7  2.2 ! B.25 at 1.13e+06
assign (resid   2 and name  HG#) (resid   2 and name  HE#)  2.5  0.7  2.2 ! A.2743 at 2.43e+06
assign (resid   2 and name   HA) (resid   3 and name   HN)  2.5  0.7  0.4 ! C.1 at 1.12e+07
assign (resid   2 and name  HB#) (resid   3 and name   HN)  4.0  2.2  2.0 ! A.18 at 5.68e+05

! L3  
assign (resid   3 and name   HN) (resid   3 and name  HB2)  2.5  0.7  0.4 ! B.382 at 4.90e+06
assign (resid   3 and name   HN) (resid   3 and name   HG)  2.5  0.7  0.4 ! C.5 at 2.61e+06
assign (resid   3 and name   HN) (resid   3 and name HD1#)  4.0  2.2  2.0 ! A.17 at 7.84e+05
assign (resid   3 and name   HN) (resid   3 and name HD2#)  4.0  2.2  2.0 ! B.383 at 8.71e+05
assign (resid   3 and name   HA) (resid   3 and name   HG)  3.0  1.2  0.2 ! A.35 at 1.39e+06
assign (resid   3 and name   HA) (resid   3 and name HD1#)  3.0  1.2  1.2 ! A.5680 at 2.17e+06
assign (resid   3 and name   HA) (resid   3 and name HD2#)  2.5  0.7  1.2 ! A.30 at 5.59e+06
assign (resid   3 and name  HB1) (resid   3 and name HD1#)  2.5  0.7  1.2 ! B.1826 at -1.37e+06
assign (resid   3 and name  HB1) (resid   3 and name HD2#)  2.5  0.7  1.2 ! A.34 at 4.51e+06
assign (resid   3 and name  HB2) (resid   3 and name HD1#)  2.5  0.7  1.2 ! A.1403 at 1.09e+07
assign (resid   3 and name  HB2) (resid   3 and name HD2#)  2.5  0.7  1.2 ! A.33 at 4.75e+06
assign (resid   3 and name   HN) (resid   4 and name   HN)  4.0  2.2  1.0 ! D.2 at 4.70e+05
assign (resid   3 and name   HA) (resid   4 and name   HN)  2.5  0.7  0.4 ! A.25 at 6.96e+06
assign (resid   3 and name  HB#) (resid   4 and name   HN)  2.5  0.7  1.4 ! C.11 at 2.11e+06
assign (resid   3 and name  HB1) (resid   4 and name   HN)  4.0  2.2  1.0 ! A.28 at 1.39e+06
assign (resid   3 and name HD1#) (resid   4 and name   HN)  4.0  2.2  2.0 ! C.12 at 4.28e+05
assign (resid   3 and name HD2#) (resid   4 and name   HN)  4.0  2.2  2.0 ! A.29 at 1.12e+06

! S4  
assign (resid   4 and name   HN) (resid   4 and name  HB#)  4.0  2.2  2.0 ! A.24 at 1.02e+06
assign (resid   4 and name   HA) (resid   5 and name   HN)  2.5  0.7  0.4 ! A.31 at 4.04e+06
assign (resid   4 and name  HB#) (resid   5 and name   HN)  2.5  0.7  1.4 ! A.30 at 4.74e+06
assign (resid   4 and name  HB#) (resid   6 and name   HN)  3.0  1.2  1.5 ! A.50 at 2.16e+06
assign (resid   4 and name   HA) (resid   7 and name   HN)  4.0  2.2  1.0 
assign (resid   4 and name  HB#) (resid   7 and name   HN)  4.0  2.2  2.0 ! C.26 at 5.95e+05

! E5  
assign (resid   5 and name   HN) (resid   5 and name  HB#)  2.5  0.7  1.4 ! A.36 at 4.40e+06
assign (resid   5 and name   HN) (resid   5 and name  HG#)  4.0  2.2  2.0 ! A.35 at 1.58e+06
assign (resid   5 and name   HA) (resid   5 and name  HG#)  2.5  0.7  1.2 ! A.2794 at 2.95e+06
assign (resid   5 and name   HN) (resid   6 and name   HN)  4.0  2.2  1.0 ! A.43 at 1.55e+06
assign (resid   5 and name   HA) (resid   6 and name   HN)  3.0  1.2  0.5 ! B.2107 at 1.48e+06
assign (resid   5 and name  HB#) (resid   6 and name   HN)  4.0  2.2  2.0 ! A.55 at 1.41e+06
assign (resid   5 and name  HG#) (resid   6 and name   HN)  4.0  2.2  2.0 ! C.21 at 5.65e+05
assign (resid   5 and name   HA) (resid   8 and name   HN)  4.0  2.2  1.0 ! C.803 at 6.15e+05
assign (resid   5 and name   HA) (resid   8 and name  HB#)  3.0  1.2  1.2 ! A.2795 at 1.53e+06
assign (resid   5 and name   HA) (resid   8 and name   HG)  3.0  1.2  0.3 ! A.2798 at 7.01e+05
assign (resid   5 and name   HA) (resid   8 and name HD1#)  2.5  0.7  1.2 ! A.2796 at 2.70e+06
assign (resid   5 and name  HG#) (resid   8 and name HD1#)  4.0  2.2  2.2 ! A.2837 at 9.26e+05
assign (resid   5 and name  HG#) (resid 152 and name HD2#)  3.0  1.2  2.3 ! A.5636 at 6.34e+05

! Y6  
assign (resid   6 and name   HN) (resid   6 and name  HB#)  3.0  1.2  1.5 ! A.53 at 2.96e+06
assign (resid   6 and name   HN) (resid   6 and name  HD#)  4.0  2.2  3.4 ! A.47 at 5.15e+05
assign (resid   6 and name   HA) (resid   6 and name  HD#)  3.0  1.2  2.7 ! A.56 at 7.56e+05
assign (resid   6 and name   HA) (resid   6 and name  HE#)  3.0  1.2  2.7 ! A.1419 at 6.39e+05
assign (resid   6 and name  HB#) (resid   6 and name  HD#)  3.0  1.2  3.6 ! A.57 at 1.18e+06
assign (resid   6 and name  HB#) (resid   6 and name  HE#)  3.0  1.2  3.7 ! A.4067 at 4.87e+05
assign (resid   6 and name   HN) (resid   7 and name   HN)  4.0  2.2  1.0 ! D.10 at 5.83e+05
assign (resid   6 and name   HA) (resid   7 and name   HN)  5.0  3.2  1.0 ! A.64 at 3.88e+05
assign (resid   6 and name  HB#) (resid   7 and name   HN)  4.0  2.2  2.0 ! A.69 at 6.46e+05
assign (resid   6 and name  HD#) (resid   7 and name   HN)  5.0  3.2  3.4 ! A.59 at 3.35e+05
assign (resid   6 and name  HD#) (resid   7 and name  HA#)  4.0  2.2  4.4 ! A.4799 at 2.82e+05
assign (resid   6 and name   HA) (resid   9 and name  HB#)  3.0  1.2  1.3 ! A.2811 at 5.08e+05
assign (resid   6 and name   HA) (resid   9 and name  HG#)  3.0  1.2  1.3 ! A.4797 at 5.21e+05
assign (resid   6 and name  HD#) (resid 159 and name  HD#)  4.0  2.2  3.7 ! A.5674 at 6.61e+05
assign (resid   6 and name  HE#) (resid 159 and name  HD#)  3.0  1.2  3.7 ! A.5673 at 6.87e+05

! G7  
assign (resid   7 and name   HN) (resid   8 and name   HN)  4.0  2.2  1.0 ! A.71 at 1.05e+06
assign (resid   7 and name  HA#) (resid   8 and name   HN)  4.0  2.2  2.0 ! A.73 at 7.39e+05
assign (resid   7 and name  HA#) (resid  10 and name  HB#)  4.0  2.2  3.0 ! A.1249 at 3.13e+05
assign (resid   7 and name  HA#) (resid  10 and name HD2#)  4.0  2.2  3.0 ! A.2820 at 3.91e+05

! L8  
assign (resid   8 and name   HN) (resid   8 and name  HB#)  3.0  1.2  1.5 ! A.76 at 2.53e+06
assign (resid   8 and name   HN) (resid   8 and name   HG)  3.0  1.2  0.5 ! A.80 at 1.80e+06
assign (resid   8 and name   HN) (resid   8 and name HD1#)  4.0  2.2  2.0 ! B.415 at 9.48e+05
assign (resid   8 and name   HN) (resid   8 and name HD2#)  4.0  2.2  2.0 ! A.79 at 1.06e+06
assign (resid   8 and name   HA) (resid   8 and name HD2#)  2.5  0.7  1.2 ! A.1432 at 4.29e+06
assign (resid   8 and name  HB#) (resid   8 and name HD1#)  2.5  0.7  2.2 ! A.2830 at 5.03e+06
assign (resid   8 and name  HB#) (resid   8 and name HD2#)  2.5  0.7  2.2 ! A.3272 at 3.49e+06
assign (resid   8 and name   HN) (resid   9 and name   HN)  3.0  1.2  0.5 ! D.611 at 9.08e+05
assign (resid   8 and name   HA) (resid   9 and name   HN)  3.0  1.2  0.5 ! C.1162 at 1.00e+06
assign (resid   8 and name  HB#) (resid   9 and name   HN)  4.0  2.2  2.0 ! A.92 at 1.44e+06
assign (resid   8 and name   HA) (resid  11 and name   HN)  4.0  2.2  1.0 ! A.115 at 8.71e+05
assign (resid   8 and name   HA) (resid  11 and name  HB#)  2.5  0.7  1.2 ! A.4833 at 3.51e+06
assign (resid   8 and name HD1#) (resid  11 and name HE2#)  3.0  1.2  2.3 ! C.1155 at 7.80e+05
assign (resid   8 and name HD2#) (resid  11 and name  HB#)  2.5  0.7  2.2 ! A.2873 at 1.63e+06
assign (resid   8 and name HD2#) (resid  11 and name HE2#)  4.0  2.2  3.0 ! A.131 at 9.72e+05

! Q9  
assign (resid   9 and name   HN) (resid   9 and name  HB#)  3.0  1.2  1.5 ! C.981 at 1.29e+06
assign (resid   9 and name   HN) (resid   9 and name  HG#)  3.0  1.2  1.5 ! A.86 at 2.34e+06
assign (resid   9 and name   HA) (resid   9 and name  HG#)  2.5  0.7  1.2 ! A.2842 at 1.13e+06
assign (resid   9 and name  HB#) (resid   9 and name HE2#)  5.0  3.2  3.0 ! A.96 at 3.56e+05
assign (resid   9 and name  HG#) (resid   9 and name HE2#)  5.0  3.2  3.0 ! A.97 at 6.45e+05
assign (resid   9 and name   HN) (resid  10 and name   HN)  4.0  2.2  1.0 ! D.18 at 4.95e+05
assign (resid   9 and name   HA) (resid  10 and name   HN)  4.0  2.2  1.0 ! A.104 at 6.97e+05
assign (resid   9 and name   HA) (resid  12 and name   HN)  5.0  3.2  1.0 ! A.139 at 4.25e+05
assign (resid   9 and name   HA) (resid 152 and name  HB1)  3.0  1.2  0.3 ! A.4740 at 4.63e+05
assign (resid   9 and name   HA) (resid 152 and name  HB2)  4.0  2.2  1.0 ! A.4741 at 4.19e+05
assign (resid   9 and name   HA) (resid 152 and name HD1#)  3.0  1.2  1.2 ! A.5633 at 1.24e+06
assign (resid   9 and name   HA) (resid 152 and name HD2#)  3.0  1.2  1.2 ! A.4708 at 1.29e+06
assign (resid   9 and name  HG#) (resid 152 and name   HA)  3.0  1.2  1.3 ! A.5631 at 8.41e+05
assign (resid   9 and name  HG#) (resid 152 and name HD2#)  2.5  0.7  2.2 ! A.2671 at 3.91e+06

! L10 
assign (resid  10 and name   HN) (resid  10 and name  HB#)  3.0  1.2  1.5 ! A.108 at 2.71e+06
assign (resid  10 and name   HN) (resid  10 and name HD2#)  4.0  2.2  2.0 ! C.41 at 5.32e+05
assign (resid  10 and name   HA) (resid  10 and name   HG)  3.0  1.2  0.3 
assign (resid  10 and name   HA) (resid  10 and name HD1#)  2.5  0.7  1.2 ! A.69 at 1.38e+06
assign (resid  10 and name   HA) (resid  10 and name HD2#)  3.0  1.2  1.3 ! A.70 at 4.75e+05
assign (resid  10 and name  HB#) (resid  10 and name HD1#)  3.0  1.2  2.2 ! A.86 at 1.06e+06
assign (resid  10 and name  HB#) (resid  10 and name HD2#)  2.5  0.7  2.2 ! A.83 at 1.67e+06
assign (resid  10 and name   HN) (resid  11 and name   HN)  4.0  2.2  1.0 ! A.102 at 1.32e+06
assign (resid  10 and name   HA) (resid  11 and name   HN)  4.0  2.2  1.0 ! A.121 at 5.82e+05
assign (resid  10 and name  HB#) (resid  11 and name   HN)  4.0  2.2  2.0 ! A.119 at 9.48e+05
assign (resid  10 and name   HG) (resid  11 and name   HN)  4.0  2.2  1.0 ! C.805 at 3.87e+05
assign (resid  10 and name HD2#) (resid  11 and name   HN)  5.0  3.2  2.0 ! B.429 at 4.38e+05
assign (resid  10 and name   HA) (resid  12 and name   HN)  4.0  2.2  1.0 ! C.982 at 5.27e+05
assign (resid  10 and name   HA) (resid  13 and name   HN)  5.0  3.2  1.0 ! A.1614 at 3.86e+05
assign (resid  10 and name   HA) (resid  13 and name  HE#)  4.0  2.2  2.0 
assign (resid  10 and name HD1#) (resid  13 and name  HE#)  2.5  0.7  2.2 ! A.4852 at 1.01e+06
assign (resid  10 and name   HA) (resid  14 and name   HN)  5.0  3.2  1.0 ! B.1740 at 3.12e+05
assign (resid  10 and name   HA) (resid 156 and name  HD#)  4.0  2.2  3.4 ! A.4817 at 4.26e+05
assign (resid  10 and name   HA) (resid 156 and name  HE#)  4.0  2.2  3.4 ! A.4818 at 4.01e+05
assign (resid  10 and name HD1#) (resid 156 and name  HD#)  3.0  1.2  3.7 ! A.4828 at 5.45e+05
assign (resid  10 and name HD1#) (resid 156 and name  HE#)  2.5  0.7  3.6 ! A.4776 at 3.89e+06
assign (resid  10 and name HD1#) (resid 156 and name   HZ)  4.0  2.2  2.0 ! A.4364 at 3.30e+05
assign (resid  10 and name HD2#) (resid 156 and name  HD#)  4.0  2.2  4.4 ! A.4830 at 3.07e+05
assign (resid  10 and name HD2#) (resid 156 and name  HE#)  2.5  0.7  3.6 ! A.4768 at 1.42e+06
assign (resid  10 and name HD2#) (resid 156 and name   HZ)  3.0  1.2  1.3 ! A.4767 at 6.45e+05

! Q11 
assign (resid  11 and name   HN) (resid  11 and name  HB#)  2.5  0.7  1.4 ! A.117 at 4.21e+06
assign (resid  11 and name   HN) (resid  11 and name  HG#)  4.0  2.2  2.0 ! A.122 at 7.00e+05
assign (resid  11 and name   HA) (resid  11 and name  HG#)  2.5  0.7  1.2 ! A.3012 at 2.02e+06
assign (resid  11 and name  HB#) (resid  11 and name HE2#)  5.0  3.2  3.0 ! A.133 at 4.40e+05
assign (resid  11 and name  HG#) (resid  11 and name HE2#)  4.0  2.2  3.0 ! A.129 at 9.34e+05
assign (resid  11 and name   HN) (resid  12 and name   HN)  4.0  2.2  1.0 ! A.135 at 1.49e+06
assign (resid  11 and name  HB#) (resid  12 and name   HN)  3.0  1.2  1.5 ! C.1163 at 1.40e+06
assign (resid  11 and name  HG#) (resid  12 and name   HN)  4.0  2.2  2.0 ! C.50 at 7.05e+05
assign (resid  11 and name   HA) (resid  14 and name   HN)  4.0  2.2  1.0 ! C.985 at 6.30e+05

! E12 
assign (resid  12 and name   HN) (resid  12 and name  HB#)  2.5  0.7  1.4 ! A.142 at 3.84e+06
assign (resid  12 and name   HN) (resid  12 and name  HG#)  4.0  2.2  2.0 ! A.141 at 5.99e+05
assign (resid  12 and name   HN) (resid  13 and name   HN)  4.0  2.2  1.0 ! D.29 at 5.90e+05
assign (resid  12 and name   HA) (resid  13 and name   HN)  4.0  2.2  1.0 ! C.1165 at 5.41e+05
assign (resid  12 and name   HA) (resid  15 and name  HG#)  3.0  1.2  1.3 ! B.1797 at 4.04e+05
assign (resid  12 and name   HA) (resid  15 and name  HD#)  2.5  0.7  1.2 ! A.3720 at 1.39e+06
assign (resid  12 and name   HA) (resid  15 and name  HE#)  3.0  1.2  1.2 ! A.2878 at 1.42e+06
assign (resid  12 and name   HN) (resid 152 and name HD2#)  5.0  3.2  2.0 ! A.144 at 3.88e+05
assign (resid  12 and name  HG#) (resid 152 and name HD1#)  2.5  0.7  2.2 

! K13 
assign (resid  13 and name   HN) (resid  13 and name  HB#)  3.0  1.2  1.5 ! A.150 at 1.98e+06
assign (resid  13 and name  HB#) (resid  13 and name  HD#)  3.0  1.2  2.3 ! A.2895 at 5.17e+05
assign (resid  13 and name  HB#) (resid  13 and name  HE#)  3.0  1.2  2.3 ! A.2909 at 7.16e+05
assign (resid  13 and name   HN) (resid  14 and name   HN)  4.0  2.2  1.0 ! A.146 at 1.39e+06
assign (resid  13 and name   HA) (resid  14 and name   HN)  5.0  3.2  1.0 ! A.1615 at 3.75e+05
assign (resid  13 and name  HB#) (resid  14 and name   HN)  4.0  2.2  2.0 ! A.167 at 8.62e+05
assign (resid  13 and name  HD#) (resid  14 and name   HN)  5.0  3.2  2.0 ! A.168 at 3.32e+05
assign (resid  13 and name  HD#) (resid  27 and name  HE#)  4.0  2.2  4.0 
assign (resid  13 and name   HA) (resid 153 and name HG1#)  3.0  1.2  1.3 ! A.4873 at 6.24e+05
assign (resid  13 and name   HA) (resid 153 and name HG2#)  3.0  1.2  1.2 ! A.4335 at 9.95e+05
assign (resid  13 and name   HA) (resid 153 and name HD1#)  3.0  1.2  1.2 ! A.1317 at 1.97e+06
assign (resid  13 and name  HD#) (resid 156 and name  HE#)  4.0  2.2  4.0 
assign (resid  13 and name  HE#) (resid 156 and name  HE#)  3.0  1.2  3.7 ! A.2904 at 6.50e+05

! Q14 
assign (resid  14 and name   HN) (resid  14 and name  HB1)  4.0  2.2  1.0 ! A.165 at 1.39e+06
assign (resid  14 and name   HN) (resid  14 and name  HB2)  3.0  1.2  0.5 ! A.164 at 2.23e+06
assign (resid  14 and name   HN) (resid  14 and name  HG#)  4.0  2.2  2.0 ! A.163 at 1.07e+06
assign (resid  14 and name   HA) (resid  14 and name  HG#)  2.5  0.7  1.2 ! A.4853 at 9.49e+05
assign (resid  14 and name  HG#) (resid  14 and name HE2#)  3.0  1.2  2.3 ! C.998 at 8.22e+05
assign (resid  14 and name   HN) (resid  15 and name   HN)  3.0  1.2  0.5 ! A.83 at 1.64e+06
assign (resid  14 and name   HA) (resid  15 and name   HN)  3.0  1.2  0.5 ! A.85 at 2.38e+06
assign (resid  14 and name  HG#) (resid  15 and name   HN)  4.0  2.2  2.0 ! A.87 at 1.48e+06
assign (resid  14 and name   HA) (resid  17 and name   HN)  4.0  2.2  1.0 ! A.195 at 6.13e+05
assign (resid  14 and name   HA) (resid  17 and name  HB#)  3.0  1.2  1.3 ! A.1258 at 8.05e+05

! K15 
assign (resid  15 and name   HN) (resid  15 and name  HB#)  2.5  0.7  1.4 ! B.449 at 8.19e+06
assign (resid  15 and name   HN) (resid  15 and name  HG#)  2.5  0.7  1.4 ! C.61 at 2.48e+06
assign (resid  15 and name   HA) (resid  15 and name  HG#)  3.0  1.2  1.2 ! A.3703 at 9.86e+05
assign (resid  15 and name  HB#) (resid  15 and name  HD#)  3.0  1.2  2.3 ! B.259 at 4.03e+05
assign (resid  15 and name  HB#) (resid  15 and name  HE#)  3.0  1.2  2.2 ! A.2945 at 2.37e+06
assign (resid  15 and name  HG#) (resid  15 and name  HE#)  2.5  0.7  2.2 ! A.2943 at 2.06e+06
assign (resid  15 and name   HN) (resid  16 and name   HN)  4.0  2.2  1.0 ! A.84 at 1.26e+06
assign (resid  15 and name   HA) (resid  16 and name   HN)  4.0  2.2  1.0 ! C.988 at 6.49e+05
assign (resid  15 and name  HB#) (resid  16 and name   HN)  3.0  1.2  1.5 ! A.186 at 1.67e+06
assign (resid  15 and name   HA) (resid  18 and name  HB#)  3.0  1.2  1.3 ! A.1261 at 6.27e+05
assign (resid  15 and name  HE#) (resid  19 and name  HE#)  3.0  1.2  2.3 ! A.4891 at 5.81e+05
assign (resid  15 and name  HB#) (resid 148 and name HD1#)  3.0  1.2  2.2 ! A.2931 at 3.67e+06
assign (resid  15 and name  HD#) (resid 148 and name HD1#)  3.0  1.2  2.3 ! B.2040 at -3.44e+05
assign (resid  15 and name  HE#) (resid 148 and name   HA)  3.0  1.2  1.3 
assign (resid  15 and name  HE#) (resid 148 and name HD1#)  2.5  0.7  2.2 ! A.1316 at 1.85e+06

! L16 
assign (resid  16 and name   HN) (resid  16 and name  HB#)  3.0  1.2  1.5 ! A.187 at 2.46e+06
assign (resid  16 and name   HN) (resid  16 and name   HG)  4.0  2.2  1.0 ! A.185 at 1.10e+06
assign (resid  16 and name   HN) (resid  16 and name HD1#)  4.0  2.2  2.0 ! A.188 at 5.43e+05
assign (resid  16 and name   HN) (resid  16 and name HD2#)  4.0  2.2  2.0 ! A.189 at 8.63e+05
assign (resid  16 and name   HA) (resid  16 and name   HG)  3.0  1.2  0.3 ! A.102 at 6.92e+05
assign (resid  16 and name   HA) (resid  16 and name HD1#)  3.0  1.2  1.2 ! A.1493 at 1.56e+06
assign (resid  16 and name   HA) (resid  16 and name HD2#)  4.0  2.2  2.0 ! A.105 at 8.32e+05
assign (resid  16 and name  HB#) (resid  16 and name HD1#)  3.0  1.2  2.3 ! B.241 at -3.47e+05
assign (resid  16 and name  HB#) (resid  16 and name HD2#)  2.5  0.7  2.2 ! A.112 at 1.12e+06
assign (resid  16 and name   HN) (resid  17 and name   HN)  3.0  1.2  0.5 ! A.179 at 1.78e+06
assign (resid  16 and name   HA) (resid  17 and name   HN)  5.0  3.2  1.0 ! A.194 at 4.34e+05
assign (resid  16 and name  HB#) (resid  17 and name   HN)  4.0  2.2  2.0 ! A.197 at 1.08e+06
assign (resid  16 and name HD2#) (resid  17 and name   HN)  5.0  3.2  2.0 ! B.1414 at 4.95e+05
assign (resid  16 and name   HA) (resid  19 and name   HN)  4.0  2.2  1.0 ! A.223 at 1.41e+06
assign (resid  16 and name   HA) (resid  19 and name  HB#)  3.0  1.2  1.3 ! A.1263 at 5.09e+05
assign (resid  16 and name   HA) (resid  19 and name  HG#)  4.0  2.2  2.0 ! A.2955 at 4.24e+05
assign (resid  16 and name   HA) (resid  19 and name  HE#)  3.0  1.2  1.2 ! A.2979 at 1.35e+06
assign (resid  16 and name HD1#) (resid  19 and name  HE#)  2.5  0.7  2.2 ! A.4889 at 2.92e+06
assign (resid  16 and name HD1#) (resid  20 and name  HD#)  3.0  1.2  3.7 ! A.2988 at 5.17e+05
assign (resid  16 and name HD1#) (resid  20 and name  HE#)  2.5  0.7  3.6 ! A.1526 at 1.32e+06
assign (resid  16 and name HD2#) (resid  20 and name  HE#)  4.0  2.2  4.4 ! A.2970 at 3.77e+05
assign (resid  16 and name  HB#) (resid  27 and name   HZ)  4.0  2.2  2.0 ! A.4875 at 3.99e+05
assign (resid  16 and name HD1#) (resid  27 and name  HE#)  4.0  2.2  4.4 ! A.1602 at 4.02e+05
assign (resid  16 and name HD1#) (resid  27 and name   HZ)  4.0  2.2  2.0 ! A.1604 at 2.97e+05
assign (resid  16 and name HD2#) (resid  27 and name   HZ)  4.0  2.2  2.0 ! A.1606 at 4.20e+05
assign (resid  16 and name HD1#) (resid  45 and name  HD#)  4.0  2.2  4.4 ! A.4756 at 4.11e+05
assign (resid  16 and name HD2#) (resid  45 and name  HD#)  3.0  1.2  3.7 ! A.2968 at 8.12e+05
assign (resid  16 and name HD1#) (resid  46 and name  HE#)  2.5  0.7  2.2 ! A.4471 at 3.15e+06
assign (resid  16 and name HD2#) (resid  46 and name  HE#)  3.0  1.2  2.3 ! B.6349 at 2.92e+05
assign (resid  16 and name   HG) (resid  49 and name HD1#)  3.0  1.2  1.3 ! A.3240 at 5.17e+05
assign (resid  16 and name HD1#) (resid  49 and name HD1#)  3.0  1.2  2.2 ! A.1461 at 2.03e+06
assign (resid  16 and name HD2#) (resid  49 and name HD1#)  2.5  0.7  2.2 ! A.115 at 2.16e+06
assign (resid  16 and name   HN) (resid 148 and name HD1#)  4.0  2.2  2.0 ! A.190 at 5.77e+05
assign (resid  16 and name   HA) (resid 148 and name HD1#)  3.0  1.2  1.3 ! A.4782 at 6.51e+05
assign (resid  16 and name HD1#) (resid 148 and name HG2#)  2.5  0.7  2.2 ! B.239 at 6.92e+05
assign (resid  16 and name HD1#) (resid 148 and name HD1#)  2.5  0.7  2.2 ! A.2763 at 5.51e+06

! R17 
assign (resid  17 and name   HN) (resid  17 and name  HB#)  3.0  1.2  1.5 ! A.198 at 2.64e+06
assign (resid  17 and name   HA) (resid  17 and name  HG#)  3.0  1.2  1.3 ! A.126 at 8.92e+05
assign (resid  17 and name   HA) (resid  17 and name  HD#)  4.0  2.2  2.0 ! A.130 at 2.71e+05
assign (resid  17 and name  HB#) (resid  17 and name  HD#)  3.0  1.2  2.3 ! A.151 at 7.13e+05
assign (resid  17 and name   HN) (resid  18 and name   HN)  4.0  2.2  1.0 ! A.204 at 1.16e+06
assign (resid  17 and name   HA) (resid  18 and name   HN)  5.0  3.2  1.0 ! B.460 at 3.04e+05
assign (resid  17 and name  HB#) (resid  18 and name   HN)  4.0  2.2  2.0 ! A.1088 at 5.36e+05
assign (resid  17 and name  HG#) (resid  18 and name  HE1)  4.0  2.2  2.0 ! A.4887 at 3.91e+05
assign (resid  17 and name   HA) (resid  21 and name   HN)  5.0  3.2  1.0 ! B.1757 at 2.10e+05
assign (resid  17 and name   HA) (resid  22 and name   HN)  5.0  3.2  1.0 ! A.264 at 3.87e+05
assign (resid  17 and name   HA) (resid  22 and name   HB)  4.0  2.2  0.3 ! A.1484 at 6.35e+05
assign (resid  17 and name   HA) (resid  22 and name HG2#)  3.0  1.2  1.3 ! A.1485 at 8.49e+05
assign (resid  17 and name  HB#) (resid  22 and name   HN)  4.0  2.2  2.0 ! C.1007 at 4.88e+05
assign (resid  17 and name  HG#) (resid  22 and name   HN)  3.0  1.2  1.5 ! C.1006 at 7.59e+05
assign (resid  17 and name  HG#) (resid  22 and name   HB)  3.0  1.2  1.3 ! A.1477 at 6.10e+05
assign (resid  17 and name  HD#) (resid  24 and name   HA)  3.0  1.2  1.2 ! A.3008 at 9.69e+05
assign (resid  17 and name   HA) (resid  27 and name  HD#)  4.0  2.2  3.4 ! A.132 at 4.36e+05
assign (resid  17 and name   HA) (resid  27 and name  HE#)  3.0  1.2  2.7 ! A.131 at 8.40e+05
assign (resid  17 and name  HG#) (resid  27 and name  HD#)  4.0  2.2  4.4 ! A.4884 at 3.88e+05
assign (resid  17 and name  HD#) (resid  27 and name  HD#)  4.0  2.2  4.4 ! A.1491 at 3.69e+05

! H18 
assign (resid  18 and name   HN) (resid  18 and name  HB#)  3.0  1.2  1.5 ! A.211 at 3.01e+06
assign (resid  18 and name   HA) (resid  18 and name  HD2)  3.0  1.2  0.3 ! A.165 at 8.81e+05
assign (resid  18 and name  HB#) (resid  18 and name  HD2)  3.0  1.2  1.3 ! A.164 at 6.09e+05
assign (resid  18 and name   HN) (resid  19 and name   HN)  3.0  1.2  0.5 ! A.220 at 1.95e+06
assign (resid  18 and name   HA) (resid  19 and name   HN)  3.0  1.2  0.5 ! C.72 at 9.78e+05
assign (resid  18 and name  HB#) (resid  19 and name   HN)  4.0  2.2  2.0 ! A.225 at 1.42e+06
assign (resid  18 and name   HA) (resid  21 and name   HN)  4.0  2.2  1.0 ! A.243 at 7.93e+05

! M19 
assign (resid  19 and name   HN) (resid  19 and name  HB#)  2.5  0.7  1.4 ! C.73 at 1.83e+06
assign (resid  19 and name   HN) (resid  19 and name  HG#)  3.0  1.2  1.5 ! A.226 at 3.26e+06
assign (resid  19 and name   HN) (resid  19 and name  HE#)  4.0  2.2  2.0 ! C.969 at 5.38e+05
assign (resid  19 and name   HA) (resid  19 and name  HG#)  2.5  0.7  1.2 ! A.1504 at 1.45e+06
assign (resid  19 and name   HA) (resid  19 and name  HE#)  2.5  0.7  1.2 ! A.1510 at 1.76e+06
assign (resid  19 and name  HG#) (resid  19 and name  HE#)  3.0  1.2  2.2 ! A.170 at 8.85e+06
assign (resid  19 and name   HN) (resid  20 and name   HN)  3.0  1.2  0.5 ! A.222 at 1.59e+06
assign (resid  19 and name   HA) (resid  20 and name   HN)  4.0  2.2  1.0 ! A.232 at 5.31e+05
assign (resid  19 and name  HB#) (resid  20 and name   HN)  4.0  2.2  2.0 ! A.236 at 9.77e+05
assign (resid  19 and name  HB#) (resid  20 and name  HD#)  4.0  2.2  4.4 ! A.3680 at 4.24e+05
assign (resid  19 and name  HG#) (resid  20 and name   HN)  5.0  3.2  2.0 ! A.235 at 3.65e+05
assign (resid  19 and name  HG#) (resid  20 and name  HD#)  4.0  2.2  4.4 ! A.1503 at 3.35e+05
assign (resid  19 and name  HE#) (resid  20 and name  HD#)  3.0  1.2  3.7 ! A.1509 at 5.40e+05
assign (resid  19 and name  HE#) (resid  20 and name  HE#)  3.0  1.2  3.7 ! A.1508 at 5.27e+05
assign (resid  19 and name  HE#) (resid 145 and name  HB#)  2.5  0.7  2.2 ! A.4890 at 2.10e+06
assign (resid  19 and name  HE#) (resid 148 and name HD1#)  2.5  0.7  2.2 ! A.2985 at 5.75e+06

! Y20 
assign (resid  20 and name   HN) (resid  20 and name  HB#)  4.0  2.2  2.0 ! A.234 at 1.34e+06
assign (resid  20 and name   HN) (resid  20 and name  HD#)  4.0  2.2  3.4 ! C.817 at -5.72e+05
assign (resid  20 and name   HN) (resid  20 and name  HE#)  4.0  2.2  3.4 ! C.1001 at -4.98e+05
assign (resid  20 and name   HA) (resid  20 and name  HD#)  2.5  0.7  2.6 ! A.174 at 9.68e+05
assign (resid  20 and name  HB#) (resid  20 and name  HD#)  3.0  1.2  3.7 ! A.183 at 6.11e+05
assign (resid  20 and name   HN) (resid  21 and name   HN)  2.5  0.7  0.4 ! A.239 at 3.53e+06
assign (resid  20 and name   HA) (resid  21 and name   HN)  5.0  3.2  1.0 ! A.242 at 4.71e+05
assign (resid  20 and name  HB#) (resid  21 and name   HN)  5.0  3.2  2.0 ! A.245 at 4.34e+05
assign (resid  20 and name  HB#) (resid  22 and name HG2#)  3.0  1.2  2.3 ! A.1520 at 6.91e+05
assign (resid  20 and name  HD#) (resid  22 and name HG2#)  2.5  0.7  3.2 
assign (resid  20 and name  HD#) (resid  46 and name  HE#)  4.0  2.2  4.4 ! A.3184 at 3.14e+05
assign (resid  20 and name  HE#) (resid  46 and name  HE#)  3.0  1.2  3.7 ! A.1778 at 8.32e+05
assign (resid  20 and name  HB#) (resid  49 and name HD1#)  4.0  2.2  3.0 ! A.5008 at 3.07e+05
assign (resid  20 and name  HD#) (resid  49 and name HD1#)  4.0  2.2  4.4 ! A.1829 at 2.91e+05
assign (resid  20 and name  HE#) (resid  49 and name HD1#)  4.0  2.2  4.4 ! A.420 at 4.37e+05
assign (resid  20 and name  HE#) (resid  50 and name   HA)  3.0  1.2  2.6 ! A.2989 at 1.03e+06
assign (resid  20 and name  HD#) (resid  55 and name   HN)  5.0  3.2  3.4 ! B.2110 at 3.39e+05
assign (resid  20 and name  HD#) (resid  59 and name   HE)  5.0  3.2  3.4 ! B.2111 at -3.64e+05
assign (resid  20 and name  HE#) (resid  59 and name   HE)  5.0  3.2  2.0 

! G21 
assign (resid  21 and name   HN) (resid  22 and name   HN)  3.0  1.2  0.5 ! A.260 at 2.86e+06
assign (resid  21 and name   HN) (resid  22 and name HG2#)  5.0  3.2  2.0 ! B.479 at 3.17e+05
assign (resid  21 and name  HA#) (resid  22 and name   HN)  4.0  2.2  2.0 ! A.262 at 1.38e+06

! V22 
assign (resid  22 and name   HN) (resid  22 and name   HB)  3.0  1.2  0.5 ! A.265 at 1.88e+06
assign (resid  22 and name   HN) (resid  22 and name HG1#)  4.0  2.2  2.0 ! A.267 at 5.57e+05
assign (resid  22 and name   HN) (resid  22 and name HG2#)  3.0  1.2  1.5 ! A.266 at 2.25e+06
assign (resid  22 and name   HA) (resid  22 and name HG1#)  2.5  0.7  1.2 ! A.193 at 2.27e+06
assign (resid  22 and name   HA) (resid  22 and name HG2#)  2.5  0.7  1.2 ! A.194 at 2.00e+06
assign (resid  22 and name   HA) (resid  23 and name   HN)  2.5  0.7  0.4 ! A.272 at 5.75e+06
assign (resid  22 and name   HB) (resid  23 and name   HN)  4.0  2.2  1.0 ! A.275 at 6.83e+05
assign (resid  22 and name   HB) (resid  23 and name   HA)  4.0  2.2  1.0 ! A.1553 at 2.79e+05
assign (resid  22 and name HG1#) (resid  23 and name   HN)  4.0  2.2  2.0 ! A.276 at 1.32e+06
assign (resid  22 and name HG2#) (resid  23 and name   HN)  5.0  3.2  2.0 ! B.1763 at 3.45e+05
assign (resid  22 and name HG1#) (resid  26 and name   HN)  4.0  2.2  2.0 ! A.314 at 5.74e+05
assign (resid  22 and name HG1#) (resid  26 and name  HB#)  3.0  1.2  2.2 ! A.1537 at 1.39e+06
assign (resid  22 and name HG1#) (resid  26 and name  HG#)  2.5  0.7  2.2 ! A.1592 at 1.28e+06
assign (resid  22 and name   HB) (resid  27 and name  HB#)  3.0  1.2  1.3 ! A.4895 at 4.87e+05
assign (resid  22 and name   HB) (resid  27 and name  HD#)  2.5  0.7  2.6 ! A.196 at 1.36e+06
assign (resid  22 and name   HB) (resid  27 and name  HE#)  4.0  2.2  3.4 ! A.200 at 4.41e+05
assign (resid  22 and name HG1#) (resid  27 and name   HN)  4.0  2.2  2.0 ! A.336 at 1.20e+06
assign (resid  22 and name HG1#) (resid  27 and name   HA)  2.5  0.7  1.2 ! A.4898 at 4.18e+06
assign (resid  22 and name HG1#) (resid  27 and name  HB#)  4.0  2.2  3.0 ! A.3279 at 2.93e+05
assign (resid  22 and name HG1#) (resid  27 and name  HD#)  2.5  0.7  3.6 ! A.206 at 3.20e+06
assign (resid  22 and name HG2#) (resid  27 and name  HD#)  3.0  1.2  3.6 ! A.208 at 2.41e+06
assign (resid  22 and name HG2#) (resid  27 and name  HE#)  3.0  1.2  3.3 
assign (resid  22 and name   HB) (resid  49 and name HD2#)  2.5  0.7  1.2 ! A.5210 at 1.43e+06
assign (resid  22 and name HG1#) (resid  49 and name HD2#)  2.5  0.7  2.2 ! A.5222 at 3.84e+06
assign (resid  22 and name HG2#) (resid  49 and name HD1#)  3.0  1.2  2.2 ! A.2696 at 6.03e+06
assign (resid  22 and name HG2#) (resid  49 and name HD2#)  2.5  0.7  2.2 ! A.3246 at 5.34e+06

! N23 
assign (resid  23 and name   HN) (resid  23 and name  HB#)  4.0  2.2  2.0 ! A.274 at 1.42e+06
assign (resid  23 and name   HN) (resid  23 and name HD2#)  4.0  2.2  2.0 ! D.56 at 5.36e+05
assign (resid  23 and name  HB#) (resid  23 and name HD2#)  5.0  3.2  3.0 ! A.284 at 7.28e+05
assign (resid  23 and name   HA) (resid  24 and name   HN)  2.5  0.7  0.4 ! A.290 at 5.95e+06
assign (resid  23 and name  HB#) (resid  24 and name   HN)  4.0  2.2  2.0 ! A.293 at 7.52e+05
assign (resid  23 and name  HB#) (resid  25 and name   HN)  4.0  2.2  2.0 ! A.305 at 6.92e+05
assign (resid  23 and name   HN) (resid  26 and name  HB#)  4.0  2.2  2.0 ! B.1762 at 5.82e+05
assign (resid  23 and name HD2#) (resid  26 and name  HB#)  5.0  3.2  3.0 

! E24 
assign (resid  24 and name   HN) (resid  24 and name  HB#)  3.0  1.2  1.5 ! A.296 at 2.31e+06
assign (resid  24 and name   HN) (resid  24 and name  HG#)  5.0  3.2  2.0 ! A.294 at 4.48e+05
assign (resid  24 and name   HA) (resid  24 and name  HG#)  3.0  1.2  1.2 ! A.218 at 1.16e+06
assign (resid  24 and name   HN) (resid  25 and name   HN)  4.0  2.2  1.0 ! A.288 at 1.14e+06
assign (resid  24 and name   HA) (resid  25 and name   HN)  4.0  2.2  1.0 ! A.303 at 5.73e+05
assign (resid  24 and name  HB#) (resid  25 and name   HN)  4.0  2.2  2.0 ! A.304 at 8.77e+05
assign (resid  24 and name  HG#) (resid  25 and name   HN)  4.0  2.2  2.0 
assign (resid  24 and name   HA) (resid  27 and name   HN)  4.0  2.2  1.0 ! A.331 at 6.14e+05
assign (resid  24 and name   HA) (resid  27 and name  HB#)  4.0  2.2  2.0 ! A.1561 at 3.16e+05
assign (resid  24 and name   HA) (resid  27 and name  HD#)  4.0  2.2  3.4 ! A.1554 at 4.05e+05

! R25 
assign (resid  25 and name   HN) (resid  25 and name  HB#)  2.5  0.7  1.4 ! A.201 at 4.89e+06
assign (resid  25 and name   HN) (resid  25 and name  HG#)  4.0  2.2  2.0 ! A.306 at 5.30e+05
assign (resid  25 and name   HN) (resid  25 and name  HD#)  4.0  2.2  2.0 ! B.502 at 5.80e+05
assign (resid  25 and name   HA) (resid  25 and name  HG#)  2.5  0.7  1.2 ! B.8272 at 5.53e+05
assign (resid  25 and name   HA) (resid  25 and name  HD#)  3.0  1.2  1.2 ! A.3028 at 1.93e+06
assign (resid  25 and name  HB#) (resid  25 and name  HD#)  2.5  0.7  2.2 ! A.3022 at 1.38e+06
assign (resid  25 and name   HN) (resid  26 and name   HN)  2.5  0.7  0.4 ! D.60 at 3.51e+06
assign (resid  25 and name   HA) (resid  26 and name   HN)  4.0  2.2  1.0 ! C.118 at 6.96e+05
assign (resid  25 and name  HB#) (resid  26 and name   HN)  3.0  1.2  1.5 ! A.313 at 3.28e+06
assign (resid  25 and name  HG#) (resid  26 and name   HN)  4.0  2.2  2.0 ! C.109 at 6.03e+05
assign (resid  25 and name  HD#) (resid  26 and name   HN)  5.0  3.2  2.0 ! B.1286 at 4.33e+05

! Q26 
assign (resid  26 and name   HN) (resid  26 and name  HB#)  3.0  1.2  1.5 ! A.310 at 3.09e+06
assign (resid  26 and name   HN) (resid  26 and name  HG#)  5.0  3.2  2.0 ! A.312 at 4.93e+05
assign (resid  26 and name   HA) (resid  26 and name  HG#)  3.0  1.2  1.2 ! A.1583 at 1.49e+06
assign (resid  26 and name   HA) (resid  26 and name HE2#)  4.0  2.2  2.0 ! A.322 at 7.82e+05
assign (resid  26 and name  HG#) (resid  26 and name HE2#)  4.0  2.2  3.0 ! A.324 at 8.58e+05
assign (resid  26 and name   HN) (resid  27 and name   HN)  3.0  1.2  0.5 ! A.328 at 2.67e+06
assign (resid  26 and name   HA) (resid  27 and name   HN)  4.0  2.2  1.0 ! C.112 at 4.42e+05
assign (resid  26 and name  HB#) (resid  27 and name   HN)  4.0  2.2  2.0 ! A.334 at 7.32e+05
assign (resid  26 and name  HG#) (resid  27 and name   HN)  4.0  2.2  2.0 ! C.115 at 5.32e+05
assign (resid  26 and name   HA) (resid  29 and name  HB#)  2.5  0.7  1.2 ! B.2332 at 8.51e+05

! F27 
assign (resid  27 and name   HN) (resid  27 and name  HB#)  3.0  1.2  1.5 ! A.333 at 2.58e+06
assign (resid  27 and name   HN) (resid  27 and name  HD#)  4.0  2.2  3.4 ! A.329 at 6.04e+05
assign (resid  27 and name   HA) (resid  27 and name  HD#)  3.0  1.2  2.6 ! A.224 at 9.33e+05
assign (resid  27 and name  HB1) (resid  27 and name  HD#)  4.0  2.2  4.4 ! A.3047 at 2.89e+05
assign (resid  27 and name   HN) (resid  28 and name   HN)  4.0  2.2  1.0 ! A.337 at 1.35e+06
assign (resid  27 and name   HA) (resid  28 and name   HN)  4.0  2.2  1.0 ! A.343 at 1.10e+06
assign (resid  27 and name  HB#) (resid  28 and name   HN)  4.0  2.2  2.0 ! A.345 at 7.69e+05
assign (resid  27 and name  HD#) (resid  28 and name   HN)  4.0  2.2  3.4 ! A.338 at 5.18e+05
assign (resid  27 and name   HA) (resid  30 and name   HB)  3.0  1.2  0.2 ! A.1271 at 9.93e+05
assign (resid  27 and name   HA) (resid  45 and name  HD#)  3.0  1.2  2.7 ! A.1596 at 4.58e+05
assign (resid  27 and name  HD#) (resid  49 and name HD1#)  3.0  1.2  3.7 ! A.423 at 4.52e+05
assign (resid  27 and name  HD#) (resid  49 and name HD2#)  4.0  2.2  4.4 ! A.1601 at 2.98e+05
assign (resid  27 and name  HE#) (resid  49 and name HD1#)  2.5  0.7  3.6 ! A.424 at 1.05e+06
assign (resid  27 and name  HE#) (resid  49 and name HD2#)  2.5  0.7  3.6 ! A.2082 at 1.09e+06
assign (resid  27 and name   HZ) (resid 153 and name HD1#)  2.5  0.7  1.2 ! A.5646 at 9.20e+05

! R28 
assign (resid  28 and name   HN) (resid  28 and name  HB#)  2.5  0.7  1.4 ! A.342 at 4.13e+06
assign (resid  28 and name   HN) (resid  28 and name  HG#)  3.0  1.2  1.5 ! C.121 at 9.35e+05
assign (resid  28 and name   HN) (resid  28 and name  HD#)  4.0  2.2  2.0 ! C.123 at 5.08e+05
assign (resid  28 and name   HA) (resid  28 and name  HG#)  4.0  2.2  2.0 ! A.4985 at 4.15e+05
assign (resid  28 and name   HA) (resid  28 and name  HD#)  3.0  1.2  1.2 ! A.247 at 1.55e+06
assign (resid  28 and name  HB#) (resid  28 and name  HD#)  2.5  0.7  2.2 ! A.251 at 2.93e+06
assign (resid  28 and name   HN) (resid  29 and name   HN)  3.0  1.2  0.5 ! D.69 at 8.03e+05
assign (resid  28 and name   HA) (resid  31 and name   HN)  4.0  2.2  1.0 ! A.363 at 7.24e+05
assign (resid  28 and name   HA) (resid  31 and name  HB#)  3.0  1.2  1.3 ! A.1609 at 5.08e+05
assign (resid  28 and name   HA) (resid  31 and name  HD#)  4.0  2.2  3.4 ! A.3050 at 3.65e+05
assign (resid  28 and name  HG#) (resid  32 and name  HG#)  3.0  1.2  2.3 
assign (resid  28 and name  HG#) (resid 157 and name  HE#)  4.0  2.2  4.0 
assign (resid  28 and name  HD#) (resid 157 and name  HD#)  4.0  2.2  4.4 ! A.3057 at 4.09e+05
assign (resid  28 and name  HD#) (resid 157 and name  HE#)  3.0  1.2  3.7 ! A.1612 at 9.04e+05

! K29 
assign (resid  29 and name   HN) (resid  29 and name  HB#)  2.5  0.7  1.4 ! A.178 at 8.78e+06
assign (resid  29 and name   HA) (resid  29 and name  HG#)  2.5  0.7  1.2 ! A.3062 at 2.35e+06
assign (resid  29 and name   HA) (resid  29 and name  HD#)  3.0  1.2  1.2 ! A.3070 at 1.52e+06
assign (resid  29 and name   HA) (resid  29 and name  HE#)  3.0  1.2  1.2 ! A.3075 at 1.41e+06
assign (resid  29 and name  HB#) (resid  29 and name  HD#)  2.5  0.7  2.2 ! B.6711 at 1.32e+06
assign (resid  29 and name  HB#) (resid  29 and name  HE#)  4.0  2.2  2.2 ! A.3076 at 1.94e+06
assign (resid  29 and name  HG#) (resid  29 and name  HE#)  2.5  0.7  2.2 ! A.4933 at 2.43e+06
assign (resid  29 and name   HN) (resid  30 and name   HN)  2.5  0.7  0.4 ! A.175 at 3.71e+06
assign (resid  29 and name   HA) (resid  30 and name   HN)  4.0  2.2  0.5 ! C.324 at 8.37e+05
assign (resid  29 and name  HB#) (resid  30 and name   HN)  3.0  1.2  1.5 ! C.126 at 1.09e+06
assign (resid  29 and name   HA) (resid  32 and name   HN)  4.0  2.2  1.0 ! A.370 at 8.37e+05
assign (resid  29 and name  HG#) (resid  33 and name  HG#)  3.0  1.2  2.3 ! A.5286 at 4.79e+05
assign (resid  29 and name  HD#) (resid  33 and name  HG#)  3.0  1.2  2.3 ! B.11819 at -2.31e+05

! T30 
assign (resid  30 and name   HN) (resid  30 and name   HB)  3.0  1.2  0.5 ! A.348 at 2.78e+06
assign (resid  30 and name   HN) (resid  30 and name HG2#)  4.0  2.2  2.0 ! B.1443 at 7.77e+05
assign (resid  30 and name   HA) (resid  30 and name HG2#)  2.5  0.7  1.2 ! A.258 at 2.41e+06
assign (resid  30 and name   HN) (resid  31 and name   HN)  3.0  1.2  0.5 ! A.356 at 2.27e+06
assign (resid  30 and name   HA) (resid  31 and name   HN)  5.0  3.2  1.0 ! B.526 at 3.14e+05
assign (resid  30 and name   HB) (resid  31 and name   HN)  4.0  2.2  1.0 ! A.359 at 1.26e+06
assign (resid  30 and name HG2#) (resid  31 and name   HN)  4.0  2.2  2.0 ! A.365 at 5.23e+05
assign (resid  30 and name   HA) (resid  33 and name   HN)  4.0  2.2  1.0 ! A.381 at 1.14e+06
assign (resid  30 and name   HA) (resid  33 and name  HB1)  3.0  1.2  0.2 ! A.3080 at 1.29e+06
assign (resid  30 and name   HA) (resid  33 and name  HB2)  3.0  1.2  0.2 ! A.3079 at 1.70e+06
assign (resid  30 and name   HA) (resid  33 and name  HG#)  3.0  1.2  1.3 ! A.3083 at 4.45e+05
assign (resid  30 and name   HA) (resid  34 and name  HB#)  4.0  2.2  2.0 ! A.4934 at 4.67e+05
assign (resid  30 and name HG2#) (resid  34 and name  HB#)  3.0  1.2  2.3 ! B.2357 at 3.69e+05
assign (resid  30 and name   HB) (resid  45 and name  HD#)  3.0  1.2  2.7 ! A.1634 at 4.98e+05
assign (resid  30 and name HG2#) (resid  45 and name   HA)  4.0  2.2  2.0 ! A.3088 at 3.95e+05
assign (resid  30 and name HG2#) (resid  45 and name  HD#)  3.0  1.2  3.6 ! A.1636 at 1.28e+06
assign (resid  30 and name   HA) (resid  48 and name HD1#)  4.0  2.2  2.0 
assign (resid  30 and name HG2#) (resid  48 and name  HB#)  3.0  1.2  2.3 ! B.8395 at -2.31e+05
assign (resid  30 and name HG2#) (resid  48 and name HD1#)  2.5  0.7  2.2 ! B.1827 at 8.27e+05
assign (resid  30 and name HG2#) (resid  48 and name HD2#)  3.0  1.2  2.2 ! A.4938 at 1.03e+06
assign (resid  30 and name   HB) (resid  49 and name HD2#)  4.0  2.2  2.0 ! A.4505 at 2.69e+05

! F31 
assign (resid  31 and name   HN) (resid  31 and name  HB#)  3.0  1.2  1.5 ! A.362 at 2.68e+06
assign (resid  31 and name   HN) (resid  31 and name  HD#)  4.0  2.2  3.4 ! A.358 at 5.34e+05
assign (resid  31 and name   HA) (resid  31 and name  HD#)  3.0  1.2  2.7 ! A.273 at 6.23e+05
assign (resid  31 and name  HB#) (resid  31 and name  HD#)  4.0  2.2  4.4 ! A.4941 at 3.41e+05
assign (resid  31 and name   HN) (resid  32 and name   HN)  4.0  2.2  1.0 ! A.367 at 1.15e+06
assign (resid  31 and name   HA) (resid  32 and name   HN)  5.0  3.2  1.0 ! A.1617 at 3.56e+05
assign (resid  31 and name  HB#) (resid  32 and name   HN)  4.0  2.2  2.0 ! A.373 at 9.37e+05
assign (resid  31 and name  HD#) (resid  32 and name   HN)  4.0  2.2  3.4 ! A.368 at 6.48e+05
assign (resid  31 and name  HD#) (resid  32 and name   HA)  3.0  1.2  2.7 ! A.1498 at 5.15e+05
assign (resid  31 and name  HD#) (resid  32 and name  HG#)  3.0  1.2  3.7 ! A.5430 at 6.84e+05
assign (resid  31 and name   HA) (resid  34 and name   HN)  5.0  3.2  1.0 ! A.389 at 4.88e+05
assign (resid  31 and name   HA) (resid  34 and name  HB#)  3.0  1.2  1.2 ! A.1274 at 1.54e+06
assign (resid  31 and name  HD#) (resid  34 and name  HB#)  4.0  2.2  4.0 
assign (resid  31 and name  HE#) (resid  41 and name  HE1)  4.0  2.2  3.4 ! A.4974 at 3.12e+05
assign (resid  31 and name   HN) (resid  45 and name  HD#)  4.0  2.2  3.4 ! A.357 at 1.33e+06
assign (resid  31 and name   HA) (resid  45 and name  HD#)  3.0  1.2  2.7 ! A.1759 at 5.46e+05
assign (resid  31 and name  HD#) (resid  45 and name  HD#)  3.0  1.2  5.1 ! A.1761 at 4.48e+05
assign (resid  31 and name  HD#) (resid 153 and name HG2#)  3.0  1.2  3.7 ! A.1648 at 5.88e+05
assign (resid  31 and name  HE#) (resid 153 and name HG2#)  2.5  0.7  3.6 ! A.2682 at 1.13e+06
assign (resid  31 and name  HD#) (resid 154 and name HG1#)  4.0  2.2  4.4 ! A.3096 at 3.11e+05
assign (resid  31 and name  HE#) (resid 154 and name   HA)  4.0  2.2  3.4 ! A.1182 at 3.51e+05
assign (resid  31 and name  HE#) (resid 154 and name HG2#)  3.0  1.2  3.7 ! A.2683 at 4.62e+05
assign (resid  31 and name   HZ) (resid 154 and name   HA)  4.0  2.2  1.0 ! A.1183 at 4.00e+05
assign (resid  31 and name   HZ) (resid 154 and name HG2#)  3.0  1.2  1.3 ! A.3098 at 4.52e+05

! E32 
assign (resid  32 and name   HN) (resid  32 and name  HB#)  4.0  2.2  2.0 ! A.372 at 1.31e+06
assign (resid  32 and name   HN) (resid  32 and name  HG#)  4.0  2.2  2.0 ! A.375 at 1.32e+06
assign (resid  32 and name   HA) (resid  32 and name  HG#)  3.0  1.2  1.2 ! A.3102 at 2.09e+06
assign (resid  32 and name   HN) (resid  33 and name   HN)  3.0  1.2  0.5 ! A.378 at 3.12e+06
assign (resid  32 and name   HA) (resid  33 and name   HN)  3.0  1.2  0.5 ! B.537 at 1.26e+06
assign (resid  32 and name   HA) (resid  35 and name   HN)  4.0  2.2  1.0 ! A.399 at 5.68e+05

! E33 
assign (resid  33 and name   HN) (resid  33 and name  HB1)  3.0  1.2  0.5 ! A.384 at 2.32e+06
assign (resid  33 and name   HN) (resid  33 and name  HB2)  2.5  0.7  0.4 ! A.383 at 5.63e+06
assign (resid  33 and name   HN) (resid  33 and name  HG#)  3.0  1.2  1.5 ! A.382 at 2.09e+06
assign (resid  33 and name   HA) (resid  33 and name  HG#)  2.5  0.7  1.2 ! A.3107 at 2.29e+06
assign (resid  33 and name   HN) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.377 at 1.58e+06
assign (resid  33 and name   HN) (resid  34 and name  HB#)  5.0  3.2  2.0 ! B.1450 at 3.40e+05
assign (resid  33 and name   HA) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.388 at 6.27e+05
assign (resid  33 and name  HB1) (resid  34 and name   HN)  4.0  2.2  1.0 ! A.393 at 1.55e+06
assign (resid  33 and name  HB2) (resid  34 and name   HN)  3.0  1.2  0.5 ! A.392 at 2.06e+06
assign (resid  33 and name  HG#) (resid  34 and name   HN)  4.0  2.2  2.0 ! C.142 at 6.78e+05
assign (resid  33 and name   HA) (resid  36 and name   HN)  4.0  2.2  1.0 ! A.407 at 6.28e+05
assign (resid  33 and name   HA) (resid  36 and name  HE#)  3.0  1.2  1.2 ! A.1694 at 1.62e+06
assign (resid  33 and name   HN) (resid  48 and name HD1#)  5.0  3.2  2.0 ! B.1789 at 2.28e+05
assign (resid  33 and name  HB1) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.4678 at 9.04e+05
assign (resid  33 and name  HB2) (resid  48 and name HD1#)  3.0  1.2  1.2 ! A.4679 at 1.20e+06

! A34 
assign (resid  34 and name   HN) (resid  34 and name  HB#)  2.5  0.7  1.4 ! A.391 at 4.21e+06
assign (resid  34 and name   HN) (resid  35 and name   HN)  3.0  1.2  0.5 ! A.387 at 2.14e+06
assign (resid  34 and name   HA) (resid  35 and name   HN)  5.0  3.2  1.0 ! A.400 at 4.75e+05
assign (resid  34 and name  HB#) (resid  35 and name   HN)  4.0  2.2  2.0 ! A.403 at 1.17e+06
assign (resid  34 and name   HA) (resid  36 and name   HN)  5.0  3.2  1.0 ! B.1454 at 2.84e+05
assign (resid  34 and name   HA) (resid  37 and name   HN)  4.0  2.2  1.0 ! A.417 at 6.22e+05
assign (resid  34 and name   HA) (resid  37 and name  HE#)  4.0  2.2  1.3 ! A.1706 at 5.82e+05
assign (resid  34 and name  HB#) (resid  37 and name  HE#)  3.0  1.2  2.3 ! A.4435 at 6.29e+05
assign (resid  34 and name  HB#) (resid  41 and name  HD2)  3.0  1.2  1.2 ! A.296 at 3.60e+06
assign (resid  34 and name   HA) (resid  44 and name  HB#)  4.0  2.2  2.0 ! A.3115 at 2.48e+05
assign (resid  34 and name  HB#) (resid  44 and name   HN)  5.0  3.2  2.0 ! B.1296 at 3.01e+05
assign (resid  34 and name  HB#) (resid  44 and name   HA)  4.0  2.2  2.0 ! A.4953 at 5.71e+05
assign (resid  34 and name  HB#) (resid  44 and name  HB#)  3.0  1.2  2.2 ! A.1752 at 2.72e+06
assign (resid  34 and name  HB#) (resid  45 and name   HN)  4.0  2.2  2.0 ! A.480 at 9.32e+05
assign (resid  34 and name  HB#) (resid  45 and name   HA)  3.0  1.2  1.2 ! A.1669 at 4.42e+06
assign (resid  34 and name  HB#) (resid  45 and name  HB#)  3.0  1.2  2.2 ! A.3118 at 1.13e+06
assign (resid  34 and name  HB#) (resid  45 and name  HD#)  3.0  1.2  3.6 ! A.1665 at 2.39e+06
assign (resid  34 and name   HN) (resid  48 and name HD1#)  3.0  1.2  1.5 ! A.394 at 1.98e+06
assign (resid  34 and name   HA) (resid  48 and name HD1#)  2.5  0.7  1.2 ! A.1664 at 2.83e+06
assign (resid  34 and name  HB#) (resid  48 and name   HG)  4.0  2.2  1.2 ! A.4490 at 1.96e+06
assign (resid  34 and name  HB#) (resid  48 and name HD1#)  2.5  0.7  2.2 ! A.1677 at 4.66e+06
assign (resid  34 and name  HB#) (resid  48 and name HD2#)  3.0  1.2  2.3 ! A.3122 at 8.53e+05

! G35 
assign (resid  35 and name   HN) (resid  36 and name   HN)  3.0  1.2  0.5 ! D.89 at 7.33e+05
assign (resid  35 and name   HN) (resid  36 and name  HG#)  4.0  2.2  2.0 ! C.1025 at 4.01e+05
assign (resid  35 and name  HA#) (resid  36 and name   HN)  4.0  2.2  2.0 ! A.408 at 6.76e+05

! K36 
assign (resid  36 and name   HN) (resid  36 and name  HB1)  4.0  2.2  1.0 ! A.410 at 1.17e+06
assign (resid  36 and name   HN) (resid  36 and name  HB2)  3.0  1.2  0.5 ! A.411 at 2.30e+06
assign (resid  36 and name   HN) (resid  36 and name  HG#)  3.0  1.2  1.5 ! A.412 at 1.65e+06
assign (resid  36 and name   HN) (resid  36 and name  HD#)  4.0  2.2  2.0 ! C.153 at 7.06e+05
assign (resid  36 and name   HA) (resid  36 and name  HG#)  2.5  0.7  1.2 ! A.3126 at 2.22e+06
assign (resid  36 and name   HA) (resid  36 and name  HD#)  2.5  0.7  1.2 ! A.1686 at 1.42e+06
assign (resid  36 and name   HA) (resid  36 and name  HE#)  4.0  2.2  1.2 ! A.1693 at 9.27e+05
assign (resid  36 and name  HB1) (resid  36 and name  HD#)  2.5  0.7  1.2 ! B.6911 at 5.68e+05
assign (resid  36 and name  HG#) (resid  36 and name  HE#)  2.5  0.7  2.2 ! A.3130 at 9.63e+05
assign (resid  36 and name   HN) (resid  37 and name   HN)  3.0  1.2  0.5 ! A.414 at 3.16e+06
assign (resid  36 and name   HN) (resid  37 and name  HG#)  5.0  3.2  2.0 ! B.1794 at 2.13e+05
assign (resid  36 and name   HA) (resid  37 and name   HN)  4.0  2.2  1.0 ! A.416 at 1.04e+06
assign (resid  36 and name  HB1) (resid  37 and name   HN)  4.0  2.2  1.0 ! A.423 at 5.58e+05
assign (resid  36 and name  HB2) (resid  37 and name   HN)  5.0  3.2  1.0 
assign (resid  36 and name  HG#) (resid  37 and name   HN)  5.0  3.2  2.0 ! B.1457 at 4.05e+05

! M37 
assign (resid  37 and name   HN) (resid  37 and name  HB1)  4.0  2.2  1.0 ! A.421 at 1.15e+06
assign (resid  37 and name   HN) (resid  37 and name  HB2)  3.0  1.2  0.5 ! A.422 at 2.90e+06
assign (resid  37 and name   HN) (resid  37 and name  HG#)  3.0  1.2  1.5 ! A.420 at 2.26e+06
assign (resid  37 and name   HN) (resid  37 and name  HE#)  4.0  2.2  2.0 ! C.158 at 7.06e+05
assign (resid  37 and name   HA) (resid  37 and name  HG#)  3.0  1.2  1.2 ! A.311 at 9.25e+05
assign (resid  37 and name   HA) (resid  37 and name  HE#)  4.0  1.2  2.0 
assign (resid  37 and name  HB1) (resid  37 and name  HE#)  3.0  1.2  1.2 ! B.472 at 6.63e+05
assign (resid  37 and name  HB2) (resid  37 and name  HE#)  2.5  0.7  1.2 ! B.2476 at 4.96e+05
assign (resid  37 and name  HG#) (resid  37 and name  HE#)  2.5  0.7  2.2 ! A.1708 at 3.55e+06
assign (resid  37 and name   HN) (resid  38 and name  HD#)  5.0  3.2  2.0 ! B.564 at 2.63e+05
assign (resid  37 and name   HA) (resid  38 and name  HG#)  3.0  1.2  1.2 ! A.3139 at 9.69e+05
assign (resid  37 and name   HA) (resid  38 and name  HD#)  2.5  0.7  1.2 ! A.302 at 1.90e+06
assign (resid  37 and name  HB1) (resid  38 and name  HD#)  3.0  1.2  1.3 ! A.1697 at 5.64e+05
assign (resid  37 and name  HB2) (resid  38 and name  HD#)  3.0  1.2  1.3 ! A.1696 at 5.56e+05
assign (resid  37 and name  HG#) (resid  38 and name  HD#)  4.0  2.2  2.3 ! A.3143 at 5.33e+05
assign (resid  37 and name  HE#) (resid  38 and name  HD#)  4.0  2.2  3.0 ! A.4433 at 3.04e+05
assign (resid  37 and name  HG#) (resid  44 and name HD2#)  5.0  3.2  3.0 ! A.1623 at 5.11e+05
assign (resid  37 and name  HE#) (resid  44 and name   HA)  2.5  0.7  1.2 ! A.316 at 1.57e+06
assign (resid  37 and name  HE#) (resid  44 and name  HB#)  2.5  0.7  2.2 ! A.4434 at 1.72e+06
assign (resid  37 and name  HE#) (resid  47 and name HG2#)  2.5  0.7  2.2 ! A.3137 at 5.26e+06
assign (resid  37 and name  HE#) (resid  47 and name HD1#)  2.5  0.7  2.2 ! B.7008 at -4.83e+05
assign (resid  37 and name  HE#) (resid  48 and name HD1#)  3.0  1.2  2.2 ! B.6119 at 8.73e+05
assign (resid  37 and name  HE#) (resid  48 and name HD2#)  2.5  0.7  2.2 ! A.3136 at 4.47e+06

! P38 
assign (resid  38 and name   HA) (resid  38 and name  HG#)  2.5  0.7  1.2 
assign (resid  38 and name   HA) (resid  38 and name  HD#)  4.0  2.2  2.0 ! A.4437 at 2.93e+05
assign (resid  38 and name  HB#) (resid  38 and name  HD#)  4.0  2.2  2.3 ! A.1858 at 8.58e+05
assign (resid  38 and name   HA) (resid  39 and name   HN)  2.5  0.7  0.4 ! A.426 at 6.50e+06
assign (resid  38 and name  HB#) (resid  39 and name   HN)  4.0  2.2  2.0 ! A.429 at 7.05e+05
assign (resid  38 and name  HG#) (resid  39 and name   HN)  5.0  3.2  2.0 ! B.570 at 3.43e+05

! G39 
assign (resid  39 and name   HN) (resid  40 and name   HN)  4.0  2.2  1.0 ! D.98 at 4.16e+05
assign (resid  39 and name  HA#) (resid  40 and name   HN)  2.5  0.7  1.4 ! A.434 at 3.76e+06
assign (resid  39 and name  HA#) (resid  40 and name   HA)  4.0  2.2  2.0 ! A.3145 at 2.78e+05

! K40 
assign (resid  40 and name   HN) (resid  40 and name  HB1)  4.0  1.2  1.0 ! A.437 at 1.89e+06
assign (resid  40 and name   HN) (resid  40 and name  HB2)  3.0  1.2  0.5 ! A.438 at 2.75e+06
assign (resid  40 and name   HN) (resid  40 and name  HG#)  3.0  1.2  1.5 ! A.439 at 2.14e+06
assign (resid  40 and name   HN) (resid  40 and name  HD#)  3.0  1.2  1.5 ! C.170 at 1.23e+06
assign (resid  40 and name   HN) (resid  40 and name  HE#)  4.0  2.2  2.0 ! C.168 at 5.20e+05
assign (resid  40 and name   HA) (resid  40 and name  HG#)  2.5  0.7  1.2 ! A.347 at 1.96e+06
assign (resid  40 and name   HA) (resid  40 and name  HD#)  3.0  1.2  1.3 ! A.3069 at 9.12e+05
assign (resid  40 and name   HA) (resid  40 and name  HE#)  4.0  2.2  1.3 ! A.3153 at 8.21e+05
assign (resid  40 and name  HB1) (resid  40 and name  HE#)  2.5  0.7  1.2 ! A.3155 at 1.78e+06
assign (resid  40 and name   HA) (resid  41 and name   HN)  3.0  1.2  0.5 ! A.443 at 3.01e+06
assign (resid  40 and name  HB1) (resid  41 and name   HN)  5.0  3.2  1.0 ! A.445 at 4.19e+05
assign (resid  40 and name  HB2) (resid  41 and name   HN)  5.0  3.2  1.0 ! B.582 at 3.70e+05
assign (resid  40 and name  HG#) (resid  41 and name   HN)  5.0  3.2  2.0 ! A.446 at 4.11e+05
assign (resid  40 and name   HA) (resid  42 and name   HN)  4.0  2.2  1.0 ! C.1187 at 4.01e+05
assign (resid  40 and name  HB1) (resid  42 and name   HN)  5.0  3.2  1.0 ! B.1291 at 4.72e+05
assign (resid  40 and name   HA) (resid  43 and name   HN)  4.0  2.2  1.0 ! C.837 at 4.14e+05
assign (resid  40 and name  HB2) (resid  43 and name   HN)  4.0  2.2  1.0 ! A.462 at 9.18e+05
assign (resid  40 and name  HG#) (resid  43 and name  HB#)  3.0  1.2  2.3 ! B.7228 at 2.56e+05
assign (resid  40 and name  HB2) (resid  44 and name   HN)  5.0  3.2  1.0 ! A.1625 at 3.40e+05

! H41 
assign (resid  41 and name   HN) (resid  41 and name  HB#)  4.0  2.2  2.0 ! A.447 at 1.31e+06
assign (resid  41 and name   HA) (resid  41 and name  HD2)  3.0  1.2  0.2 ! A.348 at 1.09e+06
assign (resid  41 and name   HN) (resid  42 and name   HN)  5.0  3.2  1.0 ! A.441 at 4.86e+05
assign (resid  41 and name   HA) (resid  42 and name   HN)  5.0  3.2  1.0 ! B.586 at 3.53e+05
assign (resid  41 and name  HB#) (resid  42 and name   HN)  4.0  2.2  2.0 ! A.453 at 1.19e+06
assign (resid  41 and name  HB#) (resid  43 and name   HN)  4.0  2.2  2.0 ! C.838 at 4.88e+05
assign (resid  41 and name   HA) (resid  44 and name   HN)  4.0  2.2  1.0 ! A.470 at 6.35e+05
assign (resid  41 and name   HA) (resid  44 and name  HB#)  3.0  1.2  1.3 ! A.3160 at 5.40e+05
assign (resid  41 and name  HB#) (resid 154 and name HG1#)  4.0  2.2  2.2 ! A.1727 at 9.21e+05
assign (resid  41 and name  HB#) (resid 154 and name HG2#)  3.0  1.2  2.3 ! B.2537 at 2.82e+05

! G42 
assign (resid  42 and name   HN) (resid  43 and name   HN)  4.0  2.2  1.0 ! A.455 at 1.54e+06
assign (resid  42 and name  HA#) (resid  43 and name   HN)  4.0  2.2  2.0 ! A.459 at 6.85e+05
assign (resid  42 and name  HA#) (resid  45 and name   HN)  5.0  3.2  2.0 ! B.620 at 3.46e+05
assign (resid  42 and name  HA#) (resid 150 and name  HG#)  4.0  2.2  3.0 ! A.3169 at 3.32e+05
assign (resid  42 and name   HN) (resid 154 and name HG2#)  3.0  1.2  1.5 ! A.454 at 1.66e+06
assign (resid  42 and name  HA#) (resid 154 and name HG2#)  3.0  1.2  2.3 ! A.1734 at 8.85e+05

! E43 
assign (resid  43 and name   HN) (resid  43 and name  HB#)  2.5  0.7  1.4 ! A.461 at 4.06e+06
assign (resid  43 and name   HN) (resid  43 and name  HG#)  4.0  2.2  2.0 ! A.464 at 1.10e+06
assign (resid  43 and name   HA) (resid  43 and name  HG#)  3.0  1.2  1.3 ! A.1742 at 7.22e+05
assign (resid  43 and name   HN) (resid  44 and name   HN)  3.0  1.2  0.5 ! A.456 at 2.36e+06
assign (resid  43 and name   HN) (resid  44 and name  HB#)  5.0  3.2  2.0 ! A.460 at 3.65e+05
assign (resid  43 and name   HA) (resid  44 and name   HN)  4.0  2.2  1.0 ! A.471 at 5.20e+05
assign (resid  43 and name  HB#) (resid  44 and name   HN)  3.0  1.2  1.5 ! A.473 at 1.92e+06
assign (resid  43 and name  HG#) (resid  44 and name   HN)  4.0  2.2  2.0 ! C.193 at 5.84e+05
assign (resid  43 and name   HA) (resid  46 and name   HN)  4.0  2.2  1.0 ! C.840 at 5.00e+05
assign (resid  43 and name   HA) (resid  46 and name  HB#)  2.5  0.7  1.2 ! B.6154 at 6.43e+05
assign (resid  43 and name  HB#) (resid  47 and name HD1#)  3.0  1.2  2.3 ! B.613 at -2.69e+05
assign (resid  43 and name  HG#) (resid  47 and name HD1#)  4.0  2.2  2.3 ! A.1747 at 8.79e+05
assign (resid  43 and name  HG#) (resid 141 and name   HE)  5.0  3.2  2.0 

! N44 
assign (resid  44 and name   HN) (resid  44 and name  HB#)  3.0  1.2  1.5 ! A.472 at 2.82e+06
assign (resid  44 and name  HB#) (resid  44 and name  HD#)  4.0  2.2  3.0 ! C.1029 at 3.99e+05
assign (resid  44 and name   HN) (resid  45 and name   HN)  4.0  2.2  1.0 ! D.110 at 6.21e+05
assign (resid  44 and name   HA) (resid  45 and name   HN)  4.0  2.2  1.0 ! C.197 at 5.98e+05
assign (resid  44 and name  HB#) (resid  45 and name   HN)  4.0  2.2  2.0 ! A.479 at 1.02e+06
assign (resid  44 and name   HN) (resid  47 and name HD1#)  5.0  3.2  2.0 ! B.1458 at 3.69e+05
assign (resid  44 and name   HA) (resid  47 and name   HN)  5.0  3.2  1.0 ! A.492 at 4.77e+05
assign (resid  44 and name   HA) (resid  47 and name   HB)  3.0  1.2  0.2 ! A.1278 at 9.60e+05
assign (resid  44 and name   HA) (resid  47 and name HG2#)  3.0  1.2  1.2 ! A.1795 at 1.06e+06
assign (resid  44 and name   HA) (resid  47 and name HD1#)  2.5  0.7  1.2 ! A.1750 at 1.86e+06

! F45 
assign (resid  45 and name   HN) (resid  45 and name  HB#)  3.0  1.2  1.5 ! A.477 at 2.37e+06
assign (resid  45 and name   HN) (resid  45 and name  HD#)  5.0  3.2  3.4 ! B.103 at 2.22e+05
assign (resid  45 and name   HA) (resid  45 and name  HD#)  2.5  0.7  2.6 ! A.375 at 9.62e+05
assign (resid  45 and name  HB#) (resid  45 and name  HD#)  4.0  2.2  4.4 ! A.1811 at 4.26e+05
assign (resid  45 and name   HN) (resid  46 and name   HN)  4.0  2.2  1.0 ! A.475 at 1.01e+06
assign (resid  45 and name   HA) (resid  46 and name   HN)  5.0  3.2  1.0 ! B.1470 at 2.35e+05
assign (resid  45 and name  HB#) (resid  46 and name   HN)  4.0  2.2  2.0 ! A.486 at 6.51e+05
assign (resid  45 and name  HD#) (resid  46 and name   HN)  5.0  3.2  3.4 ! B.1469 at 2.96e+05
assign (resid  45 and name  HD#) (resid  46 and name   HA)  4.0  2.2  3.4 ! A.1764 at 3.09e+05
assign (resid  45 and name   HA) (resid  48 and name   HN)  4.0  2.2  1.0 ! A.501 at 5.13e+05
assign (resid  45 and name   HA) (resid  48 and name HD1#)  3.0  1.2  1.3 ! A.4493 at 4.71e+05
assign (resid  45 and name  HD#) (resid  48 and name HD1#)  3.0  1.2  3.7 ! A.3210 at 8.12e+05
assign (resid  45 and name  HD#) (resid  49 and name HD1#)  2.5  0.7  3.6 ! A.3232 at 9.21e+05

! M46 
assign (resid  46 and name   HN) (resid  46 and name  HG#)  4.0  2.2  2.0 ! A.487 at 1.42e+06
assign (resid  46 and name   HA) (resid  46 and name  HG#)  3.0  1.2  1.2 ! A.1766 at 1.13e+06
assign (resid  46 and name   HA) (resid  46 and name  HE#)  2.5  0.7  1.2 ! A.1774 at 2.49e+06
assign (resid  46 and name  HG#) (resid  46 and name  HE#)  3.0  1.2  2.2 ! A.1782 at 2.39e+06
assign (resid  46 and name   HN) (resid  47 and name   HN)  4.0  2.2  1.0 ! A.490 at 1.14e+06
assign (resid  46 and name   HA) (resid  47 and name   HN)  4.0  2.2  1.0 ! A.493 at 6.83e+05
assign (resid  46 and name  HB#) (resid  47 and name   HN)  4.0  2.2  2.0 ! A.496 at 1.16e+06
assign (resid  46 and name   HA) (resid  49 and name   HN)  4.0  2.2  1.0 ! A.511 at 7.48e+05
assign (resid  46 and name   HA) (resid  49 and name HD1#)  3.0  1.2  1.3 ! A.1610 at 8.85e+05
assign (resid  46 and name  HE#) (resid  49 and name HD1#)  3.0  1.2  2.3 ! A.1780 at 5.03e+05
assign (resid  46 and name  HG#) (resid 144 and name HD1#)  4.0  2.2  3.0 ! A.4986 at 4.37e+05
assign (resid  46 and name  HE#) (resid 144 and name   HA)  4.0  2.2  2.0 ! A.4463 at 6.25e+05
assign (resid  46 and name  HE#) (resid 144 and name  HB#)  2.5  0.7  2.2 ! A.4991 at 1.93e+06
assign (resid  46 and name  HE#) (resid 144 and name HD1#)  2.5  0.7  2.2 ! B.8715 at 6.70e+05
assign (resid  46 and name  HE#) (resid 144 and name HD2#)  3.0  1.2  2.2 ! A.3191 at 3.55e+06
assign (resid  46 and name  HE#) (resid 145 and name   HA)  4.0  2.2  2.0 ! A.4467 at 6.68e+05
assign (resid  46 and name  HG#) (resid 148 and name HG2#)  3.0  1.2  2.3 ! A.4461 at 5.12e+05
assign (resid  46 and name  HE#) (resid 148 and name   HA)  5.0  3.2  2.0 ! A.4465 at 4.17e+05
assign (resid  46 and name  HE#) (resid 148 and name   HB)  2.5  0.7  1.2 ! A.2628 at 4.63e+06
assign (resid  46 and name  HE#) (resid 148 and name HG1#)  3.0  1.2  2.3 ! B.4977 at 3.17e+05
assign (resid  46 and name  HE#) (resid 148 and name HG2#)  2.5  0.7  2.2 ! A.1784 at 5.28e+06

! I47 
assign (resid  47 and name   HN) (resid  47 and name   HB)  3.0  1.2  0.5 ! A.495 at 2.55e+06
assign (resid  47 and name   HN) (resid  47 and name HG1#)  4.0  2.2  2.0 ! A.111 at 1.48e+06
assign (resid  47 and name   HN) (resid  47 and name HG2#)  3.0  1.2  1.5 ! A.497 at 2.41e+06
assign (resid  47 and name   HN) (resid  47 and name HD1#)  3.0  1.2  1.5 ! B.623 at 2.12e+06
assign (resid  47 and name   HA) (resid  47 and name HG1#)  3.0  1.2  1.3 ! A.4475 at 6.99e+05
assign (resid  47 and name   HA) (resid  47 and name HG2#)  3.0  1.2  1.2 ! A.381 at 3.03e+06
assign (resid  47 and name   HA) (resid  47 and name HD1#)  4.0  2.2  2.0 ! A.383 at 1.26e+06
assign (resid  47 and name   HB) (resid  47 and name HD1#)  2.5  0.7  1.2 ! A.3206 at 2.40e+06
assign (resid  47 and name   HN) (resid  48 and name   HN)  4.0  2.2  1.0 ! A.499 at 9.93e+05
assign (resid  47 and name   HA) (resid  48 and name   HN)  5.0  3.2  1.0 ! A.503 at 4.01e+05
assign (resid  47 and name   HB) (resid  48 and name   HN)  3.0  1.2  0.5 ! C.1197 at 7.48e+05
assign (resid  47 and name HG2#) (resid  48 and name   HN)  4.0  2.2  2.0 ! A.506 at 9.31e+05
assign (resid  47 and name HD1#) (resid  48 and name   HN)  4.0  2.2  2.0 ! C.1202 at 4.13e+05
assign (resid  47 and name   HA) (resid  50 and name   HN)  5.0  3.2  1.0 ! A.1626 at 3.34e+05
assign (resid  47 and name HG2#) (resid 138 and name HD2#)  2.5  0.7  2.2 
assign (resid  47 and name HD1#) (resid 138 and name HD2#)  3.0  1.2  2.3 
assign (resid  47 and name HG2#) (resid 139 and name  HD#)  4.0  2.2  3.0 

! L48 
assign (resid  48 and name   HN) (resid  48 and name  HB#)  4.0  2.2  2.0 ! A.505 at 8.11e+05
assign (resid  48 and name   HN) (resid  48 and name   HG)  3.0  1.2  0.5 ! A.504 at 2.61e+06
assign (resid  48 and name   HN) (resid  48 and name HD2#)  4.0  2.2  2.0 ! A.507 at 9.35e+05
assign (resid  48 and name   HA) (resid  48 and name   HG)  4.0  2.2  1.0 ! A.1797 at 3.42e+05
assign (resid  48 and name   HA) (resid  48 and name HD2#)  2.5  0.7  1.2 ! A.384 at 2.30e+06
assign (resid  48 and name  HB#) (resid  48 and name HD1#)  3.0  1.2  2.3 ! A.390 at 7.42e+05
assign (resid  48 and name  HB#) (resid  48 and name HD2#)  3.0  1.2  2.3 ! A.388 at 8.45e+05
assign (resid  48 and name   HN) (resid  49 and name   HN)  4.0  2.2  1.0 ! A.500 at 1.51e+06
assign (resid  48 and name  HB#) (resid  49 and name   HA)  4.0  2.2  2.0 ! A.4500 at 3.66e+05
assign (resid  48 and name   HA) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.535 at 6.37e+05
assign (resid  48 and name   HA) (resid  51 and name  HB#)  4.0  2.2  1.3 ! A.1279 at 7.66e+05
assign (resid  48 and name HD2#) (resid  51 and name   HN)  5.0  3.2  2.0 ! B.2129 at 2.60e+05
assign (resid  48 and name HD2#) (resid  91 and name  HD#)  2.5  0.7  2.2 ! A.5274 at 1.66e+06
assign (resid  48 and name HD2#) (resid  91 and name   HE)  5.0  3.2  2.0 

! L49 
assign (resid  49 and name   HN) (resid  49 and name  HB#)  4.0  2.2  2.0 ! A.512 at 7.99e+05
assign (resid  49 and name   HN) (resid  49 and name   HG)  2.5  0.7  0.4 ! A.515 at 3.81e+06
assign (resid  49 and name   HN) (resid  49 and name HD1#)  4.0  2.2  2.0 ! A.513 at 8.07e+05
assign (resid  49 and name   HN) (resid  49 and name HD2#)  4.0  2.2  2.0 ! A.514 at 7.04e+05
assign (resid  49 and name   HA) (resid  49 and name   HG)  3.0  1.2  0.3 ! A.398 at 7.46e+05
assign (resid  49 and name   HA) (resid  49 and name HD1#)  4.0  2.2  2.0 ! A.400 at 5.07e+05
assign (resid  49 and name   HA) (resid  49 and name HD2#)  2.5  0.7  1.2 ! A.399 at 1.39e+06
assign (resid  49 and name  HB#) (resid  49 and name HD1#)  3.0  1.2  2.3 ! A.404 at 5.81e+05
assign (resid  49 and name  HB#) (resid  49 and name HD2#)  3.0  1.2  2.3 ! A.405 at 6.69e+05
assign (resid  49 and name   HN) (resid  50 and name   HN)  4.0  2.2  1.0 ! D.126 at 5.55e+05
assign (resid  49 and name   HA) (resid  50 and name   HN)  4.0  2.2  1.0 ! A.523 at 5.35e+05
assign (resid  49 and name   HA) (resid  50 and name  HB#)  4.0  2.2  2.0 ! A.4499 at 3.63e+05
assign (resid  49 and name  HB#) (resid  50 and name   HN)  4.0  2.2  2.0 ! A.519 at 5.05e+05
assign (resid  49 and name   HG) (resid  50 and name   HN)  4.0  2.2  1.0 ! B.633 at 7.25e+05
assign (resid  49 and name HD2#) (resid  50 and name   HN)  4.0  2.2  2.0 ! C.222 at 3.80e+05
assign (resid  49 and name   HA) (resid  52 and name   HN)  5.0  3.2  1.0 ! A.539 at 4.06e+05

! E50 
assign (resid  50 and name   HN) (resid  50 and name  HB#)  4.0  2.2  2.0 ! A.645 at 6.87e+05
assign (resid  50 and name   HA) (resid  50 and name  HG#)  4.0  2.2  2.0 ! A.3249 at 4.31e+05
assign (resid  50 and name   HN) (resid  51 and name   HN)  4.0  2.2  1.0 ! A.518 at 1.22e+06
assign (resid  50 and name  HB#) (resid  51 and name   HN)  5.0  3.2  2.0 ! A.526 at 4.83e+05

! S51 
assign (resid  51 and name   HN) (resid  51 and name  HB#)  4.0  2.2  2.0 ! A.534 at 1.27e+06
assign (resid  51 and name   HN) (resid  52 and name   HN)  4.0  2.2  1.0 ! D.131 at 5.05e+05
assign (resid  51 and name   HN) (resid  52 and name  HB#)  4.0  2.2  2.0 ! A.528 at 5.75e+05
assign (resid  51 and name   HA) (resid  52 and name   HN)  4.0  2.2  1.0 ! A.538 at 7.04e+05
assign (resid  51 and name   HA) (resid  55 and name HD2#)  5.0  3.2  2.0 ! A.1628 at 4.77e+05
assign (resid  51 and name   HA) (resid  56 and name HD1#)  3.0  1.2  1.2 ! A.4454 at 1.12e+06
assign (resid  51 and name  HB#) (resid  92 and name   HN)  5.0  3.2  2.0 ! A.1641 at 4.43e+05
assign (resid  51 and name   HA) (resid 135 and name  HE#)  4.0  2.2  3.4 ! A.5556 at 2.98e+05

! R52 
assign (resid  52 and name   HN) (resid  52 and name  HB#)  3.0  1.2  1.5 ! A.543 at 2.19e+06
assign (resid  52 and name   HN) (resid  52 and name  HG#)  4.0  2.2  2.0 ! C.231 at 6.87e+05
assign (resid  52 and name   HN) (resid  52 and name  HD#)  4.0  2.2  2.0 ! A.541 at 8.08e+05
assign (resid  52 and name   HN) (resid  52 and name   HE)  5.0  3.2  1.0 ! B.2028 at -4.19e+05
assign (resid  52 and name  HB#) (resid  52 and name  HD#)  4.0  2.2  3.0 ! A.4510 at 3.67e+05
assign (resid  52 and name  HB#) (resid  52 and name   HE)  4.0  2.2  2.0 ! B.2032 at -6.18e+05
assign (resid  52 and name   HN) (resid  53 and name   HN)  5.0  3.2  1.0 ! B.2133 at 1.88e+05
assign (resid  52 and name   HA) (resid  53 and name   HN)  3.0  1.2  0.5 ! C.235 at 1.10e+06
assign (resid  52 and name  HB#) (resid  53 and name   HN)  4.0  2.2  2.0 ! B.1821 at 6.33e+05
assign (resid  52 and name  HD#) (resid  53 and name   HN)  5.0  3.2  2.0 ! B.1491 at 3.69e+05
assign (resid  52 and name   HN) (resid  55 and name  HB#)  5.0  3.2  2.0 ! B.656 at 3.18e+05
assign (resid  52 and name  HB#) (resid  55 and name   HN)  4.0  2.2  2.0 ! A.581 at 1.10e+06

! L53 
assign (resid  53 and name   HN) (resid  53 and name  HB#)  3.0  1.2  1.5 ! A.554 at 2.37e+06
assign (resid  53 and name   HN) (resid  53 and name   HG)  5.0  3.2  1.0 ! A.555 at 5.01e+05
assign (resid  53 and name   HN) (resid  53 and name HD1#)  4.0  2.2  2.0 ! A.557 at 8.10e+05
assign (resid  53 and name   HN) (resid  53 and name HD2#)  4.0  2.2  2.0 ! B.664 at 6.33e+05
assign (resid  53 and name   HA) (resid  53 and name HD2#)  2.5  0.7  1.2 ! A.1849 at 1.35e+06
assign (resid  53 and name  HB#) (resid  53 and name HD2#)  3.0  1.2  2.3 ! A.1844 at 6.49e+05
assign (resid  53 and name   HN) (resid  54 and name   HN)  4.0  2.2  1.0 ! A.551 at 6.04e+05
assign (resid  53 and name   HA) (resid  54 and name   HN)  4.0  2.2  1.0 ! A.561 at 1.57e+06
assign (resid  53 and name  HB#) (resid  54 and name   HN)  4.0  2.2  2.0 ! A.566 at 1.56e+06
assign (resid  53 and name   HG) (resid  54 and name   HN)  4.0  2.2  1.0 ! A.568 at 7.31e+05
assign (resid  53 and name HD1#) (resid  54 and name   HN)  4.0  2.2  2.0 ! C.1214 at 6.37e+05
assign (resid  53 and name HD2#) (resid  54 and name   HN)  4.0  2.2  2.0 ! A.570 at 6.04e+05
assign (resid  53 and name   HA) (resid  55 and name   HN)  5.0  3.2  1.0 ! B.1830 at 3.17e+05
assign (resid  53 and name HD1#) (resid  78 and name HG2#)  2.5  0.7  2.2 
assign (resid  53 and name HD2#) (resid  85 and name HG1#)  2.5  0.7  2.2 ! A.4515 at 3.05e+06
assign (resid  53 and name   HN) (resid  90 and name  HB#)  5.0  3.2  2.0 ! B.2137 at 3.97e+05
assign (resid  53 and name   HN) (resid  90 and name  HD#)  5.0  3.2  3.4 ! B.2131 at 2.51e+05
assign (resid  53 and name  HB#) (resid  90 and name   HN)  5.0  3.2  2.0 ! A.968 at 4.19e+05
assign (resid  53 and name HD2#) (resid  90 and name   HN)  4.0  2.2  2.0 ! A.971 at 6.23e+05
assign (resid  53 and name HD2#) (resid  90 and name  HB#)  3.0  1.2  2.3 ! A.5027 at 6.74e+05
assign (resid  53 and name HD2#) (resid  90 and name  HD#)  3.0  1.2  3.7 ! A.5266 at 5.24e+05
assign (resid  53 and name HD2#) (resid  91 and name  HG#)  2.5  0.7  2.2 ! B.9245 at 6.79e+05
assign (resid  53 and name   HN) (resid  92 and name   HN)  4.0  2.2  1.0 ! A.983 at 5.15e+05
assign (resid  53 and name   HN) (resid  92 and name HG2#)  4.0  2.2  2.0 ! A.556 at 8.32e+05
assign (resid  53 and name   HA) (resid  92 and name HG2#)  3.0  1.2  1.3 
assign (resid  53 and name HD1#) (resid  92 and name HG2#)  2.5  0.7  2.2 ! B.9739 at 1.70e+06

! D54 
assign (resid  54 and name   HN) (resid  54 and name  HB#)  3.0  1.2  1.5 ! A.563 at 2.50e+06
assign (resid  54 and name   HN) (resid  55 and name   HN)  3.0  1.2  0.5 ! A.572 at 1.66e+06
assign (resid  54 and name   HA) (resid  55 and name   HN)  5.0  3.2  1.0 ! A.579 at 4.36e+05
assign (resid  54 and name  HB#) (resid  55 and name   HN)  4.0  2.2  2.0 ! A.582 at 1.11e+06
assign (resid  54 and name   HN) (resid  57 and name   HB)  5.0  3.2  1.0 ! A.1630 at 3.84e+05
assign (resid  54 and name   HN) (resid  57 and name HG2#)  4.0  2.2  2.0 
assign (resid  54 and name   HA) (resid  57 and name   HN)  4.0  2.2  1.0 ! A.604 at 6.93e+05
assign (resid  54 and name   HA) (resid  57 and name   HB)  3.0  1.2  0.3 ! A.1857 at 7.40e+05
assign (resid  54 and name   HA) (resid  57 and name HG2#)  2.5  0.7  1.2 ! A.4523 at 1.07e+06
assign (resid  54 and name   HA) (resid  58 and name   HN)  5.0  3.2  1.0 ! A.618 at 4.70e+05
assign (resid  54 and name   HA) (resid  69 and name  HB#)  3.0  1.2  1.3 ! A.4729 at 5.80e+05
assign (resid  54 and name  HB#) (resid  69 and name  HB#)  4.0  2.2  3.0 ! A.4593 at 3.75e+05
assign (resid  54 and name  HB#) (resid  70 and name   HA)  3.0  1.2  1.3 ! A.5126 at 5.99e+05
assign (resid  54 and name   HN) (resid  73 and name HG2#)  4.0  2.2  2.0 ! A.569 at 6.36e+05
assign (resid  54 and name   HA) (resid  73 and name HG2#)  3.0  1.2  1.3 ! B.8996 at 2.82e+05
assign (resid  54 and name   HN) (resid  88 and name   HA)  4.0  2.2  1.0 

! N55 
assign (resid  55 and name   HN) (resid  55 and name  HB#)  3.0  1.2  1.5 ! A.577 at 1.78e+06
assign (resid  55 and name   HA) (resid  55 and name HD2#)  5.0  3.2  2.0 ! A.1627 at 4.59e+05
assign (resid  55 and name   HN) (resid  56 and name   HN)  4.0  2.2  1.0 ! A.573 at 1.08e+06
assign (resid  55 and name  HB#) (resid  56 and name   HN)  4.0  2.2  2.0 ! A.598 at 1.05e+06
assign (resid  55 and name   HA) (resid  58 and name  HD#)  3.0  1.2  2.7 ! A.4780 at 7.73e+05
assign (resid  55 and name  HB#) (resid  59 and name   HE)  5.0  3.2  2.0 ! B.2106 at -3.47e+05
assign (resid  55 and name HD2#) (resid  59 and name  HG#)  4.0  2.2  3.0 ! A.586 at 6.00e+05
assign (resid  55 and name HD2#) (resid  59 and name  HD#)  4.0  2.2  3.0 ! A.585 at 1.09e+06
assign (resid  55 and name HD2#) (resid  59 and name   HE)  5.0  3.2  2.0 ! A.652 at -4.47e+05

! L56 
assign (resid  56 and name   HN) (resid  56 and name  HB#)  4.0  2.2  1.5 ! A.594 at 2.37e+06
assign (resid  56 and name   HN) (resid  56 and name   HG)  3.0  1.2  0.5 ! A.593 at 2.72e+06
assign (resid  56 and name   HN) (resid  56 and name HD1#)  4.0  2.2  2.0 ! A.597 at 6.74e+05
assign (resid  56 and name   HN) (resid  56 and name HD2#)  4.0  2.2  2.0 ! A.596 at 1.17e+06
assign (resid  56 and name   HA) (resid  56 and name   HG)  4.0  2.2  1.0 ! A.4532 at 3.57e+05
assign (resid  56 and name   HA) (resid  56 and name HD1#)  4.0  2.2  2.0 ! A.440 at 3.78e+05
assign (resid  56 and name   HA) (resid  56 and name HD2#)  2.5  0.7  1.2 ! A.439 at 1.93e+06
assign (resid  56 and name  HB#) (resid  56 and name HD1#)  3.0  1.2  2.3 ! A.441 at 4.88e+05
assign (resid  56 and name  HB#) (resid  56 and name HD2#)  3.0  1.2  2.3 
assign (resid  56 and name   HN) (resid  57 and name   HN)  4.0  2.2  1.0 ! A.600 at 1.50e+06
assign (resid  56 and name   HA) (resid  57 and name   HN)  4.0  2.2  1.0 ! A.603 at 5.19e+05
assign (resid  56 and name  HB#) (resid  57 and name   HN)  4.0  2.2  2.0 ! A.607 at 5.94e+05
assign (resid  56 and name   HA) (resid  59 and name   HN)  4.0  2.2  1.0 ! A.629 at 7.16e+05
assign (resid  56 and name   HA) (resid  59 and name  HB#)  4.0  2.2  2.0 ! A.3989 at 3.05e+05
assign (resid  56 and name HD1#) (resid  92 and name   HN)  4.0  2.2  2.0 ! A.989 at 5.06e+05
assign (resid  56 and name HD1#) (resid  92 and name   HB)  3.0  1.2  1.3 ! A.2188 at 8.36e+05
assign (resid  56 and name HD1#) (resid  92 and name HG1#)  2.5  0.7  2.2 ! A.2208 at 2.25e+06
assign (resid  56 and name HD1#) (resid  92 and name HG2#)  2.5  0.7  2.2 ! A.2212 at 2.77e+06
assign (resid  56 and name HD1#) (resid  98 and name HD1#)  2.5  0.7  2.2 ! A.786 at 3.04e+06
assign (resid  56 and name   HG) (resid 124 and name HD1#)  2.5  0.7  1.2 ! A.5488 at 1.21e+06
assign (resid  56 and name HD1#) (resid 124 and name HD2#)  3.0  1.2  2.2 ! A.4731 at 2.41e+06
assign (resid  56 and name HD2#) (resid 124 and name HD2#)  2.5  0.7  2.2 ! A.5495 at 8.61e+06
assign (resid  56 and name   HA) (resid 135 and name  HE#)  4.0  2.2  3.4 ! A.4569 at 3.31e+05
assign (resid  56 and name HD1#) (resid 135 and name  HB#)  4.0  2.2  3.0 ! A.4579 at 3.82e+05
assign (resid  56 and name HD1#) (resid 135 and name  HD#)  3.0  1.2  3.7 ! A.3233 at 4.85e+05
assign (resid  56 and name HD1#) (resid 135 and name  HE#)  4.0  2.2  4.4 ! A.3290 at 3.68e+05
assign (resid  56 and name HD2#) (resid 135 and name  HD#)  2.5  0.7  3.6 ! A.4771 at 1.11e+06
assign (resid  56 and name HD2#) (resid 135 and name  HE#)  2.5  0.7  3.6 ! A.2578 at 1.19e+06

! V57 
assign (resid  57 and name   HN) (resid  57 and name   HB)  2.5  0.7  0.4 ! A.606 at 4.14e+06
assign (resid  57 and name   HN) (resid  57 and name HG1#)  4.0  2.2  2.0 ! C.260 at 6.98e+05
assign (resid  57 and name   HN) (resid  57 and name HG2#)  2.5  0.7  1.4 ! A.609 at 3.50e+06
assign (resid  57 and name   HA) (resid  57 and name HG1#)  3.0  1.2  1.2 ! A.1878 at 1.65e+06
assign (resid  57 and name   HA) (resid  57 and name HG2#)  3.0  1.2  1.2 ! A.1877 at 1.65e+06
assign (resid  57 and name   HN) (resid  58 and name   HN)  4.0  2.2  1.0 ! A.602 at 1.22e+06
assign (resid  57 and name   HB) (resid  58 and name   HN)  3.0  1.2  0.5 ! A.621 at 1.69e+06
assign (resid  57 and name HG1#) (resid  58 and name   HN)  4.0  2.2  2.0 ! A.623 at 8.78e+05
assign (resid  57 and name HG1#) (resid  58 and name   HA)  4.0  2.2  2.0 ! A.3311 at 3.33e+05
assign (resid  57 and name HG2#) (resid  58 and name   HN)  4.0  2.2  2.0 ! C.263 at 3.85e+05
assign (resid  57 and name   HA) (resid  62 and name HD1#)  3.0  1.2  1.2 ! A.3356 at 1.96e+06
assign (resid  57 and name HG1#) (resid  62 and name HD1#)  2.5  0.7  2.2 ! A.5046 at 7.43e+06
assign (resid  57 and name HG1#) (resid  63 and name   HN)  5.0  3.2  2.0 ! A.679 at 4.79e+05
assign (resid  57 and name HG1#) (resid  63 and name  HB#)  2.5  0.7  2.2 ! A.3305 at 2.48e+06
assign (resid  57 and name   HB) (resid  69 and name  HB#)  3.0  1.2  1.3 ! A.4956 at 5.94e+05
assign (resid  57 and name HG1#) (resid  69 and name   HA)  3.0  1.2  1.2 ! A.1982 at 9.95e+05
assign (resid  57 and name HG1#) (resid  69 and name  HB#)  2.5  0.7  2.2 ! A.1992 at 5.48e+06
assign (resid  57 and name HG2#) (resid  69 and name  HB#)  3.0  1.2  2.2 ! A.4397 at 1.44e+06
assign (resid  57 and name HG1#) (resid  78 and name HD1#)  2.5  0.7  2.2 ! B.9050 at -4.64e+05
assign (resid  57 and name HG2#) (resid  78 and name HG2#)  2.5  0.7  2.2 
assign (resid  57 and name HG2#) (resid  78 and name HD1#)  2.5  0.7  2.2 ! B.9060 at -7.49e+05
assign (resid  57 and name HG2#) (resid  98 and name HG2#)  2.5  0.7  2.2 ! A.5317 at 4.59e+06

! Y58 
assign (resid  58 and name   HN) (resid  58 and name  HB1)  3.0  1.2  0.5 ! A.619 at 3.18e+06
assign (resid  58 and name   HN) (resid  58 and name  HB2)  3.0  1.2  0.5 ! A.620 at 2.11e+06
assign (resid  58 and name   HN) (resid  58 and name  HD#)  4.0  2.2  3.4 ! A.616 at 8.08e+05
assign (resid  58 and name   HA) (resid  58 and name  HD#)  3.0  1.2  2.7 ! A.1899 at 4.87e+05
assign (resid  58 and name  HB1) (resid  58 and name  HD#)  4.0  2.2  3.4 ! A.464 at 4.40e+05
assign (resid  58 and name  HB1) (resid  58 and name  HE#)  4.0  2.2  3.4 ! A.3316 at 3.74e+05
assign (resid  58 and name  HB2) (resid  58 and name  HD#)  4.0  2.2  3.4 ! A.465 at 3.80e+05
assign (resid  58 and name   HN) (resid  59 and name   HN)  4.0  2.2  1.0 ! A.626 at 1.24e+06
assign (resid  58 and name   HA) (resid  59 and name   HN)  5.0  3.2  1.0 ! A.628 at 3.92e+05
assign (resid  58 and name  HB2) (resid  59 and name   HN)  4.0  2.2  1.0 ! A.631 at 5.44e+05
assign (resid  58 and name  HD#) (resid  59 and name   HN)  4.0  2.2  3.4 ! A.627 at 8.48e+05
assign (resid  58 and name   HA) (resid  61 and name   HN)  5.0  3.2  1.0 ! B.725 at 3.10e+05
assign (resid  58 and name   HA) (resid  62 and name   HN)  5.0  3.2  1.0 
assign (resid  58 and name   HA) (resid  63 and name   HN)  3.0  1.2  0.5 ! C.1222 at 7.45e+05
assign (resid  58 and name   HA) (resid  63 and name  HB#)  3.0  1.2  1.3 ! A.2597 at 6.58e+05
assign (resid  58 and name  HD#) (resid  63 and name  HB#)  3.0  1.2  3.7 ! A.5091 at 5.72e+05
assign (resid  58 and name  HE#) (resid  64 and name   HA)  3.0  1.2  2.7 ! A.2307 at 4.68e+05
assign (resid  58 and name  HD#) (resid  65 and name   HN)  5.0  3.2  3.4 ! A.1632 at 4.75e+05
assign (resid  58 and name  HD#) (resid  65 and name   HA)  4.0  2.2  3.4 ! A.3315 at 2.92e+05
assign (resid  58 and name  HE#) (resid  65 and name   HN)  5.0  3.2  3.4 ! B.1851 at 3.51e+05
assign (resid  58 and name  HE#) (resid  65 and name   HA)  3.0  1.2  2.6 ! A.1901 at 1.60e+06
assign (resid  58 and name  HE#) (resid  65 and name   HB)  4.0  2.2  3.4 ! A.4639 at 3.01e+05
assign (resid  58 and name  HE#) (resid  65 and name HG2#)  3.0  1.2  3.7 ! A.4596 at 5.46e+05
assign (resid  58 and name  HD#) (resid  66 and name   HA)  4.0  2.2  3.4 ! A.4640 at 3.62e+05
assign (resid  58 and name  HE#) (resid  66 and name   HN)  5.0  3.2  3.4 ! A.712 at 4.19e+05
assign (resid  58 and name   HN) (resid  69 and name  HB#)  4.0  2.2  2.0 ! A.622 at 1.49e+06
assign (resid  58 and name   HA) (resid  69 and name  HB#)  3.0  1.2  1.3 ! A.1894 at 7.48e+05
assign (resid  58 and name  HB1) (resid  69 and name  HB#)  3.0  1.2  1.3 ! A.4539 at 7.23e+05
assign (resid  58 and name  HB2) (resid  69 and name  HB#)  3.0  1.2  1.3 ! A.4591 at 4.96e+05
assign (resid  58 and name  HD#) (resid  69 and name  HB#)  2.5  0.7  3.6 ! A.1984 at 9.64e+05

! R59 
assign (resid  59 and name   HN) (resid  59 and name  HB#)  5.0  3.2  2.0 ! A.634 at 4.85e+05
assign (resid  59 and name   HN) (resid  59 and name  HG#)  3.0  1.2  1.5 ! A.632 at 1.69e+06
assign (resid  59 and name   HA) (resid  59 and name  HG#)  4.0  2.2  2.0 ! A.470 at 4.01e+05
assign (resid  59 and name   HA) (resid  59 and name  HD#)  3.0  1.2  1.3 ! A.3328 at 9.16e+05
assign (resid  59 and name  HG#) (resid  59 and name   HE)  5.0  3.2  2.0 ! A.654 at -5.98e+05
assign (resid  59 and name   HN) (resid  60 and name   HN)  4.0  2.2  1.0 ! A.625 at 1.47e+06
assign (resid  59 and name   HA) (resid  60 and name   HN)  4.0  2.2  1.0 ! A.643 at 8.47e+05
assign (resid  59 and name  HB#) (resid  60 and name   HN)  5.0  3.2  2.0 ! A.648 at 4.35e+05
assign (resid  59 and name  HG#) (resid  60 and name   HN)  3.0  1.2  1.5 ! A.646 at 1.79e+06
assign (resid  59 and name  HG#) (resid  60 and name   HA)  3.0  1.2  1.3 ! A.5066 at 5.31e+05

! L60 
assign (resid  60 and name   HN) (resid  60 and name  HB#)  4.0  2.2  2.0 ! A.649 at 1.49e+06
assign (resid  60 and name   HN) (resid  60 and name   HG)  3.0  1.2  0.5 ! C.273 at 1.26e+06
assign (resid  60 and name   HN) (resid  60 and name HD1#)  4.0  2.2  2.0 ! A.650 at 1.47e+06
assign (resid  60 and name   HN) (resid  60 and name HD2#)  3.0  1.2  1.5 ! B.718 at 1.58e+06
assign (resid  60 and name   HA) (resid  60 and name HD1#)  4.0  2.2  1.5 ! B.2944 at 2.22e+05
assign (resid  60 and name   HA) (resid  60 and name HD2#)  2.5  0.7  1.2 ! A.5681 at 2.65e+06
assign (resid  60 and name   HN) (resid  61 and name   HN)  4.0  2.2  1.0 ! A.637 at 1.21e+06
assign (resid  60 and name  HB#) (resid  61 and name   HN)  4.0  2.2  2.0 ! A.661 at 6.66e+05
assign (resid  60 and name   HG) (resid  61 and name   HN)  4.0  2.2  1.0 ! C.277 at 4.81e+05
assign (resid  60 and name HD1#) (resid  61 and name   HN)  5.0  3.2  2.0 ! B.723 at 5.11e+05
assign (resid  60 and name  HB#) (resid  62 and name   HN)  4.0  2.2  2.0 ! A.675 at 7.05e+05
assign (resid  60 and name HD1#) (resid  98 and name   HB)  3.0  1.2  1.3 
assign (resid  60 and name   HA) (resid 120 and name HG2#)  2.5  0.7  1.2 
assign (resid  60 and name   HA) (resid 120 and name HD1#)  3.0  1.2  1.2 ! A.5454 at 1.16e+06
assign (resid  60 and name HD2#) (resid 120 and name HD1#)  3.0  1.2  2.2 ! B.10349 at -5.08e+05
assign (resid  60 and name HD2#) (resid 124 and name HD2#)  2.5  0.7  2.2 
assign (resid  60 and name HD1#) (resid 126 and name  HD#)  2.5  0.7  3.6 ! A.2418 at 1.01e+06
assign (resid  60 and name HD2#) (resid 126 and name   HA)  3.0  1.2  1.3 ! A.4562 at 7.60e+05
assign (resid  60 and name HD2#) (resid 126 and name  HB#)  2.5  0.7  2.2 
assign (resid  60 and name HD2#) (resid 126 and name  HD#)  3.0  1.2  3.6 ! A.4604 at 2.50e+06
assign (resid  60 and name HD1#) (resid 133 and name  HA#)  3.0  1.2  2.3 ! A.5596 at 5.80e+05
assign (resid  60 and name HD2#) (resid 133 and name  HA#)  3.0  1.2  2.3 ! A.4607 at 7.83e+05
assign (resid  60 and name HD2#) (resid 134 and name   HN)  5.0  3.2  2.0 ! A.1415 at 4.91e+05

! G61 
assign (resid  61 and name   HN) (resid  62 and name   HN)  3.0  1.2  0.5 ! A.665 at 1.60e+06
assign (resid  61 and name  HA#) (resid  62 and name   HN)  4.0  2.2  2.0 ! A.669 at 7.84e+05
assign (resid  61 and name   HN) (resid  63 and name   HN)  4.0  2.2  1.0 ! B.1848 at 9.38e+05
assign (resid  61 and name  HA#) (resid  63 and name   HN)  4.0  2.2  2.0 ! A.681 at 7.51e+05
assign (resid  61 and name  HA#) (resid 114 and name HD2#)  4.0  2.2  3.0 ! A.5422 at 4.34e+05
assign (resid  61 and name  HA#) (resid 117 and name  HB#)  4.0  2.2  2.3 ! A.5369 at 4.59e+05

! L62 
assign (resid  62 and name   HN) (resid  62 and name  HB1)  4.0  2.2  0.5 ! A.672 at 1.63e+06
assign (resid  62 and name   HN) (resid  62 and name  HB2)  3.0  1.2  0.5 ! A.670 at 2.08e+06
assign (resid  62 and name   HN) (resid  62 and name   HG)  3.0  1.2  0.5 ! C.1219 at 8.70e+05
assign (resid  62 and name   HN) (resid  62 and name HD1#)  4.0  2.2  2.0 ! A.673 at 1.50e+06
assign (resid  62 and name   HN) (resid  62 and name HD2#)  3.0  1.2  1.5 ! C.282 at 9.60e+05
assign (resid  62 and name   HA) (resid  62 and name   HG)  3.0  1.2  0.3 ! A.3351 at 5.40e+05
assign (resid  62 and name   HA) (resid  62 and name  HD*)  2.5  0.7  2.2 ! A.487 at 2.19e+06
assign (resid  62 and name   HA) (resid  62 and name HD2#)  2.5  0.7  1.2 ! A.2858 at 4.19e+06
assign (resid  62 and name  HB1) (resid  62 and name HD1#)  2.5  0.7  1.2 ! A.490 at 1.29e+06
assign (resid  62 and name  HB2) (resid  62 and name HD1#)  3.0  1.2  1.3 ! B.8073 at -2.21e+05
assign (resid  62 and name   HN) (resid  63 and name   HN)  3.0  1.2  0.5 ! A.663 at 1.81e+06
assign (resid  62 and name   HA) (resid  63 and name   HN)  4.0  2.2  1.0 ! A.680 at 9.70e+05
assign (resid  62 and name   HA) (resid  63 and name   HA)  4.0  2.2  1.0 ! A.4625 at 4.37e+05
assign (resid  62 and name  HB2) (resid  63 and name   HN)  4.0  2.2  1.0 ! A.682 at 6.29e+05
assign (resid  62 and name HD1#) (resid  63 and name   HN)  4.0  2.2  2.0 ! C.291 at 4.53e+05
assign (resid  62 and name HD2#) (resid  63 and name   HN)  4.0  2.2  2.0 ! A.684 at 5.54e+05
assign (resid  62 and name HD1#) (resid 100 and name HG2#)  2.5  0.7  2.2 ! A.3849 at 1.04e+07
assign (resid  62 and name HD2#) (resid 100 and name HG2#)  2.5  0.7  2.2 ! B.6108 at 1.03e+06
assign (resid  62 and name   HA) (resid 110 and name HG2#)  3.0  1.2  1.2 ! A.5078 at 9.80e+05
assign (resid  62 and name HD2#) (resid 110 and name HG2#)  2.5  0.7  2.2 ! B.9861 at 1.11e+06
assign (resid  62 and name   HN) (resid 113 and name  HB#)  3.0  1.2  1.5 ! A.671 at 2.39e+06
assign (resid  62 and name HD2#) (resid 131 and name   HA)  4.0  2.2  1.5 ! A.5683 at 5.08e+05
assign (resid  62 and name HD2#) (resid 131 and name  HG#)  2.5  0.7  2.2 ! A.5530 at 9.85e+05
assign (resid  62 and name HD2#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! A.5536 at 5.44e+06

! A63 
assign (resid  63 and name   HN) (resid  63 and name  HB#)  3.0  1.2  1.5 ! A.683 at 2.36e+06
assign (resid  63 and name   HN) (resid  64 and name   HN)  5.0  3.2  1.0 ! B.159 at 2.43e+05
assign (resid  63 and name   HA) (resid  64 and name   HN)  2.5  0.7  0.4 ! A.688 at 4.44e+06
assign (resid  63 and name  HB#) (resid  64 and name   HN)  3.0  1.2  1.5 ! A.691 at 2.69e+06
assign (resid  63 and name   HA) (resid  65 and name   HN)  4.0  2.2  1.0 ! C.1053 at 4.24e+05
assign (resid  63 and name  HB#) (resid  65 and name   HN)  2.5  0.7  1.4 ! C.864 at 1.61e+06
assign (resid  63 and name  HB#) (resid  68 and name   HN)  4.0  2.2  2.0 
assign (resid  63 and name  HB#) (resid  68 and name   HA)  3.0  1.2  1.3 ! A.5093 at 6.05e+05
assign (resid  63 and name  HB#) (resid  68 and name  HB#)  2.5  0.7  2.2 ! A.4791 at 3.28e+06
assign (resid  63 and name  HB#) (resid  68 and name  HG#)  2.5  0.7  2.2 ! A.5625 at 1.29e+06
assign (resid  63 and name  HB#) (resid  69 and name   HN)  3.0  1.2  1.5 ! A.765 at 2.07e+06
assign (resid  63 and name  HB#) (resid  69 and name   HA)  2.5  0.7  1.2 ! A.1940 at 1.57e+06
assign (resid  63 and name  HB#) (resid  69 and name  HB#)  2.5  0.7  2.2 ! A.1944 at 4.82e+06
assign (resid  63 and name   HA) (resid  72 and name HD1#)  4.0  2.2  1.3 ! A.5087 at 5.73e+05
assign (resid  63 and name  HB#) (resid  72 and name HD1#)  2.5  0.7  2.2 ! B.8658 at 7.42e+05
assign (resid  63 and name   HA) (resid 109 and name  HG*)  4.0  2.2  2.2 ! A.4722 at 1.08e+06
assign (resid  63 and name  HB#) (resid 109 and name  HG*)  2.5  0.7  3.2 ! B.9199 at 5.17e+05
assign (resid  63 and name   HN) (resid 113 and name  HB#)  3.0  1.2  1.5 ! C.1281 at 1.20e+06
assign (resid  63 and name   HA) (resid 113 and name  HB#)  2.5  0.7  1.2 ! A.4700 at 4.40e+06
assign (resid  63 and name  HB#) (resid 113 and name  HB#)  2.5  0.7  2.2 ! B.10051 at 6.09e+05

! R64 
assign (resid  64 and name   HN) (resid  64 and name  HB1)  4.0  2.2  1.0 ! A.689 at 1.42e+06
assign (resid  64 and name   HN) (resid  64 and name  HG#)  2.5  0.7  1.4 ! A.690 at 3.48e+06
assign (resid  64 and name   HN) (resid  64 and name  HD#)  5.0  3.2  2.0 ! B.1849 at 2.40e+05
assign (resid  64 and name   HN) (resid  64 and name   HE)  5.0  3.2  1.0 ! B.2045 at -4.22e+05
assign (resid  64 and name   HA) (resid  64 and name  HG#)  2.5  0.7  1.2 ! A.1954 at 2.04e+06
assign (resid  64 and name   HA) (resid  64 and name  HD#)  2.5  0.7  1.2 ! B.811 at -5.39e+05
assign (resid  64 and name  HB1) (resid  64 and name  HD#)  2.5  0.7  1.2 ! A.3438 at 3.68e+06
assign (resid  64 and name  HB1) (resid  64 and name   HE)  5.0  3.2  1.0 ! B.1533 at -2.43e+05
assign (resid  64 and name  HB2) (resid  64 and name  HD#)  2.5  0.7  1.2 ! A.5100 at 1.24e+06
assign (resid  64 and name  HG#) (resid  64 and name   HE)  5.0  3.2  2.0 ! A.698 at -6.64e+05
assign (resid  64 and name   HN) (resid  65 and name   HN)  3.0  1.2  0.5 ! A.686 at 2.21e+06
assign (resid  64 and name   HA) (resid  65 and name   HN)  4.0  2.2  1.0 ! A.706 at 9.32e+05
assign (resid  64 and name   HA) (resid  65 and name HG2#)  4.0  2.2  2.0 ! B.9210 at 2.18e+05
assign (resid  64 and name  HB#) (resid  65 and name   HN)  3.0  1.2  1.5 ! C.303 at 9.58e+05
assign (resid  64 and name  HB1) (resid  65 and name HG2#)  3.0  1.2  1.2 ! A.1952 at 2.74e+06
assign (resid  64 and name  HB2) (resid  65 and name   HN)  4.0  2.2  1.0 ! A.708 at 1.27e+06
assign (resid  64 and name  HB2) (resid  65 and name HG2#)  2.5  0.7  1.2 ! A.1949 at 1.18e+06
assign (resid  64 and name  HG#) (resid  65 and name   HN)  4.0  2.2  2.0 ! C.304 at 3.96e+05
assign (resid  64 and name  HD#) (resid  65 and name HG2#)  3.0  1.2  2.2 ! A.3416 at 1.15e+06
assign (resid  64 and name   HN) (resid  68 and name  HB#)  4.0  2.2  2.0 ! C.1046 at 4.27e+05
assign (resid  64 and name   HN) (resid  68 and name  HG#)  5.0  3.2  2.0 ! B.1366 at 2.53e+05
assign (resid  64 and name   HN) (resid 113 and name  HB#)  3.0  1.2  1.5 ! C.1282 at 9.69e+05
assign (resid  64 and name   HA) (resid 113 and name   HA)  4.0  2.2  1.0 ! A.5409 at 4.26e+05
assign (resid  64 and name   HA) (resid 113 and name  HB#)  3.0  1.2  1.2 ! A.4742 at 1.09e+06
assign (resid  64 and name  HG#) (resid 113 and name   HN)  4.0  2.2  2.0 ! A.1195 at 1.03e+06
assign (resid  64 and name  HG#) (resid 113 and name   HA)  3.0  1.2  1.2 ! A.3862 at 2.27e+06
assign (resid  64 and name  HG#) (resid 113 and name  HB#)  3.0  1.2  2.2 ! A.5412 at 3.63e+06
assign (resid  64 and name  HD#) (resid 113 and name   HA)  2.5  0.7  1.2 ! A.4715 at 2.11e+06
assign (resid  64 and name  HD#) (resid 113 and name  HB#)  2.5  0.7  2.2 ! A.4718 at 1.22e+06
assign (resid  64 and name  HG#) (resid 116 and name  HB#)  2.5  0.7  2.2 ! A.5436 at 9.18e+05
assign (resid  64 and name  HD#) (resid 116 and name  HB#)  2.5  0.7  2.2 ! A.4711 at 2.52e+06

! T65 
assign (resid  65 and name   HN) (resid  65 and name   HB)  5.0  3.2  1.0 ! A.705 at 4.80e+05
assign (resid  65 and name   HN) (resid  65 and name HG2#)  3.0  1.2  1.5 ! A.709 at 2.97e+06
assign (resid  65 and name   HA) (resid  65 and name HG2#)  2.5  0.7  1.2 ! A.505 at 3.16e+06
assign (resid  65 and name   HN) (resid  66 and name   HN)  4.0  2.2  1.0 ! D.171 at 3.45e+05
assign (resid  65 and name   HA) (resid  66 and name   HN)  2.5  0.7  0.4 ! A.713 at 4.93e+06
assign (resid  65 and name   HB) (resid  66 and name   HN)  2.5  0.7  0.4 ! B.751 at 4.21e+06
assign (resid  65 and name HG2#) (resid  66 and name   HN)  4.0  2.2  2.0 ! A.716 at 6.81e+05
assign (resid  65 and name   HB) (resid  67 and name   HN)  3.0  1.2  0.5 ! B.1301 at 2.94e+06
assign (resid  65 and name   HN) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.737 at 5.23e+05
assign (resid  65 and name   HN) (resid  68 and name  HB#)  3.0  1.2  1.5 ! A.707 at 2.87e+06
assign (resid  65 and name   HN) (resid  68 and name  HG#)  5.0  3.2  2.0 ! B.1536 at 2.47e+05
assign (resid  65 and name   HB) (resid  68 and name   HN)  4.0  2.2  1.0 ! B.2141 at 8.05e+05
assign (resid  65 and name HG2#) (resid  68 and name   HN)  4.0  2.2  2.0 ! A.743 at 5.80e+05
assign (resid  65 and name HG2#) (resid  68 and name HE2#)  5.0  3.2  3.0 ! B.2051 at 2.37e+05

! R66 
assign (resid  66 and name   HN) (resid  66 and name  HB#)  4.0  2.2  2.0 ! A.717 at 1.29e+06
assign (resid  66 and name   HN) (resid  67 and name   HN)  4.0  2.2  1.0 ! A.711 at 7.49e+05
assign (resid  66 and name  HB#) (resid  67 and name   HN)  4.0  2.2  2.0 ! A.733 at 7.64e+05
assign (resid  66 and name   HA) (resid  69 and name   HN)  4.0  2.2  1.0 ! A.767 at 5.66e+05
assign (resid  66 and name   HA) (resid  69 and name  HB#)  2.5  0.7  1.2 ! A.1965 at 1.59e+06

! R67 
assign (resid  67 and name   HN) (resid  67 and name  HB#)  3.0  1.2  1.5 ! A.730 at 2.56e+06
assign (resid  67 and name   HN) (resid  67 and name  HG#)  4.0  2.2  2.0 ! A.732 at 9.80e+05
assign (resid  67 and name   HA) (resid  67 and name  HG#)  2.5  0.7  1.2 ! A.2155 at 3.87e+06
assign (resid  67 and name   HA) (resid  67 and name  HD#)  2.5  0.7  1.2 ! A.3407 at 2.34e+06
assign (resid  67 and name  HB#) (resid  67 and name  HD#)  2.5  0.7  2.2 ! A.1975 at 8.90e+06
assign (resid  67 and name   HN) (resid  68 and name   HN)  3.0  1.2  0.5 ! A.721 at 1.60e+06
assign (resid  67 and name   HA) (resid  68 and name   HN)  4.0  2.2  1.0 ! A.745 at 1.20e+06
assign (resid  67 and name  HB#) (resid  68 and name   HN)  4.0  2.2  2.0 ! A.744 at 7.13e+05
assign (resid  67 and name  HG#) (resid  68 and name   HN)  4.0  2.2  2.0 ! C.316 at 5.50e+05
assign (resid  67 and name   HA) (resid  70 and name   HN)  4.0  2.2  1.0 ! A.1633 at 1.06e+06

! Q68 
assign (resid  68 and name   HN) (resid  68 and name  HB#)  2.5  0.7  1.4 ! A.741 at 3.77e+06
assign (resid  68 and name   HN) (resid  68 and name  HG#)  4.0  2.2  2.0 ! A.740 at 1.02e+06
assign (resid  68 and name   HA) (resid  68 and name  HG#)  2.5  0.7  1.2 ! A.5117 at 2.15e+06
assign (resid  68 and name  HB#) (resid  68 and name HE2#)  5.0  3.2  3.0 ! A.758 at 6.03e+05
assign (resid  68 and name  HG#) (resid  68 and name HE2#)  4.0  2.2  3.0 ! A.755 at 9.47e+05
assign (resid  68 and name   HN) (resid  69 and name   HN)  4.0  2.2  1.0 ! A.760 at 1.46e+06
assign (resid  68 and name   HN) (resid  69 and name  HB#)  4.0  2.2  2.0 ! C.808 at 4.30e+05
assign (resid  68 and name   HA) (resid  69 and name   HN)  5.0  3.2  1.0 ! A.764 at 4.94e+05
assign (resid  68 and name  HB#) (resid  69 and name   HN)  3.0  1.2  1.5 ! A.763 at 1.75e+06
assign (resid  68 and name  HG#) (resid  69 and name   HN)  4.0  2.2  2.0 ! C.320 at 4.84e+05
assign (resid  68 and name   HN) (resid  70 and name   HN)  5.0  3.2  1.0 
assign (resid  68 and name  HB#) (resid 109 and name  HG*)  2.5  0.7  3.2 ! B.10798 at 5.93e+05
assign (resid  68 and name  HG#) (resid 109 and name  HG*)  3.0  1.2  3.3 ! B.9816 at -3.39e+05
assign (resid  68 and name HE2#) (resid 109 and name  HG*)  5.0  3.2  4.0 ! A.754 at 1.02e+06

! A69 
assign (resid  69 and name   HN) (resid  69 and name  HB#)  3.0  1.2  1.5 ! A.762 at 3.03e+06
assign (resid  69 and name   HN) (resid  70 and name   HN)  3.0  1.2  0.5 ! A.761 at 1.69e+06
assign (resid  69 and name   HA) (resid  70 and name   HN)  4.0  2.2  1.0 
assign (resid  69 and name  HB#) (resid  70 and name   HN)  3.0  1.2  1.5 ! A.354 at 1.91e+06
assign (resid  69 and name   HA) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.799 at 1.15e+06
assign (resid  69 and name   HA) (resid  72 and name  HB1)  4.0  2.2  1.0 
assign (resid  69 and name   HA) (resid  72 and name  HB2)  3.0  1.2  0.3 ! A.4667 at 6.67e+05
assign (resid  69 and name   HA) (resid  72 and name HD1#)  3.0  1.2  1.2 ! A.3455 at 1.69e+06
assign (resid  69 and name  HB#) (resid  72 and name HD1#)  3.0  1.2  2.3 

! R70 
assign (resid  70 and name   HN) (resid  70 and name  HB#)  2.5  0.7  1.4 ! A.353 at 3.85e+06
assign (resid  70 and name   HN) (resid  70 and name  HG#)  3.0  1.2  1.5 ! C.327 at 9.78e+05
assign (resid  70 and name   HN) (resid  70 and name  HD#)  4.0  2.2  2.0 ! C.326 at 4.97e+05
assign (resid  70 and name   HA) (resid  70 and name  HG#)  3.0  1.2  1.3 ! A.1999 at 6.59e+05
assign (resid  70 and name   HA) (resid  70 and name  HD#)  4.0  2.2  2.0 ! A.3474 at 3.78e+05
assign (resid  70 and name  HB#) (resid  70 and name  HD#)  2.5  0.7  2.2 ! A.1574 at 2.59e+06
assign (resid  70 and name  HB#) (resid  70 and name   HE)  5.0  3.2  2.0 ! A.774 at -5.09e+05
assign (resid  70 and name   HN) (resid  71 and name   HN)  3.0  1.2  0.5 ! A.781 at 2.27e+06
assign (resid  70 and name   HA) (resid  71 and name   HN)  4.0  2.2  1.0 ! A.784 at 9.12e+05
assign (resid  70 and name  HB#) (resid  71 and name   HN)  2.5  0.7  1.4 ! A.787 at 4.52e+06
assign (resid  70 and name  HG#) (resid  71 and name   HN)  5.0  3.2  2.0 ! A.788 at 3.89e+05
assign (resid  70 and name   HA) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.5125 at 3.34e+05

! Q71 
assign (resid  71 and name   HN) (resid  71 and name  HB2)  2.5  0.7  0.4 ! A.786 at 3.73e+06
assign (resid  71 and name   HN) (resid  71 and name  HG#)  4.0  2.2  2.0 ! A.785 at 1.49e+06
assign (resid  71 and name   HA) (resid  71 and name  HG#)  2.5  0.7  1.2 ! A.3482 at 2.07e+06
assign (resid  71 and name  HG#) (resid  71 and name HE2#)  5.0  3.2  3.0 ! A.794 at 7.05e+05
assign (resid  71 and name   HN) (resid  72 and name   HN)  3.0  1.2  0.5 ! A.797 at 2.37e+06
assign (resid  71 and name  HB1) (resid  72 and name   HN)  4.0  2.2  1.0 ! A.804 at 1.12e+06
assign (resid  71 and name   HA) (resid  74 and name   HN)  4.0  2.2  1.0 ! C.1061 at 5.24e+05
assign (resid  71 and name   HA) (resid  74 and name HG2#)  3.0  1.2  1.3 
assign (resid  71 and name   HA) (resid  75 and name   HN)  4.0  2.2  1.0 ! C.1063 at 4.20e+05
assign (resid  71 and name   HA) (resid  75 and name  HD2)  4.0  2.2  1.0 ! A.5682 at 3.60e+05

! L72 
assign (resid  72 and name   HN) (resid  72 and name  HB1)  4.0  2.2  1.0 ! A.802 at 1.31e+06
assign (resid  72 and name   HN) (resid  72 and name  HB2)  2.5  0.7  0.4 ! A.800 at 3.91e+06
assign (resid  72 and name   HN) (resid  72 and name   HG)  2.5  0.7  0.4 ! A.801 at 3.39e+06
assign (resid  72 and name   HN) (resid  72 and name HD2#)  4.0  2.2  2.0 ! A.803 at 1.32e+06
assign (resid  72 and name   HA) (resid  72 and name   HG)  4.0  2.2  1.0 ! A.2013 at 3.41e+05
assign (resid  72 and name   HA) (resid  72 and name HD1#)  3.0  1.2  1.3 ! A.534 at 6.92e+05
assign (resid  72 and name   HA) (resid  72 and name HD2#)  2.5  0.7  1.2 ! A.526 at 2.21e+06
assign (resid  72 and name  HB1) (resid  72 and name HD1#)  3.0  1.2  1.3 ! B.8425 at -2.76e+05
assign (resid  72 and name  HB1) (resid  72 and name HD2#)  2.5  0.7  1.2 ! A.531 at 1.11e+06
assign (resid  72 and name  HB2) (resid  72 and name HD1#)  3.0  1.2  1.3 ! B.8424 at -2.68e+05
assign (resid  72 and name  HB2) (resid  72 and name HD2#)  3.0  1.2  1.2 ! A.2012 at 1.24e+06
assign (resid  72 and name   HN) (resid  73 and name   HN)  3.0  1.2  0.5 ! A.796 at 1.73e+06
assign (resid  72 and name   HA) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.809 at 5.13e+05
assign (resid  72 and name  HB1) (resid  73 and name   HN)  4.0  2.2  1.0 ! A.811 at 7.91e+05
assign (resid  72 and name   HN) (resid  74 and name   HN)  4.0  2.2  1.0 ! D.637 at 3.63e+05
assign (resid  72 and name   HA) (resid  77 and name  HD2)  3.0  1.2  0.2 ! A.4786 at 1.35e+06
assign (resid  72 and name HD2#) (resid  77 and name  HB1)  4.0  2.2  2.0 ! A.592 at 3.67e+05
assign (resid  72 and name HD2#) (resid  77 and name  HB2)  4.0  2.2  2.0 ! A.591 at 3.52e+05
assign (resid  72 and name HD2#) (resid  77 and name  HD2)  2.5  0.7  1.2 ! A.4581 at 1.05e+06
assign (resid  72 and name HD1#) (resid 109 and name  HG*)  2.5  0.7  3.2 ! B.9417 at 4.76e+05
assign (resid  72 and name HD2#) (resid 109 and name  HG*)  2.5  0.7  2.2 
assign (resid  72 and name HD1#) (resid 110 and name HD1#)  2.5  0.7  2.2 ! B.9886 at -8.76e+05
assign (resid  72 and name HD2#) (resid 110 and name HD1#)  2.5  0.7  2.2 ! A.5400 at 5.81e+06

! V73 
assign (resid  73 and name   HN) (resid  73 and name   HB)  2.5  0.7  0.4 ! A.810 at 5.28e+06
assign (resid  73 and name   HN) (resid  73 and name HG1#)  4.0  2.2  2.0 ! A.813 at 1.23e+06
assign (resid  73 and name   HN) (resid  73 and name HG2#)  3.0  1.2  1.5 ! A.812 at 3.19e+06
assign (resid  73 and name   HA) (resid  73 and name HG1#)  3.0  1.2  1.2 ! A.539 at 1.73e+06
assign (resid  73 and name   HA) (resid  73 and name HG2#)  2.5  0.7  1.2 ! A.538 at 1.47e+06
assign (resid  73 and name   HN) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.807 at 1.67e+06
assign (resid  73 and name   HA) (resid  74 and name   HN)  4.0  2.2  1.0 ! A.819 at 6.00e+05
assign (resid  73 and name   HB) (resid  74 and name   HN)  3.0  1.2  0.5 ! A.820 at 3.04e+06
assign (resid  73 and name HG1#) (resid  74 and name   HN)  4.0  2.2  2.0 ! A.823 at 9.53e+05
assign (resid  73 and name HG1#) (resid  74 and name   HA)  3.0  1.2  1.3 ! A.3224 at 6.76e+05
assign (resid  73 and name HG1#) (resid  74 and name HG2#)  3.0  1.2  2.2 ! A.2047 at 1.90e+06
assign (resid  73 and name HG2#) (resid  74 and name   HN)  4.0  2.2  2.0 ! A.822 at 6.27e+05
assign (resid  73 and name HG1#) (resid  76 and name   HN)  4.0  2.2  2.0 ! A.837 at 5.52e+05
assign (resid  73 and name   HA) (resid  78 and name   HN)  4.0  2.2  1.0 ! A.855 at 6.46e+05
assign (resid  73 and name   HA) (resid  78 and name   HB)  3.0  1.2  0.3 ! A.5186 at 7.31e+05
assign (resid  73 and name HG2#) (resid  78 and name   HN)  4.0  2.2  2.0 ! A.858 at 5.11e+05
assign (resid  73 and name HG2#) (resid  78 and name   HB)  3.0  1.2  1.3 ! B.8471 at -2.55e+05
assign (resid  73 and name HG2#) (resid  78 and name HD1#)  3.0  1.2  2.3 ! B.9049 at -3.84e+05
assign (resid  73 and name HG1#) (resid  86 and name   HN)  5.0  3.2  2.0 ! A.1639 at 4.53e+05
assign (resid  73 and name HG1#) (resid  86 and name   HA)  2.5  0.7  1.2 ! A.4496 at 2.37e+06
assign (resid  73 and name HG1#) (resid  86 and name  HB#)  4.0  2.2  3.0 ! A.5234 at 4.36e+05
assign (resid  73 and name HG1#) (resid  87 and name   HN)  4.0  2.2  2.0 ! A.951 at 8.55e+05
assign (resid  73 and name HG1#) (resid  88 and name   HA)  2.5  0.7  1.2 ! A.4660 at 2.09e+06
assign (resid  73 and name HG1#) (resid  88 and name  HB#)  2.5  0.7  2.2 ! A.5255 at 1.25e+06
assign (resid  73 and name HG1#) (resid  88 and name  HD#)  3.0  1.2  2.3 ! A.5261 at 4.76e+05
assign (resid  73 and name HG2#) (resid  88 and name   HA)  3.0  1.2  1.3 ! A.4661 at 5.36e+05

! T74 
assign (resid  74 and name   HN) (resid  74 and name   HB)  3.0  1.2  0.5 ! C.350 at -8.24e+05
assign (resid  74 and name   HN) (resid  74 and name HG2#)  3.0  1.2  1.5 ! A.821 at 3.16e+06
assign (resid  74 and name   HA) (resid  74 and name HG2#)  2.5  0.7  1.2 ! A.552 at 3.25e+06
assign (resid  74 and name   HN) (resid  75 and name   HN)  4.0  2.2  1.0 ! A.827 at 1.55e+06
assign (resid  74 and name   HA) (resid  75 and name   HN)  4.0  2.2  1.0 ! A.830 at 1.28e+06
assign (resid  74 and name   HB) (resid  75 and name   HN)  3.0  1.2  0.5 ! C.355 at -7.48e+05
assign (resid  74 and name   HB) (resid  75 and name  HD2)  4.0  2.2  1.0 ! A.5162 at 4.35e+05
assign (resid  74 and name HG2#) (resid  75 and name   HN)  5.0  3.2  2.0 ! A.832 at 4.37e+05
assign (resid  74 and name HG2#) (resid  75 and name  HD2)  4.0  2.2  2.0 
assign (resid  74 and name   HA) (resid  76 and name   HN)  5.0  3.2  1.0 ! A.836 at 4.74e+05
assign (resid  74 and name   HA) (resid  86 and name   HA)  3.0  1.2  0.3 ! A.5156 at 7.28e+05
assign (resid  74 and name   HA) (resid  86 and name  HB#)  3.0  1.2  1.2 ! A.5233 at 9.80e+05
assign (resid  74 and name HG2#) (resid  87 and name   HA)  4.0  2.2  2.0 ! A.5167 at 3.83e+05
assign (resid  74 and name HG2#) (resid  88 and name  HB#)  3.0  1.2  2.3 ! A.4389 at 6.41e+05
assign (resid  74 and name HG2#) (resid  88 and name  HG#)  2.5  0.7  2.2 ! A.3537 at 1.30e+06
assign (resid  74 and name HG2#) (resid  88 and name  HD#)  3.0  1.2  2.2 ! A.5164 at 2.69e+06

! H75 
assign (resid  75 and name   HN) (resid  75 and name  HB1)  4.0  2.2  1.0 ! A.829 at 1.09e+06
assign (resid  75 and name   HN) (resid  75 and name  HB2)  3.0  1.2  0.5 ! A.831 at 1.81e+06
assign (resid  75 and name   HA) (resid  75 and name  HD2)  3.0  1.2  0.3 ! A.577 at 4.98e+05
assign (resid  75 and name  HB1) (resid  75 and name  HD2)  4.0  2.2  0.3 ! A.578 at 5.93e+05
assign (resid  75 and name  HB2) (resid  75 and name  HD2)  4.0  2.2  1.0 ! A.579 at 3.93e+05
assign (resid  75 and name   HN) (resid  76 and name   HN)  4.0  2.2  1.0 ! A.824 at 1.41e+06
assign (resid  75 and name   HA) (resid  76 and name   HN)  4.0  2.2  1.0 ! C.357 at 5.38e+05
assign (resid  75 and name  HB2) (resid  76 and name   HN)  5.0  3.2  1.0 ! B.1879 at 3.93e+05
assign (resid  75 and name   HN) (resid  77 and name  HD2)  4.0  2.2  1.0 ! A.825 at 7.35e+05
assign (resid  75 and name  HB1) (resid  77 and name  HD2)  3.0  1.2  0.3 ! A.3556 at 6.07e+05
assign (resid  75 and name  HB2) (resid  77 and name  HD2)  2.5  0.7  0.2 ! A.5172 at 9.22e+05

! G76 
assign (resid  76 and name   HN) (resid  77 and name   HN)  4.0  2.2  1.0 ! D.207 at 5.80e+05
assign (resid  76 and name  HA#) (resid  77 and name   HN)  4.0  2.2  2.0 ! A.845 at 7.18e+05
assign (resid  76 and name  HA#) (resid  84 and name  HD#)  3.0  1.2  2.3 ! A.5181 at 5.72e+05
assign (resid  76 and name  HA#) (resid  86 and name  HB#)  4.0  2.2  3.0 ! A.5238 at 3.38e+05

! H77 
assign (resid  77 and name   HN) (resid  77 and name  HB1)  4.0  2.2  1.0 ! A.847 at 1.12e+06
assign (resid  77 and name   HN) (resid  77 and name  HB2)  3.0  1.2  0.5 ! A.848 at 1.74e+06
assign (resid  77 and name   HN) (resid  77 and name  HD2)  4.0  2.2  1.0 ! A.842 at 6.90e+05
assign (resid  77 and name   HN) (resid  78 and name   HN)  4.0  2.2  1.0 ! A.851 at 1.55e+06
assign (resid  77 and name   HN) (resid  78 and name   HB)  5.0  3.2  1.0 ! A.1635 at 3.55e+05
assign (resid  77 and name   HN) (resid  78 and name HD1#)  5.0  3.2  2.0 ! A.1634 at 4.14e+05
assign (resid  77 and name   HA) (resid  78 and name   HN)  5.0  3.2  1.0 ! B.819 at 4.84e+05
assign (resid  77 and name  HB#) (resid  78 and name   HN)  4.0  2.2  2.0 ! C.364 at 3.72e+05
assign (resid  77 and name  HB1) (resid  78 and name HD1#)  3.0  1.2  1.3 ! A.5196 at 5.01e+05
assign (resid  77 and name   HA) (resid 101 and name  HB#)  3.0  1.2  1.3 ! A.5348 at 5.73e+05
assign (resid  77 and name   HA) (resid 101 and name  HG#)  3.0  1.2  1.3 ! A.3548 at 4.47e+05
assign (resid  77 and name   HA) (resid 101 and name  HD#)  3.0  1.2  1.2 ! A.3866 at 1.42e+06
assign (resid  77 and name  HD2) (resid 107 and name HD1#)  3.0  1.2  1.3 ! A.5377 at 5.07e+05
assign (resid  77 and name  HB1) (resid 110 and name HD1#)  4.0  2.2  2.0 ! A.5399 at 4.32e+05

! I78 
assign (resid  78 and name   HN) (resid  78 and name   HB)  3.0  1.2  0.5 ! A.856 at 2.33e+06
assign (resid  78 and name   HN) (resid  78 and name HG2#)  4.0  2.2  2.0 ! B.822 at 6.26e+05
assign (resid  78 and name   HN) (resid  78 and name HD1#)  4.0  2.2  2.0 ! A.859 at 5.18e+05
assign (resid  78 and name   HA) (resid  78 and name HG2#)  2.5  0.7  1.2 ! A.603 at 2.32e+06
assign (resid  78 and name   HA) (resid  78 and name HD1#)  3.0  1.2  1.2 ! A.606 at 3.10e+06
assign (resid  78 and name   HB) (resid  78 and name HD1#)  3.0  1.2  1.2 ! A.608 at 2.21e+06
assign (resid  78 and name   HA) (resid  79 and name   HN)  2.5  0.7  0.4 ! C.369 at 1.68e+06
assign (resid  78 and name   HA) (resid  79 and name   HG)  4.0  2.2  1.0 ! A.3568 at 3.78e+05
assign (resid  78 and name HG2#) (resid  79 and name   HN)  3.0  1.2  1.5 ! C.374 at 1.24e+06
assign (resid  78 and name HD1#) (resid  79 and name   HN)  4.0  2.2  2.0 ! A.865 at 9.20e+05
assign (resid  78 and name HG2#) (resid  99 and name   HN)  4.0  2.2  2.0 ! A.1049 at 1.25e+06
assign (resid  78 and name   HA) (resid 100 and name   HA)  3.0  1.2  0.3 ! A.797 at 6.73e+05
assign (resid  78 and name   HA) (resid 100 and name HG1#)  4.0  2.2  2.0 ! A.3833 at 2.68e+05
assign (resid  78 and name   HA) (resid 100 and name HG2#)  4.0  2.2  2.0 ! A.5343 at 3.54e+05
assign (resid  78 and name HD1#) (resid 100 and name   HN)  4.0  2.2  2.0 ! A.1061 at 6.68e+05
assign (resid  78 and name HD1#) (resid 100 and name   HA)  3.0  1.2  1.2 ! A.607 at 2.12e+06
assign (resid  78 and name HD1#) (resid 100 and name HG1#)  3.0  1.2  2.3 ! B.6367 at -3.40e+05
assign (resid  78 and name HD1#) (resid 100 and name HG2#)  2.5  0.7  2.2 ! A.2281 at 4.74e+06
assign (resid  78 and name   HA) (resid 101 and name   HN)  4.0  2.2  1.0 ! A.1067 at 8.10e+05
assign (resid  78 and name HD1#) (resid 101 and name   HN)  4.0  2.2  2.0 ! A.1075 at 5.02e+05

! L79 
assign (resid  79 and name   HN) (resid  79 and name  HB#)  4.0  2.2  2.0 ! A.862 at 1.25e+06
assign (resid  79 and name   HN) (resid  79 and name   HG)  3.0  1.2  0.5 ! A.863 at 1.98e+06
assign (resid  79 and name   HN) (resid  79 and name HD2#)  4.0  2.2  2.0 ! C.373 at 5.48e+05
assign (resid  79 and name   HA) (resid  79 and name   HG)  4.0  2.2  0.3 ! A.5016 at 7.04e+05
assign (resid  79 and name   HA) (resid  79 and name HD1#)  4.0  1.2  2.0 
assign (resid  79 and name   HA) (resid  79 and name HD2#)  2.5  0.7  1.2 ! A.634 at 5.23e+06
assign (resid  79 and name  HB#) (resid  79 and name HD1#)  3.0  1.2  2.2 ! A.624 at 1.69e+06
assign (resid  79 and name  HB#) (resid  79 and name HD2#)  3.0  1.2  2.3 ! A.625 at 7.36e+05
assign (resid  79 and name   HN) (resid  80 and name   HN)  5.0  3.2  1.0 ! B.203 at 2.14e+05
assign (resid  79 and name   HA) (resid  80 and name   HN)  2.5  0.7  0.4 ! A.869 at 5.03e+06
assign (resid  79 and name  HB#) (resid  80 and name   HN)  4.0  2.2  2.0 ! A.872 at 1.28e+06
assign (resid  79 and name  HB#) (resid  82 and name   HN)  4.0  2.2  2.0 ! A.897 at 8.44e+05
assign (resid  79 and name HD1#) (resid  82 and name   HN)  4.0  2.2  2.0 ! B.2117 at 9.25e+05
assign (resid  79 and name HD1#) (resid  82 and name  HA#)  3.0  1.2  2.3 ! A.5204 at 7.97e+05
assign (resid  79 and name  HB#) (resid  83 and name   HN)  4.0  2.2  2.0 ! A.908 at 5.44e+05
assign (resid  79 and name  HB#) (resid  83 and name   HA)  4.0  2.2  1.3 ! A.3611 at 6.00e+05
assign (resid  79 and name HD2#) (resid  83 and name   HN)  4.0  2.2  2.0 ! A.910 at 6.66e+05
assign (resid  79 and name HD2#) (resid  83 and name   HA)  3.0  1.2  1.2 ! A.3612 at 1.18e+06
assign (resid  79 and name   HA) (resid  84 and name   HA)  3.0  1.2  0.2 ! A.663 at 1.38e+06
assign (resid  79 and name  HB#) (resid  84 and name   HA)  4.0  2.2  2.0 ! A.3620 at 2.74e+05
assign (resid  79 and name HD2#) (resid  84 and name   HN)  4.0  2.2  2.0 ! A.913 at 1.34e+06
assign (resid  79 and name HD2#) (resid  84 and name   HA)  2.5  0.7  1.2 ! A.3242 at 3.17e+06
assign (resid  79 and name HD2#) (resid  84 and name  HB#)  2.5  0.7  2.2 ! A.2110 at 9.42e+05
assign (resid  79 and name HD2#) (resid  84 and name  HG#)  3.0  1.2  2.2 ! A.3625 at 1.33e+06
assign (resid  79 and name HD2#) (resid  84 and name  HD#)  3.0  1.2  2.2 ! A.2324 at 1.12e+06
assign (resid  79 and name   HA) (resid  85 and name   HN)  4.0  2.2  1.0 ! A.920 at 9.93e+05
assign (resid  79 and name   HA) (resid  85 and name   HB)  4.0  2.2  1.0 ! A.3626 at 2.82e+05
assign (resid  79 and name   HN) (resid  99 and name   HN)  4.0  2.2  1.0 ! D.382 at 4.59e+05
assign (resid  79 and name   HA) (resid  99 and name  HB#)  4.0  2.2  2.0 ! A.4643 at 4.15e+05
assign (resid  79 and name  HB#) (resid  99 and name   HN)  4.0  2.2  2.0 ! A.1047 at 6.17e+05
assign (resid  79 and name  HB#) (resid  99 and name  HB#)  2.5  0.7  2.2 ! B.1805 at 6.69e+06
assign (resid  79 and name HD1#) (resid  99 and name  HB#)  2.5  0.7  2.2 ! A.2760 at 4.84e+06
assign (resid  79 and name HD2#) (resid  99 and name  HB#)  4.0  2.2  3.0 ! A.4682 at 1.20e+06
assign (resid  79 and name   HN) (resid 100 and name   HA)  5.0  3.2  1.0 ! A.1636 at 3.34e+05
assign (resid  79 and name   HN) (resid 101 and name   HN)  4.0  2.2  1.0 ! A.1651 at 5.84e+05
assign (resid  79 and name   HG) (resid 101 and name   HN)  4.0  2.2  1.0 ! A.1072 at 5.79e+05
assign (resid  79 and name   HG) (resid 101 and name   HA)  2.5  0.7  0.2 ! A.5018 at 1.66e+06
assign (resid  79 and name   HG) (resid 101 and name  HB#)  4.0  2.2  2.0 ! A.2300 at 4.36e+05
assign (resid  79 and name HD1#) (resid 101 and name   HN)  5.0  3.2  2.0 ! A.1074 at 3.85e+05
assign (resid  79 and name HD1#) (resid 101 and name   HA)  2.5  0.7  1.2 ! A.2076 at 4.65e+06
assign (resid  79 and name HD1#) (resid 101 and name  HB#)  4.0  2.2  3.0 ! A.2951 at 7.19e+05
assign (resid  79 and name HD2#) (resid 101 and name   HA)  3.0  1.2  1.3 ! A.1841 at 7.35e+05
assign (resid  79 and name HD2#) (resid 101 and name  HB#)  3.0  1.2  2.3 ! A.2298 at 8.20e+05
assign (resid  79 and name HD2#) (resid 101 and name  HD#)  3.0  1.2  2.3 ! A.3872 at 7.18e+05
assign (resid  79 and name HD1#) (resid 102 and name   HN)  4.0  2.2  2.0 ! A.1085 at 5.33e+05

! V80 
assign (resid  80 and name   HN) (resid  80 and name   HB)  3.0  1.2  0.5 ! B.833 at 2.33e+06
assign (resid  80 and name   HN) (resid  80 and name HG2#)  3.0  1.2  1.5 ! A.873 at 1.75e+06
assign (resid  80 and name   HA) (resid  80 and name HG1#)  2.5  0.7  1.2 ! A.639 at 1.93e+06
assign (resid  80 and name   HA) (resid  80 and name HG2#)  2.5  0.7  1.2 ! A.640 at 2.32e+06
assign (resid  80 and name   HA) (resid  81 and name   HN)  2.5  0.7  0.4 ! A.885 at 4.32e+06
assign (resid  80 and name HG1#) (resid  81 and name   HN)  4.0  2.2  2.0 ! A.887 at 1.21e+06
assign (resid  80 and name HG1#) (resid  81 and name  HB#)  3.0  1.2  2.3 ! A.3604 at 5.85e+05
assign (resid  80 and name HG2#) (resid  81 and name   HN)  5.0  3.2  2.0 ! A.888 at 4.16e+05
assign (resid  80 and name   HA) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.893 at 5.92e+05
assign (resid  80 and name   HN) (resid  83 and name   HN)  4.0  2.2  1.0 ! A.866 at 1.56e+06
assign (resid  80 and name   HN) (resid  83 and name  HB#)  4.0  2.2  2.0 ! C.856 at 5.48e+05
assign (resid  80 and name HG1#) (resid  83 and name   HN)  5.0  3.2  2.0 ! B.1898 at 3.27e+05
assign (resid  80 and name   HN) (resid  84 and name   HA)  4.0  2.2  1.0 ! A.870 at 6.76e+05
assign (resid  80 and name   HN) (resid  85 and name HG2#)  3.0  1.2  1.5 ! A.881 at 1.67e+06
assign (resid  80 and name   HA) (resid  85 and name HG2#)  4.0  2.2  2.0 ! A.4743 at 5.08e+05
assign (resid  80 and name   HB) (resid  85 and name HG2#)  2.5  0.7  1.2 ! A.2089 at 2.29e+06
assign (resid  80 and name HG1#) (resid  85 and name HG2#)  2.5  0.7  2.2 ! A.2128 at 2.59e+06
assign (resid  80 and name HG2#) (resid  85 and name   HN)  5.0  3.2  2.0 ! A.1637 at 4.02e+05
assign (resid  80 and name HG2#) (resid  85 and name   HB)  3.0  1.2  1.2 ! A.2119 at 2.21e+06
assign (resid  80 and name HG2#) (resid  85 and name HG1#)  2.5  0.7  2.2 ! A.3641 at 5.50e+06
assign (resid  80 and name HG2#) (resid  85 and name HG2#)  2.5  0.7  2.2 ! A.3645 at 5.01e+06
assign (resid  80 and name   HB) (resid  90 and name  HE#)  4.0  2.2  3.4 ! A.3587 at 3.67e+05
assign (resid  80 and name HG1#) (resid  90 and name  HE#)  2.5  0.7  3.6 ! A.2092 at 1.90e+06
assign (resid  80 and name HG2#) (resid  90 and name  HB#)  4.0  2.2  3.0 ! A.3708 at 3.74e+05
assign (resid  80 and name HG2#) (resid  90 and name  HD#)  3.0  1.2  3.7 ! A.5268 at 7.28e+05
assign (resid  80 and name HG2#) (resid  90 and name  HE#)  3.0  1.2  3.6 ! A.3714 at 9.84e+05
assign (resid  80 and name HG1#) (resid  92 and name HG1#)  2.5  0.7  2.2 ! A.3743 at 1.88e+06
assign (resid  80 and name HG2#) (resid  92 and name HG2#)  2.5  0.7  2.2 ! B.3750 at 7.33e+05
assign (resid  80 and name HG1#) (resid  96 and name  HB#)  3.0  1.2  2.3 ! A.5298 at 5.69e+05
assign (resid  80 and name HG1#) (resid  96 and name HE2#)  4.0  2.2  3.0 ! A.1020 at 8.32e+05
assign (resid  80 and name HG1#) (resid  97 and name   HN)  4.0  2.2  2.0 ! A.1033 at 5.41e+05
assign (resid  80 and name   HA) (resid  98 and name   HA)  3.0  1.2  0.2 ! A.637 at 1.08e+06
assign (resid  80 and name   HA) (resid  98 and name HG1#)  4.0  2.2  2.0 ! A.3585 at 3.93e+05
assign (resid  80 and name   HA) (resid  98 and name HG2#)  4.0  2.2  2.0 ! A.5312 at 5.60e+05
assign (resid  80 and name   HA) (resid  98 and name HD1#)  3.0  1.2  1.3 ! A.3806 at 5.68e+05
assign (resid  80 and name HG1#) (resid  98 and name   HA)  4.0  2.2  2.0 ! A.3591 at 4.66e+05
assign (resid  80 and name HG2#) (resid  98 and name   HA)  2.5  0.7  1.2 ! A.4536 at 1.30e+06
assign (resid  80 and name HG2#) (resid  98 and name HG1#)  3.0  1.2  2.3 ! B.6673 at 2.37e+05
assign (resid  80 and name   HA) (resid  99 and name   HN)  5.0  3.2  1.0 ! A.1638 at 3.27e+05
assign (resid  80 and name HG2#) (resid  99 and name   HN)  4.0  2.2  2.0 ! C.1141 at 4.30e+05

! D81 
assign (resid  81 and name   HN) (resid  81 and name   HA)  2.5  0.7  0.4 ! A.mam
assign (resid  81 and name   HN) (resid  81 and name  HB#)  5.0  3.2  2.0 ! B.840 at 2.98e+05
assign (resid  81 and name   HN) (resid  82 and name   HN)  4.0  2.2  1.0 ! A.883 at 1.03e+06
assign (resid  81 and name   HA) (resid  82 and name   HN)  3.0  1.2  0.5 ! A.894 at 1.77e+06
assign (resid  81 and name   HN) (resid  83 and name   HN)  5.0  3.2  1.0 ! B.1891 at 2.03e+05
assign (resid  81 and name   HN) (resid  97 and name   HN)  4.0  2.2  1.0 ! A.884 at 7.04e+05
assign (resid  81 and name   HN) (resid  97 and name   HB)  5.0  3.2  1.0 ! A.889 at 3.95e+05
assign (resid  81 and name   HA) (resid  97 and name   HN)  5.0  3.2  1.0 ! A.1028 at 4.60e+05
assign (resid  81 and name   HA) (resid  97 and name   HB)  4.0  2.2  1.0 ! A.763 at 6.79e+05

! G82 
assign (resid  82 and name   HN) (resid  83 and name   HN)  3.0  1.2  0.5 ! A.902 at 1.77e+06
assign (resid  82 and name  HA#) (resid  83 and name   HN)  4.0  2.2  2.0 ! A.907 at 1.03e+06

! S83 
assign (resid  83 and name   HN) (resid  83 and name  HB1)  4.0  2.2  1.0 ! A.905 at 1.18e+06
assign (resid  83 and name   HN) (resid  83 and name  HB2)  3.0  1.2  0.5 ! A.906 at 2.22e+06
assign (resid  83 and name   HN) (resid  84 and name   HN)  5.0  3.2  1.0 ! B.214 at 2.77e+05
assign (resid  83 and name   HA) (resid  84 and name   HN)  2.5  0.7  0.4 ! A.248 at 8.67e+06
assign (resid  83 and name  HB1) (resid  84 and name   HN)  4.0  2.2  1.0 ! A.251 at 1.23e+06
assign (resid  83 and name  HB2) (resid  84 and name   HN)  5.0  3.2  1.0 ! A.912 at 4.71e+05
assign (resid  83 and name  HB1) (resid  85 and name HG2#)  3.0  1.2  1.2 ! A.2131 at 1.18e+06
assign (resid  83 and name  HB2) (resid  85 and name HG2#)  3.0  1.2  1.2 ! A.3615 at 9.76e+05

! R84 
assign (resid  84 and name   HN) (resid  84 and name  HB#)  2.5  0.7  1.4 ! A.914 at 5.43e+06
assign (resid  84 and name   HN) (resid  84 and name  HG#)  5.0  3.2  2.0 ! A.915 at 4.40e+05
assign (resid  84 and name   HN) (resid  84 and name  HD#)  5.0  3.2  2.0 ! B.1578 at 2.16e+05
assign (resid  84 and name   HA) (resid  84 and name  HG#)  3.0  1.2  1.3 ! A.2104 at 6.24e+05
assign (resid  84 and name  HB#) (resid  84 and name  HD#)  2.5  0.7  2.2 ! A.2107 at 2.10e+06
assign (resid  84 and name   HN) (resid  85 and name   HN)  5.0  3.2  1.0 ! A.919 at 4.26e+05
assign (resid  84 and name   HA) (resid  85 and name   HN)  2.5  0.7  0.4 ! A.921 at 6.29e+06
assign (resid  84 and name  HB#) (resid  85 and name   HN)  4.0  2.2  2.0 ! B.864 at 7.98e+05
assign (resid  84 and name  HG#) (resid  85 and name   HN)  4.0  2.2  2.0 ! A.922 at 7.78e+05
assign (resid  84 and name  HB#) (resid  86 and name   HN)  4.0  2.2  2.0 ! A.930 at 7.50e+05

! V85 
assign (resid  85 and name   HN) (resid  85 and name   HB)  3.0  1.2  0.5 ! A.923 at 2.02e+06
assign (resid  85 and name   HN) (resid  85 and name HG1#)  3.0  1.2  1.5 ! B.865 at 1.66e+06
assign (resid  85 and name   HN) (resid  85 and name HG2#)  3.0  1.2  1.5 ! A.925 at 1.83e+06
assign (resid  85 and name   HA) (resid  85 and name  HG*)  2.5  0.7  2.2 ! A.665 at 5.77e+06
assign (resid  85 and name   HA) (resid  85 and name HG1#)  2.5  0.7  1.2 ! A.673 at 4.42e+06
assign (resid  85 and name   HA) (resid  85 and name HG2#)  2.5  0.7  1.2 ! A.675 at 5.66e+06
assign (resid  85 and name   HN) (resid  86 and name   HN)  5.0  3.2  1.0 ! A.918 at 4.53e+05
assign (resid  85 and name   HA) (resid  86 and name   HN)  2.5  0.7  0.4 ! A.254 at 7.20e+06
assign (resid  85 and name  HG*) (resid  86 and name   HN)  3.0  1.2  2.5 ! B.873 at 2.26e+06
assign (resid  85 and name   HA) (resid  87 and name   HN)  4.0  2.2  1.0 ! A.946 at 9.65e+05
assign (resid  85 and name HG1#) (resid  87 and name   HN)  2.5  0.7  1.4 ! A.952 at 4.46e+06
assign (resid  85 and name HG1#) (resid  87 and name   HB)  3.0  1.2  1.2 ! A.2124 at 1.35e+06
assign (resid  85 and name HG1#) (resid  87 and name HG2#)  3.0  1.2  2.2 ! A.3672 at 1.26e+06
assign (resid  85 and name HG1#) (resid  87 and name HD1#)  2.5  0.7  2.2 ! A.3678 at 1.05e+06
assign (resid  85 and name   HB) (resid  90 and name  HE#)  4.0  2.2  3.4 ! A.3630 at 3.53e+05
assign (resid  85 and name HG1#) (resid  90 and name   HN)  4.0  2.2  2.0 ! A.972 at 6.84e+05
assign (resid  85 and name HG1#) (resid  90 and name   HA)  4.0  2.2  2.0 ! A.4392 at 4.46e+05
assign (resid  85 and name HG1#) (resid  90 and name  HB#)  4.0  2.2  3.0 ! A.3638 at 3.59e+05
assign (resid  85 and name HG1#) (resid  90 and name  HD#)  3.0  1.2  3.6 ! A.2121 at 1.97e+06
assign (resid  85 and name HG1#) (resid  90 and name  HE#)  3.0  1.2  3.7 ! B.3683 at -2.55e+05
assign (resid  85 and name HG2#) (resid  90 and name  HD#)  3.0  1.2  3.7 ! A.2122 at 5.61e+05
assign (resid  85 and name HG2#) (resid  90 and name  HE#)  3.0  1.2  3.7 ! A.2164 at 8.00e+05

! N86 
assign (resid  86 and name   HN) (resid  86 and name  HB#)  4.0  2.2  2.0 ! A.929 at 5.42e+05
assign (resid  86 and name  HB#) (resid  86 and name HD2#)  5.0  3.2  3.0 ! A.938 at 5.19e+05
assign (resid  86 and name   HN) (resid  87 and name   HN)  3.0  1.2  0.5 ! A.253 at 2.80e+06
assign (resid  86 and name   HN) (resid  87 and name   HA)  5.0  3.2  1.0 ! A.927 at 4.60e+05
assign (resid  86 and name   HN) (resid  87 and name HG1#)  5.0  3.2  2.0 ! A.931 at 4.85e+05
assign (resid  86 and name   HN) (resid  87 and name HD1#)  4.0  2.2  2.0 ! C.1239 at 3.45e+05
assign (resid  86 and name   HA) (resid  87 and name   HN)  4.0  2.2  1.0 ! A.944 at 5.96e+05

! I87 
assign (resid  87 and name   HN) (resid  87 and name   HB)  3.0  1.2  0.5 ! A.947 at 2.64e+06
assign (resid  87 and name   HN) (resid  87 and name HG1#)  4.0  2.2  2.0 ! A.948 at 1.13e+06
assign (resid  87 and name   HN) (resid  87 and name HG2#)  5.0  3.2  2.0 ! A.950 at 4.93e+05
assign (resid  87 and name   HN) (resid  87 and name HD1#)  4.0  2.2  2.0 ! B.880 at 5.25e+05
assign (resid  87 and name   HA) (resid  87 and name HG1#)  3.0  1.2  1.3 ! A.690 at 4.96e+05
assign (resid  87 and name   HA) (resid  87 and name HG2#)  2.5  0.7  1.2 ! A.699 at 3.60e+06
assign (resid  87 and name   HA) (resid  87 and name HD1#)  3.0  1.2  1.3 ! A.700 at 8.51e+05
assign (resid  87 and name   HB) (resid  87 and name HD1#)  2.5  0.7  1.2 ! A.704 at 1.77e+06
assign (resid  87 and name   HA) (resid  88 and name  HG#)  4.0  2.2  1.3 ! A.2615 at 4.82e+05
assign (resid  87 and name   HA) (resid  88 and name  HD#)  3.0  1.2  1.2 ! A.688 at 1.96e+06
assign (resid  87 and name HG2#) (resid  88 and name  HD#)  4.0  2.2  3.0 ! A.3696 at 4.23e+05
assign (resid  87 and name   HA) (resid  89 and name   HN)  4.0  2.2  1.0 ! A.955 at 1.38e+06
assign (resid  87 and name HG2#) (resid  89 and name   HN)  3.0  1.2  1.5 ! A.960 at 3.01e+06
assign (resid  87 and name   HB) (resid  90 and name   HN)  4.0  2.2  1.0 ! A.969 at 6.79e+05
assign (resid  87 and name   HB) (resid  90 and name   HA)  4.0  2.2  1.0 ! A.3658 at 3.09e+05
assign (resid  87 and name   HB) (resid  90 and name  HB#)  4.0  2.2  1.3 ! A.3663 at 7.48e+05
assign (resid  87 and name   HB) (resid  90 and name  HD#)  3.0  1.2  2.7 ! A.3656 at 4.76e+05
assign (resid  87 and name HG1#) (resid  90 and name   HN)  5.0  3.2  2.0 ! B.1590 at 3.53e+05
assign (resid  87 and name HG2#) (resid  90 and name   HN)  3.0  1.2  1.5 ! A.970 at 2.39e+06
assign (resid  87 and name HG2#) (resid  90 and name   HA)  3.0  1.2  1.2 ! B.6146 at 6.32e+05
assign (resid  87 and name HG2#) (resid  90 and name  HB#)  2.5  0.7  2.2 ! A.3671 at 1.28e+06
assign (resid  87 and name HG2#) (resid  90 and name  HD#)  2.5  0.7  3.6 ! A.3669 at 9.85e+05
assign (resid  87 and name HD1#) (resid  90 and name  HD#)  3.0  1.2  3.7 ! A.3675 at 5.69e+05

! P88 
assign (resid  88 and name   HA) (resid  89 and name  HB#)  4.0  2.2  2.0 ! A.3679 at 3.94e+05
assign (resid  88 and name  HB#) (resid  89 and name   HN)  4.0  2.2  2.0 ! A.959 at 9.76e+05
assign (resid  88 and name  HG#) (resid  89 and name   HN)  4.0  2.2  2.0 ! A.961 at 6.22e+05
assign (resid  88 and name  HD#) (resid  89 and name   HN)  3.0  1.2  1.5 ! C.428 at 7.19e+05

! S89 
assign (resid  89 and name   HN) (resid  89 and name  HB#)  4.0  2.2  2.0 ! A.958 at 1.48e+06
assign (resid  89 and name   HN) (resid  90 and name   HN)  3.0  1.2  0.5 ! A.963 at 1.60e+06
assign (resid  89 and name   HA) (resid  90 and name   HN)  4.0  2.2  1.0 ! C.433 at 6.31e+05
assign (resid  89 and name  HB#) (resid  90 and name   HN)  4.0  2.2  2.0 ! A.965 at 5.80e+05

! Y90 
assign (resid  90 and name   HN) (resid  90 and name  HB#)  2.5  0.7  1.4 ! A.966 at 3.31e+06
assign (resid  90 and name   HN) (resid  90 and name  HD#)  4.0  2.2  3.4 ! C.891 at -5.25e+05
assign (resid  90 and name   HA) (resid  90 and name  HD#)  3.0  1.2  2.7 ! A.3710 at 5.27e+05
assign (resid  90 and name   HA) (resid  90 and name  HE#)  2.5  0.7  2.6 ! A.3701 at 9.82e+05
assign (resid  90 and name  HB#) (resid  90 and name  HD#)  3.0  1.2  3.6 ! A.728 at 1.06e+06
assign (resid  90 and name   HN) (resid  91 and name   HN)  4.0  2.2  1.0 ! D.431 at 3.15e+05
assign (resid  90 and name   HA) (resid  91 and name   HN)  2.5  0.7  0.4 ! A.256 at 5.95e+06
assign (resid  90 and name  HB#) (resid  91 and name   HN)  4.0  2.2  2.0 ! A.976 at 5.09e+05
assign (resid  90 and name  HD#) (resid  91 and name   HN)  4.0  2.2  3.4 ! B.1272 at 7.72e+05
assign (resid  90 and name  HE#) (resid  91 and name  HG#)  4.0  2.2  3.7 ! B.11243 at -2.44e+05
assign (resid  90 and name  HD#) (resid  92 and name   HA)  3.0  1.2  2.7 ! A.3735 at 7.26e+05
assign (resid  90 and name  HD#) (resid  92 and name HG2#)  3.0  1.2  3.7 ! A.3711 at 5.34e+05
assign (resid  90 and name  HE#) (resid  92 and name   HA)  2.5  0.7  2.6 ! A.2182 at 1.70e+06
assign (resid  90 and name  HE#) (resid  92 and name HG1#)  3.0  1.2  3.7 ! A.2197 at 8.29e+05
assign (resid  90 and name  HE#) (resid  92 and name HG2#)  2.5  0.7  3.6 ! A.2161 at 1.30e+06
assign (resid  90 and name  HE#) (resid  93 and name   HN)  5.0  3.2  3.4 ! B.1600 at 3.46e+05

! R91 
assign (resid  91 and name   HN) (resid  91 and name  HB#)  3.0  1.2  1.5 ! A.977 at 3.08e+06
assign (resid  91 and name   HN) (resid  91 and name  HG#)  5.0  3.2  2.0 ! B.899 at 3.91e+05
assign (resid  91 and name   HA) (resid  91 and name  HG#)  4.0  2.2  1.3 ! A.3664 at 7.64e+05
assign (resid  91 and name   HA) (resid  91 and name  HD#)  4.0  2.2  1.2 ! A.2169 at 1.01e+06
assign (resid  91 and name  HB#) (resid  91 and name  HD#)  3.0  1.2  2.2 ! A.2178 at 1.46e+06
assign (resid  91 and name  HB#) (resid  91 and name   HE)  4.0  2.2  2.0 ! A.778 at -9.27e+05
assign (resid  91 and name  HG#) (resid  91 and name   HE)  4.0  2.2  2.0 ! A.981 at -7.35e+05
assign (resid  91 and name   HA) (resid  92 and name   HN)  2.5  0.7  0.4 ! A.984 at 5.73e+06
assign (resid  91 and name   HA) (resid  92 and name HG2#)  4.0  2.2  2.0 ! A.3718 at 4.18e+05
assign (resid  91 and name  HB#) (resid  92 and name   HN)  5.0  3.2  2.0 ! A.988 at 4.81e+05
assign (resid  91 and name  HG#) (resid  92 and name   HN)  4.0  2.2  2.0 ! C.442 at 6.79e+05

! V92 
assign (resid  92 and name   HN) (resid  92 and name   HB)  3.0  1.2  0.5 ! A.986 at 1.92e+06
assign (resid  92 and name   HN) (resid  92 and name HG1#)  4.0  2.2  2.0 ! B.906 at 6.18e+05
assign (resid  92 and name   HN) (resid  92 and name HG2#)  3.0  1.2  1.5 ! A.987 at 2.62e+06
assign (resid  92 and name   HA) (resid  92 and name HG1#)  2.5  0.7  1.2 ! A.2184 at 1.60e+06
assign (resid  92 and name   HA) (resid  92 and name HG2#)  2.5  0.7  1.2 ! A.2185 at 1.42e+06
assign (resid  92 and name   HN) (resid  93 and name   HN)  5.0  3.2  1.0 ! B.2149 at 2.05e+05
assign (resid  92 and name   HA) (resid  93 and name   HN)  2.5  0.7  0.4 ! A.992 at 3.35e+06
assign (resid  92 and name HG1#) (resid  93 and name   HN)  3.0  1.2  1.5 ! A.996 at 1.79e+06
assign (resid  92 and name HG1#) (resid  96 and name   HN)  4.0  2.2  2.0 ! A.1012 at 7.76e+05
assign (resid  92 and name HG1#) (resid  96 and name   HA)  4.0  2.2  2.0 ! A.2201 at 4.37e+05
assign (resid  92 and name HG1#) (resid  98 and name HD1#)  2.5  0.7  2.2 ! A.3746 at 3.13e+06
assign (resid  92 and name HG2#) (resid  98 and name HD1#)  2.5  0.7  2.2 ! A.3749 at 3.13e+06
assign (resid  92 and name   HB) (resid 135 and name  HD#)  4.0  2.2  2.7 ! A.2187 at 5.78e+05
assign (resid  92 and name HG1#) (resid 135 and name  HB#)  4.0  2.2  3.0 ! A.4209 at 3.68e+05
assign (resid  92 and name HG1#) (resid 135 and name  HD#)  2.5  0.7  3.6 ! A.2195 at 1.54e+06
assign (resid  92 and name HG1#) (resid 135 and name  HE#)  3.0  1.2  3.7 ! A.4225 at 7.13e+05

! K93 
assign (resid  93 and name   HN) (resid  93 and name  HB#)  4.0  2.2  2.0 ! A.995 at 1.45e+06
assign (resid  93 and name   HN) (resid  93 and name  HG#)  3.0  1.2  1.5 ! B.912 at 1.27e+06
assign (resid  93 and name   HN) (resid  93 and name  HD#)  4.0  2.2  2.0 ! C.448 at 3.95e+05
assign (resid  93 and name   HA) (resid  93 and name  HG#)  3.0  1.2  1.3 ! A.2220 at 7.99e+05
assign (resid  93 and name   HA) (resid  94 and name  HD#)  3.0  1.2  1.2 ! A.733 at 1.93e+06
assign (resid  93 and name  HB#) (resid  94 and name  HD#)  3.0  1.2  2.3 ! A.2216 at 5.06e+05
assign (resid  93 and name   HN) (resid  96 and name   HN)  5.0  3.2  1.0 ! B.1907 at 2.54e+05
assign (resid  93 and name   HN) (resid  96 and name  HB#)  4.0  2.2  2.0 ! C.1139 at 6.97e+05
assign (resid  93 and name   HN) (resid  96 and name  HG#)  4.0  2.2  2.0 ! A.993 at 1.12e+06
assign (resid  93 and name   HA) (resid 135 and name  HE#)  4.0  2.2  2.7 ! A.2560 at 7.07e+05

! P94 
assign (resid  94 and name   HA) (resid  94 and name  HG#)  4.0  2.2  2.0 ! A.738 at 4.02e+05
assign (resid  94 and name   HA) (resid  94 and name  HD#)  2.5  0.7  1.2 ! A.3759 at 9.36e+05
assign (resid  94 and name  HB#) (resid  94 and name  HD#)  3.0  1.2  2.3 ! A.2229 at 6.41e+05
assign (resid  94 and name   HA) (resid  95 and name   HN)  2.5  0.7  0.4 ! A.1000 at 5.69e+06
assign (resid  94 and name  HB#) (resid  95 and name   HN)  5.0  3.2  2.0 ! A.1003 at 4.15e+05
assign (resid  94 and name   HA) (resid  96 and name   HN)  4.0  2.2  1.0 ! A.1008 at 8.62e+05
assign (resid  94 and name   HA) (resid 135 and name   HN)  5.0  3.2  1.0 
assign (resid  94 and name   HA) (resid 135 and name  HB#)  3.0  1.2  1.3 ! A.3761 at 5.09e+05
assign (resid  94 and name   HA) (resid 135 and name  HD#)  4.0  2.2  3.4 ! A.4213 at 4.09e+05
assign (resid  94 and name  HB#) (resid 137 and name   HA)  3.0  1.2  1.3 
assign (resid  94 and name  HG#) (resid 138 and name HD2#)  2.5  0.7  2.2 ! A.5228 at 1.23e+06
assign (resid  94 and name  HD#) (resid 138 and name HD2#)  3.0  1.2  2.2 ! A.5291 at 2.04e+06

! G95 
assign (resid  95 and name   HN) (resid  96 and name   HN)  3.0  1.2  0.5 ! A.191 at 1.85e+06
assign (resid  95 and name   HN) (resid  96 and name  HG#)  5.0  3.2  2.0 ! A.1645 at 4.33e+05
assign (resid  95 and name  HA#) (resid  96 and name   HN)  4.0  2.2  2.0 ! A.1009 at 1.32e+06
assign (resid  95 and name   HN) (resid 134 and name HG2#)  4.0  2.2  2.0 ! A.1643 at 6.24e+05
assign (resid  95 and name  HA#) (resid 134 and name HG2#)  4.0  2.2  3.0 ! A.3777 at 4.00e+05
assign (resid  95 and name   HN) (resid 136 and name   HA)  4.0  2.2  1.0 ! C.1243 at 4.13e+05

! Q96 
assign (resid  96 and name   HN) (resid  96 and name  HB#)  4.0  2.2  2.0 ! A.1011 at 1.13e+06
assign (resid  96 and name   HN) (resid  96 and name  HG#)  2.5  0.7  1.4 ! A.1010 at 4.55e+06
assign (resid  96 and name   HA) (resid  96 and name  HG#)  3.0  1.2  1.3 ! A.755 at 6.31e+05
assign (resid  96 and name  HG#) (resid  96 and name HE2#)  4.0  2.2  3.0 ! A.1018 at 9.69e+05
assign (resid  96 and name   HN) (resid  97 and name   HN)  5.0  3.2  1.0 ! B.237 at 2.61e+05
assign (resid  96 and name   HA) (resid  97 and name   HN)  2.5  0.7  0.4 ! A.1025 at 5.17e+06
assign (resid  96 and name  HB#) (resid  97 and name   HN)  3.0  1.2  1.5 ! A.1031 at 1.60e+06
assign (resid  96 and name  HG#) (resid  97 and name   HN)  4.0  2.2  2.0 ! A.1030 at 1.54e+06
assign (resid  96 and name   HN) (resid 134 and name HG2#)  4.0  2.2  2.0 ! A.1013 at 6.82e+05

! T97 
assign (resid  97 and name   HN) (resid  97 and name   HB)  3.0  1.2  0.5 ! A.1029 at 1.65e+06
assign (resid  97 and name   HN) (resid  97 and name HG2#)  4.0  2.2  2.0 ! A.1032 at 9.10e+05
assign (resid  97 and name   HA) (resid  97 and name HG2#)  2.5  0.7  1.2 ! A.759 at 1.66e+06
assign (resid  97 and name   HN) (resid  98 and name   HN)  5.0  3.2  1.0 ! A.1024 at 3.62e+05
assign (resid  97 and name   HA) (resid  98 and name   HN)  3.0  1.2  0.5 ! A.1036 at 3.11e+06
assign (resid  97 and name   HA) (resid  98 and name   HB)  4.0  2.2  1.0 ! A.3782 at 4.00e+05
assign (resid  97 and name   HB) (resid  98 and name   HN)  4.0  2.2  1.0 ! A.1039 at 1.02e+06
assign (resid  97 and name HG2#) (resid  98 and name   HN)  4.0  2.2  2.0 ! A.1043 at 7.33e+05
assign (resid  97 and name HG2#) (resid  99 and name  HB#)  2.5  0.7  2.2 ! B.5844 at 6.13e+05
assign (resid  97 and name   HB) (resid 132 and name  HB#)  4.0  2.2  2.0 
assign (resid  97 and name   HB) (resid 132 and name  HG#)  3.0  1.2  1.2 ! A.3788 at 1.09e+06
assign (resid  97 and name HG2#) (resid 132 and name   HA)  4.0  2.2  2.0 ! A.3411 at 2.52e+05
assign (resid  97 and name HG2#) (resid 132 and name  HB#)  3.0  1.2  2.3 ! A.2252 at 9.06e+05
assign (resid  97 and name HG2#) (resid 132 and name  HG#)  3.0  1.2  2.3 ! A.4196 at 9.09e+05
assign (resid  97 and name   HA) (resid 133 and name   HN)  5.0  3.2  1.0 ! A.1647 at 3.89e+05
assign (resid  97 and name HG2#) (resid 133 and name   HN)  5.0  3.2  2.0 ! A.1648 at 3.60e+05
assign (resid  97 and name   HA) (resid 134 and name   HA)  2.5  0.7  0.2 ! A.1008 at 2.71e+06
assign (resid  97 and name   HA) (resid 134 and name   HB)  4.0  2.2  1.0 ! A.4670 at 3.27e+05
assign (resid  97 and name   HA) (resid 134 and name HG2#)  3.0  1.2  1.3 ! A.2240 at 6.44e+05
assign (resid  97 and name   HB) (resid 134 and name   HA)  4.0  2.2  1.0 ! A.2245 at 1.23e+06
assign (resid  97 and name   HB) (resid 134 and name HG2#)  4.0  2.2  2.0 ! A.3786 at 4.03e+05
assign (resid  97 and name HG2#) (resid 134 and name   HN)  5.0  3.2  2.0 ! A.1410 at 4.51e+05
assign (resid  97 and name HG2#) (resid 134 and name   HA)  3.0  1.2  1.3 ! A.1012 at 1.03e+06
assign (resid  97 and name HG2#) (resid 134 and name HG2#)  3.0  1.2  2.3 ! A.5305 at 2.28e+06
assign (resid  97 and name   HN) (resid 135 and name   HN)  4.0  2.2  1.0 ! D.682 at 3.90e+05
assign (resid  97 and name   HA) (resid 135 and name   HN)  4.0  2.2  1.0 ! A.1422 at 7.04e+05
assign (resid  97 and name HG2#) (resid 135 and name   HN)  5.0  3.2  2.0 ! B.1976 at 3.75e+05

! I98 
assign (resid  98 and name   HN) (resid  98 and name   HB)  3.0  1.2  0.5 ! A.1042 at 1.78e+06
assign (resid  98 and name   HN) (resid  98 and name HG1#)  3.0  1.2  1.5 ! C.470 at 8.13e+05
assign (resid  98 and name   HN) (resid  98 and name HG2#)  4.0  2.2  2.0 ! A.1041 at 7.69e+05
assign (resid  98 and name   HN) (resid  98 and name HD1#)  4.0  2.2  2.0 ! A.1040 at 7.69e+05
assign (resid  98 and name   HA) (resid  98 and name HG1#)  3.0  1.2  1.3 
assign (resid  98 and name   HA) (resid  98 and name HG2#)  3.0  1.2  1.2 ! A.779 at 2.74e+06
assign (resid  98 and name   HA) (resid  98 and name HD1#)  3.0  1.2  1.3 ! A.782 at 7.78e+05
assign (resid  98 and name   HB) (resid  98 and name HD1#)  2.5  0.7  1.2 ! A.787 at 4.88e+06
assign (resid  98 and name   HN) (resid  99 and name   HN)  4.0  2.2  1.0 
assign (resid  98 and name   HA) (resid  99 and name   HN)  2.5  0.7  0.4 ! A.1046 at 5.06e+06
assign (resid  98 and name   HA) (resid  99 and name   HA)  4.0  2.2  1.0 ! A.3813 at 4.06e+05
assign (resid  98 and name   HA) (resid  99 and name  HB#)  4.0  2.2  2.0 ! A.4757 at 1.38e+06
assign (resid  98 and name HG2#) (resid  99 and name   HN)  3.0  1.2  1.5 ! A.1050 at 2.11e+06
assign (resid  98 and name HG2#) (resid  99 and name   HA)  4.0  2.2  2.0 ! A.2255 at 4.22e+05
assign (resid  98 and name   HN) (resid 133 and name   HN)  4.0  2.2  1.0 ! A.1035 at 8.87e+05
assign (resid  98 and name HG2#) (resid 133 and name   HN)  4.0  2.2  2.0 ! A.1397 at 1.02e+06
assign (resid  98 and name   HN) (resid 134 and name   HA)  4.0  2.2  1.0 ! A.1037 at 8.61e+05
assign (resid  98 and name HD1#) (resid 135 and name  HD#)  3.0  1.2  3.7 ! A.3805 at 4.97e+05

! A99 
assign (resid  99 and name   HN) (resid  99 and name  HB#)  3.0  1.2  1.5 ! A.1048 at 2.46e+06
assign (resid  99 and name   HN) (resid 100 and name   HN)  5.0  3.2  1.0 ! A.1650 at 3.41e+05
assign (resid  99 and name   HA) (resid 100 and name   HN)  2.5  0.7  0.4 ! A.1055 at 5.18e+06
assign (resid  99 and name   HA) (resid 100 and name HG2#)  4.0  2.2  2.0 ! A.5342 at 4.14e+05
assign (resid  99 and name  HB#) (resid 100 and name   HN)  3.0  1.2  1.5 ! A.1059 at 3.08e+06
assign (resid  99 and name   HA) (resid 132 and name   HA)  2.5  0.7  0.2 ! A.996 at 2.07e+06
assign (resid  99 and name   HA) (resid 132 and name  HB#)  3.0  1.2  1.3 ! A.2536 at 5.84e+05
assign (resid  99 and name   HA) (resid 132 and name  HG#)  4.0  2.2  2.0 ! A.3816 at 4.02e+05
assign (resid  99 and name  HB#) (resid 132 and name   HA)  2.5  0.7  1.2 ! A.1683 at 2.69e+06
assign (resid  99 and name  HB#) (resid 132 and name  HB#)  2.5  0.7  2.2 ! A.2541 at 1.63e+06
assign (resid  99 and name  HB#) (resid 132 and name  HG#)  3.0  1.2  2.2 ! A.3823 at 1.26e+06
assign (resid  99 and name   HN) (resid 133 and name   HN)  4.0  2.2  1.0 ! D.656 at 3.55e+05
assign (resid  99 and name   HA) (resid 133 and name   HN)  4.0  2.2  1.0 ! C.950 at 5.04e+05
assign (resid  99 and name  HB#) (resid 133 and name   HN)  4.0  2.2  2.0 ! A.1398 at 8.97e+05

! V100
assign (resid 100 and name   HN) (resid 100 and name   HB)  2.5  0.7  0.4 ! A.1058 at 3.37e+06
assign (resid 100 and name   HN) (resid 100 and name HG2#)  2.5  0.7  1.4 ! A.1060 at 3.86e+06
assign (resid 100 and name   HA) (resid 100 and name HG1#)  2.5  0.7  1.2 ! A.2273 at 2.92e+06
assign (resid 100 and name   HA) (resid 100 and name HG2#)  2.5  0.7  1.2 ! A.800 at 2.71e+06
assign (resid 100 and name   HN) (resid 101 and name   HN)  5.0  3.2  1.0 ! A.1649 at 3.81e+05
assign (resid 100 and name   HA) (resid 101 and name   HN)  2.5  0.7  0.4 ! A.1066 at 5.52e+06
assign (resid 100 and name  HG*) (resid 101 and name   HN)  3.0  1.2  2.5 ! B.963 at 1.66e+06
assign (resid 100 and name HG1#) (resid 101 and name   HN)  3.0  1.2  1.5 ! A.1073 at 1.94e+06
assign (resid 100 and name HG2#) (resid 101 and name   HN)  4.0  2.2  2.0 ! C.491 at 6.95e+05
assign (resid 100 and name  HG*) (resid 104 and name   HN)  4.0  2.2  3.0 ! B.1327 at 5.31e+05
assign (resid 100 and name HG1#) (resid 104 and name  HB1)  3.0  1.2  1.3 ! A.2317 at 7.65e+05
assign (resid 100 and name HG1#) (resid 104 and name  HB2)  4.0  2.2  1.3 ! A.2319 at 8.07e+05
assign (resid 100 and name HG1#) (resid 105 and name   HN)  4.0  2.2  2.0 ! A.1111 at 8.31e+05
assign (resid 100 and name HG1#) (resid 105 and name   HA)  2.5  0.7  1.2 ! A.2336 at 1.83e+06
assign (resid 100 and name HG1#) (resid 105 and name  HG#)  3.0  1.2  2.3 ! A.3840 at 7.56e+05
assign (resid 100 and name HG1#) (resid 105 and name  HD#)  3.0  1.2  2.3 ! A.3835 at 6.11e+05
assign (resid 100 and name HG1#) (resid 110 and name HD1#)  2.5  0.7  2.2 ! A.5339 at 5.28e+06
assign (resid 100 and name HG2#) (resid 110 and name HG2#)  2.5  0.7  2.2 
assign (resid 100 and name HG2#) (resid 110 and name HD1#)  2.5  0.7  2.2 ! A.3851 at 5.34e+06
assign (resid 100 and name   HN) (resid 131 and name  HB#)  4.0  2.2  2.0 ! A.1063 at 7.10e+05
assign (resid 100 and name HG1#) (resid 131 and name  HB#)  3.0  1.2  2.3 ! A.4181 at 6.28e+05
assign (resid 100 and name HG1#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! A.3838 at 8.07e+06
assign (resid 100 and name HG2#) (resid 131 and name   HA)  4.0  2.2  2.0 ! A.4175 at 4.08e+05
assign (resid 100 and name HG2#) (resid 131 and name  HB#)  3.0  1.2  2.3 ! A.4179 at 7.16e+05
assign (resid 100 and name HG2#) (resid 131 and name  HG#)  3.0  1.2  2.2 ! A.5346 at 1.10e+06
assign (resid 100 and name HG2#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! B.3286 at 1.22e+06
assign (resid 100 and name   HN) (resid 132 and name   HA)  4.0  2.2  1.0 ! A.1056 at 5.32e+05

! R101
assign (resid 101 and name   HN) (resid 101 and name  HB#)  4.0  2.2  2.0 ! A.1070 at 1.27e+06
assign (resid 101 and name   HN) (resid 101 and name  HG#)  4.0  2.2  2.0 ! A.1071 at 5.62e+05
assign (resid 101 and name   HN) (resid 101 and name  HD#)  5.0  3.2  2.0 ! B.1325 at 2.98e+05
assign (resid 101 and name   HA) (resid 101 and name  HG#)  3.0  1.2  1.3 ! B.11412 at 3.90e+05
assign (resid 101 and name   HA) (resid 101 and name  HD#)  4.0  2.2  1.3 ! A.3868 at 8.19e+05
assign (resid 101 and name  HB#) (resid 101 and name  HD#)  3.0  1.2  2.2 ! A.2303 at 3.71e+06
assign (resid 101 and name   HA) (resid 102 and name   HN)  2.5  0.7  0.4 ! A.1079 at 6.37e+06
assign (resid 101 and name   HA) (resid 102 and name   HA)  4.0  2.2  1.0 ! A.3854 at 2.86e+05
assign (resid 101 and name  HB#) (resid 102 and name   HN)  3.0  2.2  2.0 ! A.1082 at 2.48e+06
assign (resid 101 and name  HG#) (resid 102 and name   HN)  5.0  3.2  2.0 ! A.1084 at 3.93e+05
assign (resid 101 and name  HD#) (resid 102 and name   HN)  4.0  2.2  2.0 ! C.908 at 4.81e+05
assign (resid 101 and name   HN) (resid 104 and name  HB2)  5.0  3.2  1.0 ! B.1922 at 2.54e+05
assign (resid 101 and name  HG#) (resid 104 and name   HN)  3.0  1.2  1.5 ! C.911 at 1.11e+06
assign (resid 101 and name  HG#) (resid 104 and name  HB2)  4.0  2.2  2.0 ! A.3863 at 3.91e+05

! E102
assign (resid 102 and name   HN) (resid 102 and name  HB#)  2.5  0.7  1.4 ! A.1081 at 3.81e+06
assign (resid 102 and name   HN) (resid 102 and name  HG#)  3.0  1.2  1.5 ! C.497 at 1.19e+06
assign (resid 102 and name   HA) (resid 102 and name  HG#)  2.5  0.7  1.2 ! A.2886 at 2.17e+06
assign (resid 102 and name   HN) (resid 103 and name   HN)  5.0  3.2  1.0 ! A.1077 at 4.96e+05
assign (resid 102 and name   HA) (resid 103 and name   HN)  4.0  2.2  1.0 ! A.210 at 5.22e+05
assign (resid 102 and name  HB#) (resid 103 and name   HN)  3.0  1.2  1.5 ! B.1931 at 2.35e+06
assign (resid 102 and name  HB#) (resid 103 and name  HE#)  3.0  1.2  2.3 ! B.12201 at -3.47e+05
assign (resid 102 and name  HG#) (resid 103 and name   HN)  4.0  2.2  2.0 ! C.504 at 7.05e+05
assign (resid 102 and name   HA) (resid 104 and name   HN)  5.0  3.2  1.0 ! A.1098 at 3.89e+05
assign (resid 102 and name   HA) (resid 105 and name  HB#)  3.0  1.2  1.3 ! B.9499 at 2.09e+05
assign (resid 102 and name   HA) (resid 105 and name  HG#)  2.5  0.7  1.2 ! A.5129 at 1.29e+06
assign (resid 102 and name   HA) (resid 105 and name  HD#)  2.5  0.7  1.2 ! A.5127 at 1.46e+06
assign (resid 102 and name   HA) (resid 105 and name   HE)  5.0  3.2  1.0 
assign (resid 102 and name  HG#) (resid 105 and name  HD#)  3.0  1.2  2.3 ! B.5950 at 2.80e+05

! K103
assign (resid 103 and name   HN) (resid 103 and name  HB#)  3.0  1.2  1.5 ! A.216 at 3.25e+06
assign (resid 103 and name   HN) (resid 103 and name  HG#)  4.0  2.2  2.0 ! A.215 at 1.56e+06
assign (resid 103 and name   HN) (resid 103 and name  HE#)  4.0  2.2  2.0 ! C.503 at 3.66e+05
assign (resid 103 and name   HA) (resid 103 and name  HG#)  2.5  0.7  1.2 ! A.3897 at 2.13e+06
assign (resid 103 and name   HA) (resid 103 and name  HD#)  3.0  1.2  1.2 ! A.2314 at 2.29e+06
assign (resid 103 and name   HA) (resid 103 and name  HE#)  3.0  1.2  1.3 ! A.3905 at 7.90e+05
assign (resid 103 and name  HB#) (resid 103 and name  HD#)  2.5  0.7  2.2 ! B.1235 at 1.50e+06
assign (resid 103 and name  HB#) (resid 103 and name  HE#)  4.0  2.2  3.0 ! A.3899 at 4.13e+05
assign (resid 103 and name  HG#) (resid 103 and name  HE#)  2.5  0.7  2.2 ! A.4447 at 7.01e+06
assign (resid 103 and name   HN) (resid 104 and name   HN)  4.0  2.2  1.0 ! A.205 at 1.11e+06
assign (resid 103 and name   HA) (resid 104 and name   HN)  4.0  2.2  1.0 ! A.1097 at 1.26e+06
assign (resid 103 and name  HB#) (resid 104 and name   HN)  4.0  2.2  2.0 ! A.1100 at 1.21e+06
assign (resid 103 and name  HG#) (resid 104 and name   HN)  4.0  2.2  2.0 ! A.1101 at 1.57e+06

! S104
assign (resid 104 and name   HN) (resid 104 and name  HB1)  4.0  2.2  1.0 ! A.1095 at 1.28e+06
assign (resid 104 and name   HN) (resid 104 and name  HB2)  3.0  1.2  0.5 ! A.1096 at 2.36e+06
assign (resid 104 and name   HN) (resid 105 and name   HN)  3.0  1.2  0.5 ! A.1105 at 2.90e+06
assign (resid 104 and name   HA) (resid 105 and name   HN)  4.0  2.2  1.0 ! B.988 at 5.33e+05
assign (resid 104 and name  HB1) (resid 105 and name   HN)  5.0  3.2  1.0 ! B.989 at 2.88e+05
assign (resid 104 and name   HA) (resid 106 and name   HN)  4.0  2.2  1.0 
assign (resid 104 and name   HA) (resid 107 and name   HN)  4.0  2.2  1.0 ! A.1652 at 5.88e+05
assign (resid 104 and name   HA) (resid 107 and name   HG)  3.0  1.2  0.2 ! A.2329 at 1.40e+06
assign (resid 104 and name   HA) (resid 107 and name HD1#)  2.5  0.7  1.2 ! A.1993 at 1.25e+06
assign (resid 104 and name   HA) (resid 107 and name HD2#)  3.0  1.2  1.3 ! A.3365 at 6.27e+05
assign (resid 104 and name  HB1) (resid 107 and name HD1#)  3.0  1.2  1.2 ! A.836 at 5.08e+06
assign (resid 104 and name  HB2) (resid 107 and name HD1#)  4.0  2.2  2.0 ! A.2334 at 3.89e+05

! R105
assign (resid 105 and name   HN) (resid 105 and name  HB#)  3.0  1.2  1.5 ! A.1109 at 2.99e+06
assign (resid 105 and name   HN) (resid 105 and name  HG#)  3.0  1.2  1.5 ! B.987 at 1.96e+06
assign (resid 105 and name   HN) (resid 105 and name  HD#)  4.0  2.2  2.0 ! A.1108 at 6.23e+05
assign (resid 105 and name   HA) (resid 105 and name  HG#)  2.5  0.7  1.2 ! A.2974 at 2.56e+06
assign (resid 105 and name   HA) (resid 105 and name  HD#)  3.0  1.2  1.3 ! A.3908 at 6.29e+05
assign (resid 105 and name  HB#) (resid 105 and name  HD#)  2.5  0.7  2.2 ! A.2323 at 4.65e+06
assign (resid 105 and name  HB#) (resid 105 and name   HE)  4.0  2.2  2.0 ! A.1114 at -1.45e+06
assign (resid 105 and name  HG#) (resid 105 and name   HE)  4.0  2.2  2.0 ! A.1115 at -8.15e+05
assign (resid 105 and name   HN) (resid 106 and name   HN)  4.0  2.2  1.0 ! A.1104 at 1.34e+06
assign (resid 105 and name   HA) (resid 106 and name   HN)  4.0  2.2  1.0 ! A.1120 at 8.98e+05
assign (resid 105 and name   HA) (resid 106 and name   HA)  4.0  2.2  1.0 ! A.3910 at 3.63e+05
assign (resid 105 and name  HB#) (resid 106 and name   HN)  5.0  3.2  2.0 ! A.1123 at 4.96e+05
assign (resid 105 and name  HG#) (resid 106 and name   HN)  4.0  2.2  2.0 ! A.1122 at 9.85e+05
assign (resid 105 and name   HA) (resid 107 and name   HN)  4.0  2.2  1.0 ! A.1133 at 5.84e+05
assign (resid 105 and name   HA) (resid 131 and name  HE#)  2.5  0.7  1.2 ! A.4186 at 5.35e+06
assign (resid 105 and name  HD#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! A.4190 at 1.83e+06

! N106
assign (resid 106 and name   HN) (resid 106 and name  HB1)  3.0  1.2  0.5 ! A.1121 at 1.67e+06
assign (resid 106 and name   HN) (resid 106 and name  HB2)  3.0  1.2  0.5 ! A.1021 at 3.02e+06
assign (resid 106 and name  HB1) (resid 106 and name HD2#)  5.0  3.2  2.0 ! B.1623 at 2.56e+05
assign (resid 106 and name  HB2) (resid 106 and name HD2#)  4.0  2.2  2.0 ! A.1127 at 1.34e+06
assign (resid 106 and name   HN) (resid 107 and name   HN)  3.0  1.2  0.5 ! A.1129 at 3.17e+06
assign (resid 106 and name   HN) (resid 107 and name   HA)  5.0  3.2  1.0 ! B.1618 at 2.99e+05
assign (resid 106 and name   HN) (resid 107 and name HD1#)  5.0  3.2  2.0 ! B.2114 at 2.97e+05
assign (resid 106 and name   HN) (resid 107 and name HD2#)  4.0  2.2  2.0 ! C.1276 at 5.19e+05
assign (resid 106 and name   HA) (resid 107 and name   HN)  4.0  2.2  1.0 ! A.1131 at 1.23e+06
assign (resid 106 and name  HB2) (resid 107 and name   HN)  4.0  2.2  1.0 ! A.1134 at 5.16e+05
assign (resid 106 and name   HA) (resid 111 and name  HB#)  4.0  2.2  2.0 ! A.5367 at 4.17e+05
assign (resid 106 and name   HA) (resid 111 and name  HG#)  3.0  1.2  1.2 ! A.4969 at 1.18e+06
assign (resid 106 and name   HA) (resid 111 and name  HD#)  3.0  1.2  1.2 ! A.1685 at 1.61e+06
assign (resid 106 and name   HA) (resid 111 and name  HE#)  3.0  1.2  1.2 ! A.3154 at 1.44e+06

! L107
assign (resid 107 and name   HN) (resid 107 and name  HB1)  4.0  2.2  1.0 ! A.1138 at 1.24e+06
assign (resid 107 and name   HN) (resid 107 and name  HB2)  3.0  1.2  0.5 ! A.1136 at 2.88e+06
assign (resid 107 and name   HN) (resid 107 and name   HG)  3.0  1.2  0.5 ! A.1135 at 2.76e+06
assign (resid 107 and name   HN) (resid 107 and name  HD*)  4.0  2.2  3.0 ! B.1005 at 5.99e+05
assign (resid 107 and name   HN) (resid 107 and name HD1#)  4.0  2.2  2.0 ! A.1139 at 5.46e+05
assign (resid 107 and name   HN) (resid 107 and name HD2#)  3.0  1.2  1.5 ! C.532 at 9.87e+05
assign (resid 107 and name   HA) (resid 107 and name   HG)  3.0  1.2  0.2 ! A.835 at 1.84e+06
assign (resid 107 and name   HA) (resid 107 and name HD1#)  3.0  1.2  1.2 ! B.1267 at 5.04e+05
assign (resid 107 and name   HA) (resid 107 and name HD2#)  2.5  0.7  1.2 ! A.828 at 3.48e+06
assign (resid 107 and name  HB1) (resid 107 and name HD1#)  2.5  0.7  1.2 ! A.834 at 1.92e+06
assign (resid 107 and name  HB1) (resid 107 and name HD2#)  2.5  0.7  1.2 ! A.5372 at 1.81e+06
assign (resid 107 and name  HB2) (resid 107 and name HD1#)  2.5  0.7  1.2 ! A.833 at 2.14e+06
assign (resid 107 and name  HB2) (resid 107 and name HD2#)  2.5  0.7  1.2 
assign (resid 107 and name   HN) (resid 108 and name   HN)  5.0  3.2  1.0 ! B.1939 at 2.97e+05
assign (resid 107 and name   HA) (resid 108 and name   HN)  2.5  0.7  0.4 ! A.1144 at 5.76e+06
assign (resid 107 and name  HB1) (resid 108 and name   HN)  4.0  2.2  1.0 ! A.1149 at 7.57e+05
assign (resid 107 and name HD2#) (resid 108 and name   HN)  5.0  3.2  2.0 ! A.1150 at 4.54e+05
assign (resid 107 and name   HA) (resid 109 and name   HN)  5.0  3.2  1.0 ! A.1161 at 4.17e+05
assign (resid 107 and name   HA) (resid 109 and name  HG*)  4.0  2.2  3.0 ! A.4398 at 3.68e+05
assign (resid 107 and name  HB1) (resid 109 and name   HN)  4.0  2.2  1.0 ! A.1166 at 1.01e+06
assign (resid 107 and name  HB1) (resid 109 and name  HG*)  2.5  0.7  2.2 ! B.8045 at -7.55e+05
assign (resid 107 and name  HB2) (resid 109 and name   HN)  4.0  2.2  1.0 ! A.1168 at 5.27e+05
assign (resid 107 and name HD1#) (resid 109 and name  HG*)  2.5  0.7  3.2 ! A.4688 at 4.28e+06
assign (resid 107 and name HD2#) (resid 109 and name   HN)  5.0  3.2  2.0 ! B.1328 at 3.02e+05
assign (resid 107 and name HD2#) (resid 109 and name  HG*)  2.5  0.7  3.2 ! B.7812 at 2.66e+06
assign (resid 107 and name   HN) (resid 110 and name HD1#)  5.0  3.2  2.0 ! A.1140 at 3.89e+05
assign (resid 107 and name  HB#) (resid 110 and name   HN)  3.0  1.2  1.5 ! C.921 at 7.98e+05
assign (resid 107 and name  HB1) (resid 110 and name HD1#)  3.0  1.2  1.3 ! B.1313 at 3.76e+05
assign (resid 107 and name  HB2) (resid 110 and name HD1#)  3.0  1.2  1.3 ! B.1314 at 3.36e+05
assign (resid 107 and name HD1#) (resid 110 and name   HN)  4.0  2.2  2.0 ! C.558 at 5.21e+05
assign (resid 107 and name HD1#) (resid 110 and name HD1#)  2.5  0.7  2.2 ! A.3971 at 4.28e+06
assign (resid 107 and name HD2#) (resid 110 and name   HN)  5.0  3.2  2.0 ! B.1029 at 3.46e+05

! Q108
assign (resid 108 and name   HN) (resid 108 and name  HB#)  3.0  1.2  1.5 ! A.1146 at 2.84e+06
assign (resid 108 and name   HN) (resid 108 and name  HG#)  4.0  2.2  2.0 ! A.1148 at 5.57e+05
assign (resid 108 and name   HA) (resid 108 and name  HG#)  2.5  0.7  1.2 ! A.2339 at 4.37e+06
assign (resid 108 and name  HG#) (resid 108 and name HE2#)  4.0  2.2  3.0 ! A.1155 at 1.15e+06
assign (resid 108 and name   HN) (resid 109 and name   HN)  4.0  2.2  1.0 ! A.1142 at 1.37e+06
assign (resid 108 and name   HN) (resid 109 and name  HG*)  5.0  3.2  3.0 ! B.1941 at 2.88e+05
assign (resid 108 and name   HA) (resid 109 and name   HN)  3.0  1.2  0.5 ! C.542 at 8.37e+05
assign (resid 108 and name  HB#) (resid 109 and name   HN)  4.0  2.2  2.0 ! A.1163 at 9.45e+05
assign (resid 108 and name  HG#) (resid 109 and name   HN)  4.0  2.2  2.0 ! A.1162 at 6.12e+05
assign (resid 108 and name  HG#) (resid 109 and name  HG*)  3.0  1.2  3.2 ! B.9786 at 5.23e+05
assign (resid 108 and name   HA) (resid 110 and name   HN)  4.0  2.2  1.0 ! A.1173 at 6.76e+05

! V109
assign (resid 109 and name   HN) (resid 109 and name   HB)  2.5  0.7  0.4 ! A.1164 at 5.83e+06
assign (resid 109 and name   HN) (resid 109 and name  HG*)  2.5  0.7  2.4 ! A.1167 at 4.99e+06
assign (resid 109 and name   HA) (resid 109 and name  HG*)  2.5  0.7  2.2 ! A.847 at 4.74e+06
assign (resid 109 and name   HN) (resid 110 and name   HN)  4.0  2.2  1.0 ! A.1171 at 1.02e+06
assign (resid 109 and name   HB) (resid 110 and name   HN)  4.0  2.2  1.0 ! B.1023 at 6.70e+05
assign (resid 109 and name  HG*) (resid 110 and name   HN)  3.0  1.2  2.5 ! A.1177 at 1.65e+06
assign (resid 109 and name  HG*) (resid 110 and name   HA)  3.0  1.2  2.2 ! A.5390 at 2.93e+06
assign (resid 109 and name  HG*) (resid 110 and name HG1#)  3.0  1.2  3.2 ! A.3958 at 2.91e+06
assign (resid 109 and name   HA) (resid 112 and name   HN)  4.0  2.2  1.0 ! A.1087 at 6.64e+05
assign (resid 109 and name   HA) (resid 112 and name  HB#)  3.0  1.2  1.3 ! B.12199 at 4.13e+05
assign (resid 109 and name   HA) (resid 113 and name   HN)  4.0  2.2  1.0 
assign (resid 109 and name  HG*) (resid 113 and name  HB#)  3.0  1.2  3.3 ! B.92 at 3.70e+05

! I110
assign (resid 110 and name   HN) (resid 110 and name   HB)  3.0  1.2  0.5 ! A.1174 at 2.83e+06
assign (resid 110 and name   HN) (resid 110 and name HG1#)  3.0  1.2  1.5 ! A.1175 at 1.87e+06
assign (resid 110 and name   HN) (resid 110 and name HG2#)  3.0  1.2  1.5 ! C.555 at 8.16e+05
assign (resid 110 and name   HN) (resid 110 and name HD1#)  3.0  1.2  1.5 ! C.556 at 7.47e+05
assign (resid 110 and name   HA) (resid 110 and name HG1#)  3.0  1.2  1.2 ! A.854 at 1.21e+06
assign (resid 110 and name   HA) (resid 110 and name HG2#)  2.5  0.7  1.2 ! A.859 at 3.57e+06
assign (resid 110 and name   HA) (resid 110 and name HD1#)  3.0  1.2  1.3 ! B.4165 at -3.43e+05
assign (resid 110 and name   HB) (resid 110 and name HD1#)  2.5  0.7  1.2 ! A.2352 at 2.96e+06
assign (resid 110 and name   HN) (resid 111 and name   HN)  3.0  1.2  0.5 ! A.1170 at 2.30e+06
assign (resid 110 and name   HA) (resid 111 and name   HN)  4.0  2.2  1.0 ! A.1179 at 6.88e+05
assign (resid 110 and name HG2#) (resid 111 and name   HN)  4.0  2.2  2.0 ! A.1183 at 1.10e+06
assign (resid 110 and name HG2#) (resid 111 and name   HA)  3.0  1.2  1.2 ! A.2348 at 2.18e+06
assign (resid 110 and name   HN) (resid 112 and name   HN)  5.0  3.2  1.0 ! B.1634 at 3.46e+05
assign (resid 110 and name   HA) (resid 113 and name   HN)  4.0  2.2  1.0 ! A.1193 at 1.01e+06
assign (resid 110 and name   HA) (resid 113 and name  HB#)  2.5  0.7  1.2 ! A.1296 at 2.84e+06
assign (resid 110 and name HG2#) (resid 113 and name   HN)  5.0  3.2  2.0 ! A.1197 at 4.29e+05
assign (resid 110 and name   HB) (resid 131 and name  HE#)  4.0  2.2  1.2 ! A.4692 at 3.10e+06
assign (resid 110 and name HG2#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! B.3292 at 2.73e+06
assign (resid 110 and name HD1#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! B.9881 at -7.44e+05

! K111
assign (resid 111 and name   HN) (resid 111 and name  HB#)  2.5  0.7  1.4 ! A.1180 at 7.74e+06
assign (resid 111 and name   HN) (resid 111 and name  HG#)  4.0  2.2  2.0 ! A.1182 at 7.68e+05
assign (resid 111 and name   HN) (resid 111 and name  HD#)  4.0  2.2  2.0 ! C.562 at 7.07e+05
assign (resid 111 and name   HA) (resid 111 and name  HG#)  2.5  0.7  1.2 ! A.867 at 1.61e+06
assign (resid 111 and name   HA) (resid 111 and name  HD#)  2.5  0.7  1.2 ! A.2222 at 2.65e+06
assign (resid 111 and name   HA) (resid 111 and name  HE#)  2.5  0.7  1.2 ! A.2358 at 1.54e+06
assign (resid 111 and name  HB#) (resid 111 and name  HD#)  2.5  0.7  2.2 ! B.6930 at 1.09e+06
assign (resid 111 and name  HB#) (resid 111 and name  HE#)  2.5  0.7  2.2 ! A.2360 at 3.03e+06
assign (resid 111 and name  HG#) (resid 111 and name  HE#)  2.5  0.7  2.2 ! A.3979 at 1.47e+06
assign (resid 111 and name   HN) (resid 112 and name   HN)  3.0  1.2  0.5 ! A.1052 at 2.34e+06
assign (resid 111 and name   HA) (resid 112 and name   HN)  3.0  1.2  0.5 ! A.1187 at 2.92e+06
assign (resid 111 and name  HB#) (resid 112 and name   HN)  2.5  0.7  1.4 ! A.219 at 4.62e+06
assign (resid 111 and name  HG#) (resid 112 and name   HN)  3.0  1.2  1.5 ! C.571 at 8.12e+05
assign (resid 111 and name   HA) (resid 114 and name   HN)  4.0  2.2  1.0 ! A.1202 at 1.50e+06
assign (resid 111 and name   HA) (resid 114 and name  HB2)  3.0  1.2  0.3 ! A.1298 at 6.74e+05
assign (resid 111 and name   HA) (resid 114 and name HD1#)  3.0  1.2  1.2 ! A.2374 at 2.60e+06
assign (resid 111 and name  HG#) (resid 131 and name  HE#)  3.0  1.2  2.2 ! B.10934 at 5.25e+05
assign (resid 111 and name  HE#) (resid 131 and name  HE#)  3.0  1.2  2.3 ! A.5534 at 7.70e+05

! E112
assign (resid 112 and name   HN) (resid 112 and name  HB#)  2.5  0.7  1.4 ! A.218 at 5.21e+06
assign (resid 112 and name   HN) (resid 112 and name  HG#)  3.0  1.2  1.5 ! A.1188 at 2.54e+06
assign (resid 112 and name   HA) (resid 112 and name  HG#)  2.5  0.7  1.2 ! A.1655 at 2.47e+06
assign (resid 112 and name   HN) (resid 113 and name   HN)  3.0  1.2  0.5 ! A.1191 at 3.13e+06
assign (resid 112 and name   HN) (resid 113 and name  HB#)  4.0  2.2  2.0 ! B.1281 at 6.01e+05
assign (resid 112 and name   HA) (resid 113 and name   HN)  4.0  2.2  1.0 ! C.573 at 5.71e+05
assign (resid 112 and name  HB#) (resid 113 and name   HN)  3.0  1.2  1.5 ! A.1194 at 1.74e+06
assign (resid 112 and name  HG#) (resid 113 and name   HN)  5.0  3.2  2.0 ! B.1950 at 2.35e+05
assign (resid 112 and name   HA) (resid 115 and name   HN)  4.0  2.2  1.0 ! A.1212 at 1.22e+06

! A113
assign (resid 113 and name   HN) (resid 113 and name  HB#)  2.5  0.7  1.4 ! A.1196 at 6.17e+06
assign (resid 113 and name   HN) (resid 114 and name   HN)  3.0  1.2  0.5 ! A.1190 at 3.10e+06
assign (resid 113 and name   HA) (resid 114 and name   HN)  3.0  1.2  0.5 ! B.1042 at 1.36e+06
assign (resid 113 and name  HB#) (resid 114 and name   HN)  2.5  0.7  1.4 ! A.1205 at 3.43e+06
assign (resid 113 and name  HB#) (resid 114 and name HD2#)  3.0  1.2  2.3 
assign (resid 113 and name   HA) (resid 115 and name   HN)  4.0  2.2  1.0 ! B.1953 at 7.79e+05
assign (resid 113 and name   HA) (resid 116 and name   HN)  4.0  2.2  1.0 ! A.1225 at 7.41e+05
assign (resid 113 and name   HA) (resid 116 and name  HB#)  2.5  0.7  1.2 ! A.1300 at 1.20e+06

! L114
assign (resid 114 and name   HN) (resid 114 and name  HB1)  3.0  1.2  0.5 ! A.1204 at 2.13e+06
assign (resid 114 and name   HN) (resid 114 and name  HB2)  2.5  0.7  0.4 ! A.1203 at 6.56e+06
assign (resid 114 and name   HN) (resid 114 and name   HG)  3.0  1.2  0.5 ! C.581 at 1.26e+06
assign (resid 114 and name   HN) (resid 114 and name HD1#)  4.0  2.2  2.0 ! A.1206 at 1.25e+06
assign (resid 114 and name   HN) (resid 114 and name HD2#)  5.0  3.2  2.0 ! A.1207 at 4.07e+05
assign (resid 114 and name   HA) (resid 114 and name   HG)  3.0  1.2  0.3 ! B.5245 at 3.01e+05
assign (resid 114 and name   HA) (resid 114 and name HD1#)  3.0  1.2  1.3 ! B.7530 at 3.39e+05
assign (resid 114 and name   HA) (resid 114 and name HD2#)  2.5  0.7  1.2 ! A.879 at 5.22e+06
assign (resid 114 and name  HB1) (resid 114 and name HD1#)  2.5  0.7  1.2 ! A.2375 at 3.47e+06
assign (resid 114 and name  HB1) (resid 114 and name HD2#)  2.5  0.7  1.2 ! A.4032 at 6.08e+06
assign (resid 114 and name  HB2) (resid 114 and name HD1#)  2.5  0.7  1.2 ! B.10110 at -5.47e+05
assign (resid 114 and name   HN) (resid 115 and name   HN)  3.0  1.2  0.5 ! A.1199 at 2.42e+06
assign (resid 114 and name  HB1) (resid 115 and name   HN)  4.0  2.2  1.0 ! A.1220 at 9.23e+05
assign (resid 114 and name  HB2) (resid 115 and name   HN)  3.0  1.2  0.5 ! A.1216 at 1.92e+06
assign (resid 114 and name HD1#) (resid 115 and name   HN)  5.0  3.2  2.0 ! A.1656 at 3.74e+05
assign (resid 114 and name  HB#) (resid 116 and name   HN)  4.0  2.2  2.0 ! C.929 at 4.75e+05
assign (resid 114 and name   HA) (resid 117 and name   HN)  4.0  2.2  1.0 ! A.1655 at 1.13e+06
assign (resid 114 and name   HA) (resid 117 and name  HB#)  4.0  2.2  2.0 ! A.1302 at 3.32e+05
assign (resid 114 and name HD2#) (resid 128 and name   HA)  4.0  2.2  2.0 ! A.4149 at 4.14e+05
assign (resid 114 and name HD1#) (resid 131 and name  HG#)  3.0  1.2  2.2 ! A.4023 at 1.31e+06
assign (resid 114 and name HD1#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! A.2378 at 2.19e+07
assign (resid 114 and name HD2#) (resid 131 and name  HG#)  3.0  1.2  2.3 ! A.4031 at 8.73e+05
assign (resid 114 and name HD2#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! B.8439 at 1.41e+06

! E115
assign (resid 115 and name   HN) (resid 115 and name  HB#)  2.5  0.7  1.4 ! A.1215 at 7.70e+06
assign (resid 115 and name   HN) (resid 115 and name  HG#)  4.0  2.2  2.0 ! A.1214 at 8.07e+05
assign (resid 115 and name   HA) (resid 115 and name  HG#)  2.5  0.7  1.2 ! A.4046 at 3.22e+06
assign (resid 115 and name   HN) (resid 116 and name   HN)  3.0  1.2  0.5 ! A.1223 at 2.51e+06
assign (resid 115 and name   HN) (resid 116 and name  HB#)  4.0  2.2  2.0 ! C.927 at 4.80e+05
assign (resid 115 and name   HA) (resid 116 and name   HN)  3.0  1.2  0.5 ! A.1227 at 1.60e+06
assign (resid 115 and name  HB#) (resid 116 and name   HN)  3.0  1.2  1.5 ! A.1230 at 2.14e+06
assign (resid 115 and name  HB#) (resid 116 and name   HA)  3.0  1.2  1.3 ! A.2388 at 5.40e+05
assign (resid 115 and name  HG#) (resid 116 and name   HN)  5.0  3.2  2.0 ! A.1231 at 4.32e+05
assign (resid 115 and name   HA) (resid 117 and name   HN)  4.0  2.2  1.0 ! C.596 at 1.28e+06
assign (resid 115 and name  HB#) (resid 117 and name   HN)  5.0  3.2  2.0 ! B.1330 at 2.55e+05

! A116
assign (resid 116 and name   HN) (resid 116 and name  HB#)  2.5  0.7  1.4 ! A.1229 at 6.23e+06
assign (resid 116 and name   HN) (resid 117 and name   HN)  3.0  1.2  0.5 ! A.1224 at 2.51e+06
assign (resid 116 and name   HN) (resid 117 and name   HA)  5.0  3.2  1.0 ! A.1228 at 4.67e+05
assign (resid 116 and name   HN) (resid 117 and name  HB#)  5.0  3.2  2.0 ! B.1641 at 2.66e+05
assign (resid 116 and name   HA) (resid 117 and name   HN)  3.0  1.2  0.5 ! A.1236 at 2.43e+06
assign (resid 116 and name  HB#) (resid 117 and name   HN)  3.0  1.2  1.5 ! A.1240 at 2.38e+06
assign (resid 116 and name  HB#) (resid 117 and name   HA)  4.0  2.2  2.0 ! A.1994 at 4.56e+05

! N117
assign (resid 117 and name   HN) (resid 117 and name  HB#)  3.0  1.2  1.5 ! A.1239 at 3.22e+06
assign (resid 117 and name   HA) (resid 117 and name HD2#)  5.0  3.2  2.0 
assign (resid 117 and name  HB#) (resid 117 and name HD2#)  4.0  2.2  3.0 ! A.1246 at 1.05e+06
assign (resid 117 and name   HN) (resid 118 and name   HN)  5.0  3.2  1.0 ! A.1234 at 5.91e+05
assign (resid 117 and name   HA) (resid 118 and name   HN)  2.5  0.7  0.4 ! A.1254 at 1.08e+07
assign (resid 117 and name HD2#) (resid 119 and name   HN)  4.0  2.2  2.0 ! A.1269 at 5.64e+05

! N118
assign (resid 118 and name   HN) (resid 118 and name  HB#)  2.5  0.7  1.4 ! A.1256 at 4.05e+06
assign (resid 118 and name   HN) (resid 118 and name HD2#)  5.0  3.2  2.0 ! A.1263 at 3.71e+05
assign (resid 118 and name  HB#) (resid 118 and name HD2#)  4.0  2.2  2.3 ! A.1265 at 2.27e+06
assign (resid 118 and name   HN) (resid 119 and name   HN)  3.0  1.2  0.5 ! A.1268 at 2.33e+06
assign (resid 118 and name   HA) (resid 119 and name   HN)  2.5  0.7  0.4 ! A.1270 at 3.42e+06

! Y119
assign (resid 119 and name   HN) (resid 119 and name  HB#)  3.0  1.2  1.5 ! A.1272 at 1.96e+06
assign (resid 119 and name   HN) (resid 119 and name  HD#)  3.0  1.2  2.9 ! C.931 at -9.14e+05
assign (resid 119 and name   HA) (resid 119 and name  HD#)  3.0  1.2  2.7 ! A.906 at 7.35e+05
assign (resid 119 and name   HA) (resid 119 and name  HE#)  4.0  2.2  3.4 ! A.4062 at 3.56e+05
assign (resid 119 and name  HB#) (resid 119 and name  HD#)  3.0  1.2  3.7 ! A.905 at 8.25e+05
assign (resid 119 and name  HB#) (resid 119 and name  HE#)  3.0  1.2  3.7 ! A.4063 at 4.50e+05
assign (resid 119 and name   HA) (resid 120 and name   HN)  2.5  0.7  0.4 ! A.1276 at 5.76e+06
assign (resid 119 and name  HB#) (resid 120 and name   HN)  4.0  2.2  2.0 ! A.1277 at 5.23e+05
assign (resid 119 and name  HD#) (resid 120 and name   HN)  5.0  3.2  3.4 ! A.1275 at 4.39e+05
assign (resid 119 and name  HE#) (resid 121 and name   HA)  3.0  1.2  2.6 ! A.4801 at 9.64e+05
assign (resid 119 and name  HE#) (resid 121 and name  HB#)  3.0  1.2  3.3 

! I120
assign (resid 120 and name   HN) (resid 120 and name   HB)  3.0  1.2  0.5 ! A.1278 at 2.04e+06
assign (resid 120 and name   HN) (resid 120 and name HG1#)  4.0  2.2  2.0 ! A.1279 at 1.04e+06
assign (resid 120 and name   HN) (resid 120 and name HG2#)  4.0  2.2  2.0 ! A.1283 at 5.99e+05
assign (resid 120 and name   HN) (resid 120 and name HD1#)  5.0  3.2  2.0 ! A.1281 at 3.81e+05
assign (resid 120 and name   HA) (resid 120 and name HG1#)  3.0  1.2  1.3 ! A.2400 at 8.50e+05
assign (resid 120 and name   HA) (resid 120 and name HG2#)  2.5  0.7  1.2 ! A.2416 at 2.32e+06
assign (resid 120 and name   HA) (resid 120 and name HD1#)  3.0  1.2  1.3 ! A.2429 at 5.97e+05
assign (resid 120 and name   HB) (resid 120 and name HD1#)  2.5  0.7  1.2 ! A.2432 at 2.24e+06
assign (resid 120 and name   HN) (resid 121 and name  HD#)  5.0  3.2  2.0 ! B.1331 at 2.45e+05
assign (resid 120 and name   HA) (resid 121 and name  HD#)  3.0  1.2  1.2 ! A.2403 at 1.80e+06
assign (resid 120 and name   HB) (resid 121 and name  HD#)  4.0  2.2  2.0 ! A.2404 at 3.96e+05
assign (resid 120 and name HG2#) (resid 121 and name  HG#)  3.0  1.2  2.3 ! A.2425 at 7.41e+05
assign (resid 120 and name HG2#) (resid 121 and name  HD#)  3.0  1.2  2.2 ! A.2422 at 1.81e+06
assign (resid 120 and name   HA) (resid 124 and name HD1#)  4.0  2.2  2.0 ! A.4120 at 3.59e+05
assign (resid 120 and name HG2#) (resid 124 and name   HN)  4.0  2.2  2.0 ! A.1308 at 8.03e+05
assign (resid 120 and name HG2#) (resid 124 and name   HA)  4.0  2.2  2.0 ! A.2419 at 4.18e+05
assign (resid 120 and name HG2#) (resid 124 and name  HB1)  3.0  1.2  1.2 ! A.2454 at 1.84e+06
assign (resid 120 and name HG2#) (resid 124 and name  HB2)  3.0  1.2  1.3 ! A.2453 at 7.52e+05
assign (resid 120 and name HG2#) (resid 124 and name HD1#)  2.5  0.7  2.2 ! B.1421 at 5.32e+05
assign (resid 120 and name HG2#) (resid 125 and name   HN)  4.0  2.2  2.0 ! A.1318 at 5.12e+05
assign (resid 120 and name HG2#) (resid 125 and name   HA)  4.0  2.2  2.0 ! A.5503 at 2.82e+05
assign (resid 120 and name HG1#) (resid 126 and name   HN)  4.0  2.2  2.0 
assign (resid 120 and name HG2#) (resid 126 and name   HN)  4.0  2.2  2.0 ! A.1332 at 1.11e+06
assign (resid 120 and name HG2#) (resid 126 and name  HB#)  4.0  2.2  2.2 ! A.2423 at 1.14e+06
assign (resid 120 and name HG2#) (resid 126 and name  HD#)  3.0  1.2  3.7 ! A.2417 at 5.84e+05
assign (resid 120 and name HD1#) (resid 126 and name   HN)  3.0  1.2  1.5 ! C.942 at 8.92e+05
assign (resid 120 and name HD1#) (resid 126 and name  HB#)  3.0  1.2  2.2 ! A.4076 at 1.82e+06
assign (resid 120 and name HD1#) (resid 126 and name  HD#)  2.5  0.7  3.6 ! A.5451 at 1.98e+06

! P121
assign (resid 121 and name   HA) (resid 121 and name  HG#)  3.0  1.2  1.3 ! A.2118 at 5.36e+05
assign (resid 121 and name  HB#) (resid 121 and name  HD#)  4.0  2.2  3.0 ! A.4082 at 2.88e+05
assign (resid 121 and name   HA) (resid 122 and name   HN)  2.5  0.7  0.4 ! A.1288 at 4.01e+06
assign (resid 121 and name  HB#) (resid 122 and name   HN)  4.0  2.2  2.0 ! A.1291 at 9.16e+05
assign (resid 121 and name  HG#) (resid 122 and name   HN)  4.0  2.2  2.0 ! C.1099 at 4.74e+05
assign (resid 121 and name   HA) (resid 123 and name   HN)  4.0  2.2  1.0 ! A.1298 at 6.24e+05
assign (resid 121 and name  HB#) (resid 123 and name   HN)  4.0  2.2  2.0 ! A.1300 at 7.76e+05
assign (resid 121 and name  HB#) (resid 123 and name  HD#)  4.0  2.2  4.4 ! A.5456 at 3.26e+05
assign (resid 121 and name  HB#) (resid 123 and name  HE#)  3.0  1.2  3.6 ! A.5455 at 1.00e+06
assign (resid 121 and name  HG#) (resid 123 and name  HE#)  4.0  2.2  4.4 ! A.5477 at 3.14e+05
assign (resid 121 and name  HB#) (resid 124 and name   HN)  4.0  2.2  2.0 ! B.1335 at 8.00e+05
assign (resid 121 and name  HG#) (resid 124 and name HD1#)  3.0  1.2  2.3 ! A.5490 at 7.11e+05
assign (resid 121 and name  HD#) (resid 124 and name  HB2)  4.0  2.2  2.0 ! A.5459 at 4.02e+05
assign (resid 121 and name  HD#) (resid 124 and name HD1#)  3.0  1.2  2.3 ! A.2463 at 5.72e+05

! D122
assign (resid 122 and name   HN) (resid 122 and name  HB1)  4.0  2.2  1.0 ! A.1292 at 9.94e+05
assign (resid 122 and name   HN) (resid 122 and name  HB2)  3.0  1.2  0.5 ! A.1289 at 2.37e+06
assign (resid 122 and name   HN) (resid 123 and name   HN)  4.0  2.2  1.0 ! A.1286 at 9.33e+05
assign (resid 122 and name   HN) (resid 123 and name  HD#)  4.0  2.2  3.4 ! A.1285 at 5.06e+05
assign (resid 122 and name   HN) (resid 123 and name  HE#)  5.0  3.2  3.4 ! B.1961 at 2.72e+05
assign (resid 122 and name   HA) (resid 123 and name   HN)  4.0  2.2  1.0 ! B.1088 at 8.82e+05
assign (resid 122 and name  HB2) (resid 123 and name   HN)  5.0  3.2  1.0 ! A.1299 at 3.58e+05
assign (resid 122 and name   HA) (resid 124 and name   HN)  4.0  2.2  1.0 ! A.1305 at 8.27e+05

! Y123
assign (resid 123 and name   HN) (resid 123 and name  HB#)  5.0  3.2  2.0 ! A.1301 at 4.10e+05
assign (resid 123 and name   HN) (resid 123 and name  HD#)  3.0  1.2  2.9 ! A.1293 at 2.41e+06
assign (resid 123 and name   HA) (resid 123 and name  HD#)  3.0  1.2  2.7 ! A.924 at 6.05e+05
assign (resid 123 and name   HA) (resid 123 and name  HE#)  4.0  2.2  3.4 ! A.5469 at 2.82e+05
assign (resid 123 and name  HB#) (resid 123 and name  HD#)  4.0  2.2  4.4 ! A.4100 at 3.50e+05
assign (resid 123 and name  HB#) (resid 123 and name  HE#)  3.0  1.2  3.7 ! A.4104 at 4.71e+05
assign (resid 123 and name   HN) (resid 124 and name   HN)  3.0  1.2  0.5 ! A.1303 at 3.26e+06
assign (resid 123 and name   HA) (resid 124 and name   HN)  4.0  2.2  1.0 ! C.1101 at 4.42e+05
assign (resid 123 and name  HD#) (resid 124 and name   HN)  5.0  3.2  3.4 ! B.1962 at 3.60e+05
assign (resid 123 and name  HD#) (resid 124 and name   HG)  4.0  2.2  3.4 ! A.4114 at 3.74e+05
assign (resid 123 and name  HD#) (resid 124 and name HD1#)  3.0  1.2  3.7 ! A.5484 at 7.68e+05
assign (resid 123 and name  HD#) (resid 124 and name HD2#)  2.5  0.7  3.2 
assign (resid 123 and name  HD#) (resid 135 and name  HD#)  4.0  2.2  5.8 ! A.4212 at 3.33e+05
assign (resid 123 and name  HD#) (resid 135 and name  HE#)  2.5  0.7  5.0 ! A.5554 at 1.58e+06
assign (resid 123 and name   HA) (resid 137 and name   HN)  5.0  3.2  1.0 ! B.1348 at 2.29e+05
assign (resid 123 and name   HA) (resid 137 and name  HG#)  4.0  2.2  1.3 ! A.5463 at 6.99e+05
assign (resid 123 and name  HB#) (resid 137 and name   HN)  5.0  3.2  2.0 ! B.1349 at 3.40e+05
assign (resid 123 and name  HD#) (resid 137 and name   HN)  5.0  3.2  3.4 ! B.1980 at 2.56e+05
assign (resid 123 and name  HD#) (resid 137 and name   HA)  4.0  2.2  3.4 ! A.5468 at 3.57e+05
assign (resid 123 and name  HD#) (resid 139 and name   HA)  3.0  1.2  2.7 ! A.5571 at 7.03e+05
assign (resid 123 and name  HD#) (resid 139 and name  HB#)  4.0  2.2  4.4 ! A.5574 at 3.24e+05
assign (resid 123 and name  HE#) (resid 139 and name  HB#)  4.0  2.2  3.7 ! A.5476 at 4.77e+05
assign (resid 123 and name  HE#) (resid 139 and name  HG#)  3.0  1.2  3.7 ! A.5578 at 5.58e+05
assign (resid 123 and name  HD#) (resid 140 and name   HN)  5.0  3.2  3.0 
assign (resid 123 and name  HE#) (resid 143 and name  HB#)  3.0  1.2  3.7 ! A.4272 at 4.49e+05
assign (resid 123 and name  HD#) (resid 144 and name HD2#)  4.0  2.2  4.4 ! A.4287 at 3.27e+05
assign (resid 123 and name  HE#) (resid 144 and name HD2#)  3.0  1.2  3.7 ! A.4288 at 5.38e+05

! L124
assign (resid 124 and name   HN) (resid 124 and name  HB1)  4.0  2.2  1.0 ! A.516 at 1.20e+06
assign (resid 124 and name   HN) (resid 124 and name  HB2)  3.0  1.2  0.5 ! A.1306 at 2.14e+06
assign (resid 124 and name   HN) (resid 124 and name   HG)  4.0  2.2  1.0 ! A.1307 at 1.02e+06
assign (resid 124 and name   HN) (resid 124 and name HD1#)  4.0  2.2  2.0 ! A.1309 at 6.85e+05
assign (resid 124 and name   HN) (resid 124 and name HD2#)  3.0  1.2  1.5 ! C.624 at 7.76e+05
assign (resid 124 and name   HA) (resid 124 and name   HG)  4.0  2.2  1.0 ! A.2456 at 3.47e+05
assign (resid 124 and name   HA) (resid 124 and name HD1#)  4.0  2.2  1.5 ! A.2458 at 8.80e+05
assign (resid 124 and name   HA) (resid 124 and name HD2#)  2.5  0.7  1.2 ! A.933 at 1.82e+06
assign (resid 124 and name  HB1) (resid 124 and name HD1#)  3.0  1.2  1.3 ! A.2451 at 4.95e+05
assign (resid 124 and name  HB1) (resid 124 and name HD2#)  3.0  1.2  1.3 ! A.4110 at 5.70e+05
assign (resid 124 and name   HA) (resid 125 and name   HN)  2.5  0.7  0.4 ! A.1313 at 3.69e+06
assign (resid 124 and name   HA) (resid 125 and name  HB#)  4.0  2.2  2.0 
assign (resid 124 and name  HB1) (resid 125 and name   HN)  4.0  2.2  1.0 ! A.1316 at 1.33e+06
assign (resid 124 and name  HB2) (resid 125 and name   HN)  5.0  3.2  1.0 ! B.1965 at 2.94e+05
assign (resid 124 and name HD2#) (resid 125 and name   HN)  4.0  2.2  2.0 ! A.1317 at 6.58e+05
assign (resid 124 and name HD1#) (resid 135 and name  HD#)  3.0  1.2  3.7 ! A.5485 at 4.55e+05
assign (resid 124 and name HD2#) (resid 135 and name   HN)  4.0  2.2  2.0 ! C.954 at 6.14e+05
assign (resid 124 and name HD2#) (resid 135 and name   HA)  2.5  0.7  1.2 ! B.5845 at -1.28e+06
assign (resid 124 and name HD2#) (resid 135 and name  HB#)  3.0  1.2  2.3 ! A.5155 at 8.96e+05
assign (resid 124 and name HD2#) (resid 135 and name  HD#)  3.0  1.2  3.6 ! A.2553 at 1.08e+06
assign (resid 124 and name HD2#) (resid 135 and name  HE#)  3.0  1.2  3.6 ! A.5152 at 1.25e+06
assign (resid 124 and name   HA) (resid 136 and name HG2#)  3.0  1.2  1.2 ! A.4235 at 1.54e+06
assign (resid 124 and name HD2#) (resid 136 and name   HN)  3.0  1.2  1.5 ! C.956 at 1.54e+06
assign (resid 124 and name   HA) (resid 137 and name   HN)  4.0  2.2  1.0 ! A.1436 at 7.94e+05

! S125
assign (resid 125 and name   HN) (resid 125 and name  HB#)  4.0  2.2  2.0 ! A.1319 at 1.27e+06
assign (resid 125 and name   HN) (resid 126 and name   HN)  4.0  2.2  1.0 ! A.1321 at 6.37e+05
assign (resid 125 and name   HA) (resid 126 and name   HN)  2.5  0.7  0.4 ! A.1326 at 9.00e+06
assign (resid 125 and name  HB#) (resid 126 and name   HN)  4.0  2.2  2.0 ! A.1329 at 1.28e+06
assign (resid 125 and name   HN) (resid 134 and name   HN)  3.0  1.2  0.5 ! A.1403 at 1.75e+06
assign (resid 125 and name  HB#) (resid 134 and name   HN)  3.0  1.2  1.5 ! C.952 at 9.15e+05
assign (resid 125 and name  HB#) (resid 134 and name   HB)  2.5  0.7  1.2 ! B.1534 at 7.19e+05
assign (resid 125 and name  HB#) (resid 134 and name HG2#)  3.0  1.2  2.2 ! A.2475 at 9.46e+05
assign (resid 125 and name   HN) (resid 136 and name HG2#)  3.0  1.2  1.5 ! C.941 at 8.99e+05
assign (resid 125 and name   HA) (resid 136 and name HG2#)  3.0  1.2  1.3 ! A.5497 at 4.51e+05
assign (resid 125 and name  HB#) (resid 136 and name HG2#)  2.5  0.7  2.2 ! A.1056 at 2.45e+06

! F126
assign (resid 126 and name   HN) (resid 126 and name  HB#)  3.0  1.2  1.5 ! A.1331 at 2.95e+06
assign (resid 126 and name   HN) (resid 126 and name  HD#)  4.0  2.2  3.4 ! A.1324 at 6.58e+05
assign (resid 126 and name   HA) (resid 126 and name  HD#)  3.0  1.2  2.7 ! A.954 at 5.73e+05
assign (resid 126 and name  HB#) (resid 126 and name  HD#)  3.0  1.2  3.7 ! A.2479 at 4.74e+05
assign (resid 126 and name   HN) (resid 127 and name   HN)  5.0  3.2  1.0 ! A.1323 at 4.19e+05
assign (resid 126 and name   HA) (resid 127 and name   HN)  2.5  0.7  0.4 ! A.1338 at 4.92e+06
assign (resid 126 and name  HD#) (resid 127 and name   HN)  3.0  1.2  2.9 ! A.1335 at 1.61e+06
assign (resid 126 and name  HD#) (resid 127 and name   HA)  4.0  2.2  3.4 ! A.4137 at 3.91e+05
assign (resid 126 and name  HD#) (resid 128 and name   HA)  2.5  0.7  2.6 ! A.4148 at 2.42e+06
assign (resid 126 and name  HD#) (resid 128 and name  HB#)  2.5  0.7  3.6 ! A.4151 at 1.44e+06
assign (resid 126 and name  HD#) (resid 128 and name  HG#)  3.0  1.2  3.7 ! A.4154 at 9.09e+05
assign (resid 126 and name  HD#) (resid 131 and name   HA)  4.0  2.2  3.4 ! A.5689 at 2.77e+05
assign (resid 126 and name  HD#) (resid 132 and name   HN)  4.0  2.2  3.4 ! A.1382 at 1.33e+06
assign (resid 126 and name  HD#) (resid 132 and name   HA)  4.0  2.2  3.4 ! A.4191 at 3.37e+05
assign (resid 126 and name   HA) (resid 133 and name  HA#)  3.0  1.2  1.2 ! A.1003 at 1.02e+06
assign (resid 126 and name  HD#) (resid 133 and name   HN)  5.0  3.2  3.4 ! A.1392 at 3.92e+05
assign (resid 126 and name  HD#) (resid 133 and name  HA#)  4.0  2.2  3.7 ! A.2545 at 8.75e+05
assign (resid 126 and name   HA) (resid 134 and name   HN)  4.0  2.2  1.0 ! A.1405 at 6.56e+05
assign (resid 126 and name  HD#) (resid 134 and name   HN)  5.0  3.2  3.4 ! A.1661 at 3.50e+05

! D127
assign (resid 127 and name   HN) (resid 127 and name  HB#)  3.0  1.2  1.5 ! A.1342 at 1.61e+06
assign (resid 127 and name   HA) (resid 128 and name  HG#)  3.0  1.2  1.3 ! A.2482 at 7.50e+05
assign (resid 127 and name   HA) (resid 128 and name  HD#)  3.0  1.2  1.2 ! A.979 at 1.80e+06
assign (resid 127 and name  HB#) (resid 128 and name  HD#)  4.0  2.2  3.0 ! A.5510 at 2.61e+05
assign (resid 127 and name   HA) (resid 129 and name   HN)  4.0  2.2  1.0 ! A.1345 at 5.22e+05
assign (resid 127 and name  HB#) (resid 130 and name   HN)  4.0  2.2  2.0 ! A.1359 at 6.62e+05
assign (resid 127 and name  HB#) (resid 130 and name  HB2)  4.0  2.2  2.0 ! A.4143 at 4.14e+05
assign (resid 127 and name   HN) (resid 132 and name   HN)  4.0  2.2  1.0 ! A.1336 at 7.26e+05
assign (resid 127 and name   HN) (resid 132 and name  HB#)  5.0  3.2  2.0 ! B.1969 at 2.51e+05
assign (resid 127 and name  HB#) (resid 132 and name   HN)  4.0  2.2  2.0 ! A.1385 at 5.62e+05
assign (resid 127 and name  HB#) (resid 132 and name  HB#)  4.0  2.2  2.3 ! A.4140 at 6.80e+05
assign (resid 127 and name   HN) (resid 133 and name  HA#)  4.0  2.2  2.0 ! A.1337 at 8.18e+05

! P128
assign (resid 128 and name   HA) (resid 128 and name  HG#)  3.0  1.2  1.3 ! B.7789 at 2.87e+05
assign (resid 128 and name  HB#) (resid 128 and name  HD#)  4.0  2.2  2.3 ! A.2496 at 4.59e+05
assign (resid 128 and name   HA) (resid 129 and name   HN)  4.0  2.2  1.0 ! A.1349 at 1.34e+06
assign (resid 128 and name  HB#) (resid 129 and name   HN)  3.0  1.2  1.5 ! C.644 at 7.99e+05
assign (resid 128 and name  HG#) (resid 129 and name   HN)  3.0  1.2  1.5 ! C.643 at 9.97e+05
assign (resid 128 and name  HD#) (resid 129 and name   HN)  4.0  2.2  2.0 ! A.1348 at 5.92e+05
assign (resid 128 and name   HA) (resid 131 and name   HN)  4.0  2.2  1.0 ! A.1372 at 7.02e+05
assign (resid 128 and name   HA) (resid 131 and name   HA)  3.0  1.2  0.3 ! A.2484 at 8.37e+05
assign (resid 128 and name   HA) (resid 132 and name   HN)  5.0  3.2  1.0 ! A.1389 at 4.01e+05

! E129
assign (resid 129 and name   HN) (resid 129 and name  HB#)  2.5  0.7  1.4 ! A.1350 at 8.77e+06
assign (resid 129 and name   HN) (resid 129 and name  HG#)  4.0  2.2  2.0 ! A.1351 at 1.27e+06
assign (resid 129 and name   HA) (resid 129 and name  HG#)  2.5  0.7  1.2 ! A.4159 at 4.25e+06
assign (resid 129 and name   HN) (resid 130 and name   HN)  2.5  0.7  0.4 ! A.1343 at 4.62e+06
assign (resid 129 and name   HN) (resid 130 and name  HB2)  5.0  3.2  1.0 ! A.1352 at 3.89e+05
assign (resid 129 and name   HA) (resid 130 and name   HN)  4.0  2.2  1.0 ! C.646 at 6.36e+05
assign (resid 129 and name  HB#) (resid 130 and name   HN)  3.0  1.2  1.5 ! A.1357 at 2.81e+06
assign (resid 129 and name  HB#) (resid 130 and name  HG#)  3.0  1.2  2.2 ! A.4793 at 1.07e+06
assign (resid 129 and name  HG#) (resid 130 and name   HN)  3.0  1.2  1.5 ! C.649 at 7.32e+05

! K130
assign (resid 130 and name   HN) (resid 130 and name  HB1)  3.0  1.2  0.5 ! A.1358 at 1.60e+06
assign (resid 130 and name   HN) (resid 130 and name  HB2)  3.0  1.2  0.5 ! A.1362 at 2.90e+06
assign (resid 130 and name   HN) (resid 130 and name  HG#)  3.0  1.2  1.5 ! C.652 at 1.45e+06
assign (resid 130 and name   HN) (resid 130 and name  HE#)  4.0  2.2  2.0 ! C.648 at 5.21e+05
assign (resid 130 and name   HA) (resid 130 and name  HG#)  3.0  1.2  1.2 ! A.1235 at 3.00e+06
assign (resid 130 and name   HA) (resid 130 and name  HD#)  2.5  0.7  1.2 ! A.4169 at 1.81e+06
assign (resid 130 and name   HA) (resid 130 and name  HE#)  4.0  2.2  1.2 ! A.2516 at 1.18e+06
assign (resid 130 and name  HB1) (resid 130 and name  HD#)  2.5  0.7  1.2 ! A.2502 at 1.43e+06
assign (resid 130 and name  HB1) (resid 130 and name  HE#)  3.0  1.2  1.2 ! A.5521 at 2.67e+06
assign (resid 130 and name  HB2) (resid 130 and name  HD#)  2.5  0.7  1.2 ! A.2501 at 1.16e+06
assign (resid 130 and name  HB2) (resid 130 and name  HE#)  3.0  1.2  1.3 ! B.4646 at -2.30e+05
assign (resid 130 and name  HG#) (resid 130 and name  HE#)  2.5  0.7  2.2 ! A.4173 at 6.31e+06
assign (resid 130 and name   HN) (resid 131 and name   HN)  2.5  0.7  0.4 ! A.1354 at 8.12e+06
assign (resid 130 and name   HN) (resid 131 and name   HA)  5.0  3.2  1.0 ! A.1356 at 4.19e+05
assign (resid 130 and name   HA) (resid 131 and name   HN)  4.0  2.2  1.0 ! A.1375 at 5.93e+05
assign (resid 130 and name  HB1) (resid 131 and name   HN)  5.0  3.2  1.0 ! A.1370 at 4.34e+05
assign (resid 130 and name  HB2) (resid 131 and name   HN)  4.0  2.2  1.0 ! A.1369 at 5.32e+05
assign (resid 130 and name  HB2) (resid 132 and name   HN)  4.0  2.2  1.0 ! A.1388 at 8.79e+05

! M131
assign (resid 131 and name   HN) (resid 131 and name   HA)  2.5  0.7  0.4 ! A.mam
assign (resid 131 and name   HN) (resid 131 and name  HB#)  4.0  2.2  2.0 ! A.1368 at 6.80e+05
assign (resid 131 and name   HN) (resid 131 and name  HG#)  4.0  2.2  2.0 ! A.1367 at 9.96e+05
assign (resid 131 and name   HA) (resid 131 and name  HG#)  2.5  0.7  1.2 ! A.993 at 2.45e+06
assign (resid 131 and name  HB#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! B.4605 at 6.39e+05
assign (resid 131 and name  HG#) (resid 131 and name  HE#)  2.5  0.7  2.2 ! A.2531 at 5.04e+06
assign (resid 131 and name   HN) (resid 132 and name   HN)  3.0  1.2  0.5 ! A.1365 at 1.88e+06
assign (resid 131 and name   HA) (resid 132 and name   HN)  2.5  0.7  0.4 ! A.1383 at 3.32e+06
assign (resid 131 and name  HB#) (resid 132 and name   HN)  4.0  2.2  2.0 ! C.1259 at 4.04e+05

! E132
assign (resid 132 and name   HN) (resid 132 and name  HB#)  3.0  1.2  1.5 ! A.1387 at 2.57e+06
assign (resid 132 and name   HN) (resid 132 and name  HG#)  4.0  2.2  2.0 ! A.1386 at 5.19e+05
assign (resid 132 and name   HA) (resid 132 and name  HG#)  3.0  1.2  1.3 ! A.5544 at 4.75e+05
assign (resid 132 and name   HN) (resid 133 and name   HN)  5.0  3.2  1.0 ! A.1377 at 4.37e+05
assign (resid 132 and name   HA) (resid 133 and name   HN)  2.5  0.7  0.4 ! A.1393 at 4.91e+06
assign (resid 132 and name  HB#) (resid 133 and name   HN)  4.0  2.2  2.0 ! A.1399 at 8.35e+05
assign (resid 132 and name  HG#) (resid 133 and name   HN)  4.0  2.2  2.0 ! A.1400 at 5.14e+05

! G133
assign (resid 133 and name   HN) (resid 134 and name   HN)  5.0  3.2  1.0 ! A.1402 at 4.07e+05
assign (resid 133 and name  HA#) (resid 134 and name   HN)  3.0  1.2  1.5 ! A.1408 at 2.14e+06

! T134
assign (resid 134 and name   HN) (resid 134 and name   HB)  3.0  1.2  0.5 ! A.1409 at 2.43e+06
assign (resid 134 and name   HN) (resid 134 and name HG2#)  4.0  2.2  2.0 ! A.1411 at 8.04e+05
assign (resid 134 and name   HA) (resid 134 and name HG2#)  2.5  0.7  1.2 ! A.1011 at 2.27e+06
assign (resid 134 and name   HA) (resid 135 and name   HN)  2.5  0.7  0.4 ! A.1417 at 4.43e+06
assign (resid 134 and name HG2#) (resid 135 and name   HN)  3.0  1.2  1.5 ! A.1420 at 1.78e+06
assign (resid 134 and name   HA) (resid 136 and name HG2#)  4.0  2.2  2.0 ! A.5560 at 4.11e+05
assign (resid 134 and name   HB) (resid 136 and name HG2#)  2.5  0.7  1.2 ! A.4201 at 2.52e+06
assign (resid 134 and name HG2#) (resid 136 and name   HN)  4.0  2.2  2.0 ! A.1431 at 1.06e+06
assign (resid 134 and name HG2#) (resid 136 and name   HA)  4.0  2.2  2.0 ! A.5385 at 2.28e+06
assign (resid 134 and name HG2#) (resid 136 and name   HB)  3.0  1.2  1.3 ! A.4665 at 5.68e+05
assign (resid 134 and name HG2#) (resid 136 and name HG2#)  2.5  0.7  2.2 ! A.2568 at 5.54e+06

! Y135
assign (resid 135 and name   HN) (resid 135 and name  HB#)  3.0  1.2  1.5 ! A.1419 at 2.05e+06
assign (resid 135 and name   HA) (resid 135 and name  HD#)  3.0  1.2  2.6 ! A.1033 at 1.68e+06
assign (resid 135 and name   HA) (resid 135 and name  HE#)  4.0  2.2  2.7 ! A.4219 at 6.17e+05
assign (resid 135 and name  HB#) (resid 135 and name  HD#)  4.0  2.2  3.7 ! A.4215 at 9.09e+05
assign (resid 135 and name  HB#) (resid 135 and name  HE#)  3.0  1.2  3.7 ! A.4223 at 4.51e+05
assign (resid 135 and name   HA) (resid 136 and name   HN)  2.5  0.7  0.4 ! A.1426 at 5.71e+06
assign (resid 135 and name  HB#) (resid 136 and name   HN)  5.0  3.2  2.0 ! B.1979 at 3.38e+05
assign (resid 135 and name  HD#) (resid 136 and name   HN)  4.0  2.2  3.4 ! A.1425 at 1.07e+06
assign (resid 135 and name  HD#) (resid 137 and name   HN)  4.0  2.2  3.4 ! A.1435 at 6.85e+05
assign (resid 135 and name  HE#) (resid 138 and name HD2#)  3.0  1.2  3.7 ! A.2577 at 7.55e+05
assign (resid 135 and name  HE#) (resid 139 and name  HD#)  2.5  0.7  3.6 ! A.5269 at 9.30e+05

! T136
assign (resid 136 and name   HN) (resid 136 and name   HB)  4.0  2.2  1.0 ! A.1428 at 5.33e+05
assign (resid 136 and name   HN) (resid 136 and name HG2#)  3.0  1.2  1.5 ! A.1430 at 2.69e+06
assign (resid 136 and name   HA) (resid 136 and name HG2#)  2.5  0.7  1.2 ! A.1040 at 2.96e+06
assign (resid 136 and name   HN) (resid 137 and name   HN)  3.0  1.2  0.5 ! A.1424 at 2.90e+06
assign (resid 136 and name   HN) (resid 137 and name  HG#)  5.0  3.2  2.0 ! B.1977 at 2.71e+05
assign (resid 136 and name   HA) (resid 137 and name   HN)  4.0  2.2  1.0 ! A.1438 at 1.31e+06
assign (resid 136 and name   HB) (resid 137 and name   HN)  4.0  2.2  1.0 ! A.1439 at 1.37e+06
assign (resid 136 and name HG2#) (resid 137 and name   HN)  4.0  2.2  2.0 ! A.1444 at 6.65e+05

! R137
assign (resid 137 and name   HN) (resid 137 and name  HB#)  4.0  2.2  2.0 ! A.1442 at 1.08e+06
assign (resid 137 and name   HN) (resid 137 and name  HG#)  4.0  2.2  2.0 ! A.1441 at 1.39e+06
assign (resid 137 and name   HA) (resid 138 and name   HN)  3.0  1.2  0.5 ! A.1448 at 2.30e+06
assign (resid 137 and name  HB#) (resid 138 and name   HN)  3.0  1.2  1.5 ! C.693 at 8.28e+05

! L138
assign (resid 138 and name   HN) (resid 138 and name  HB#)  3.0  1.2  1.5 ! A.1451 at 3.18e+06
assign (resid 138 and name   HN) (resid 138 and name   HG)  3.0  1.2  0.5 ! A.1452 at 2.06e+06
assign (resid 138 and name   HN) (resid 138 and name HD1#)  4.0  2.2  2.0 ! A.1453 at 1.18e+06
assign (resid 138 and name   HN) (resid 138 and name HD2#)  4.0  2.2  2.0 ! A.1454 at 5.34e+05
assign (resid 138 and name   HA) (resid 138 and name HD1#)  3.0  1.2  1.3 ! A.1062 at 7.90e+05
assign (resid 138 and name   HA) (resid 138 and name HD2#)  2.5  0.7  1.2 
assign (resid 138 and name  HB#) (resid 138 and name HD1#)  3.0  1.2  2.2 ! A.4070 at 2.18e+06
assign (resid 138 and name  HB#) (resid 138 and name HD2#)  3.0  1.2  2.3 ! A.1071 at 6.52e+05
assign (resid 138 and name   HA) (resid 139 and name  HD#)  3.0  1.2  1.3 ! A.1066 at 6.47e+05
assign (resid 138 and name  HB#) (resid 139 and name  HD#)  4.0  2.2  3.0 ! A.4071 at 3.31e+05
assign (resid 138 and name HD1#) (resid 139 and name  HD#)  3.0  1.2  2.3 ! A.4265 at 8.79e+05
assign (resid 138 and name HD2#) (resid 139 and name  HD#)  3.0  1.2  2.2 ! A.2579 at 1.40e+06

! P139
assign (resid 139 and name  HB#) (resid 139 and name  HD#)  4.0  2.2  3.0 ! A.4261 at 4.14e+05
assign (resid 139 and name   HA) (resid 140 and name   HN)  2.5  0.7  0.4 ! A.1458 at 3.57e+06
assign (resid 139 and name  HB#) (resid 140 and name   HN)  4.0  2.2  2.0 ! A.1460 at 9.38e+05
assign (resid 139 and name  HB#) (resid 144 and name HD1#)  2.5  0.7  2.2 ! A.5575 at 1.68e+06
assign (resid 139 and name  HB#) (resid 144 and name HD2#)  3.0  1.2  2.2 ! A.5604 at 2.06e+06
assign (resid 139 and name  HG#) (resid 144 and name HD1#)  2.5  0.7  2.2 ! A.5579 at 4.79e+06
assign (resid 139 and name  HG#) (resid 144 and name HD2#)  3.0  1.2  2.2 ! A.5605 at 1.62e+06

! E140
assign (resid 140 and name   HN) (resid 140 and name  HB1)  4.0  2.2  1.0 ! A.1462 at 1.40e+06
assign (resid 140 and name   HN) (resid 140 and name  HB2)  4.0  2.2  1.0 ! A.1461 at 1.53e+06
assign (resid 140 and name   HN) (resid 140 and name  HG#)  4.0  2.2  2.0 ! A.1463 at 1.35e+06
assign (resid 140 and name   HA) (resid 140 and name  HG#)  2.5  0.7  1.2 ! A.2594 at 1.83e+06
assign (resid 140 and name   HA) (resid 141 and name   HN)  2.5  0.7  0.4 ! A.1467 at 4.75e+06
assign (resid 140 and name  HB1) (resid 141 and name   HN)  4.0  2.2  1.0 ! A.1469 at 1.29e+06
assign (resid 140 and name  HB2) (resid 141 and name   HN)  2.5  0.7  0.4 ! A.1471 at 3.32e+06
assign (resid 140 and name  HB1) (resid 142 and name   HN)  4.0  2.2  1.0 ! A.1481 at 1.39e+06
assign (resid 140 and name  HB2) (resid 142 and name   HN)  3.0  1.2  0.5 ! A.1482 at 1.65e+06
assign (resid 140 and name  HG#) (resid 142 and name   HN)  4.0  2.2  2.0 ! B.1355 at 6.86e+05
assign (resid 140 and name   HN) (resid 143 and name  HB#)  4.0  2.2  2.0 ! A.1464 at 9.06e+05
assign (resid 140 and name  HB2) (resid 143 and name   HN)  4.0  2.2  1.0 ! A.1490 at 1.36e+06

! R141
assign (resid 141 and name   HN) (resid 141 and name  HB#)  3.0  1.2  1.5 ! A.1470 at 2.84e+06
assign (resid 141 and name   HA) (resid 141 and name  HD#)  3.0  1.2  1.3 ! A.4663 at 7.25e+05
assign (resid 141 and name  HB#) (resid 141 and name  HD#)  3.0  1.2  2.3 ! A.5590 at 6.08e+05
assign (resid 141 and name  HB#) (resid 141 and name   HE)  4.0  2.2  2.0 ! B.1676 at -5.72e+05
assign (resid 141 and name   HN) (resid 142 and name   HN)  4.0  2.2  1.0 ! A.1466 at 9.25e+05
assign (resid 141 and name  HB#) (resid 142 and name   HN)  4.0  2.2  2.0 ! A.1483 at 1.23e+06
assign (resid 141 and name   HN) (resid 144 and name HD1#)  5.0  3.2  2.0 ! B.1990 at 2.45e+05
assign (resid 141 and name   HA) (resid 144 and name   HN)  5.0  3.2  1.0 ! A.1663 at 3.39e+05
assign (resid 141 and name   HA) (resid 144 and name HD1#)  2.5  0.7  1.2 ! A.1918 at 1.23e+06

! S142
assign (resid 142 and name   HN) (resid 142 and name  HB1)  3.0  1.2  0.5 ! A.1479 at 2.21e+06
assign (resid 142 and name   HN) (resid 142 and name  HB2)  4.0  2.2  1.0 ! A.1480 at 7.82e+05
assign (resid 142 and name   HN) (resid 143 and name   HN)  4.0  2.2  1.0 ! A.1485 at 1.16e+06
assign (resid 142 and name   HN) (resid 143 and name  HB#)  5.0  3.2  2.0 
assign (resid 142 and name   HA) (resid 143 and name   HN)  4.0  2.2  1.0 ! C.968 at 4.62e+05
assign (resid 142 and name  HB1) (resid 143 and name   HN)  4.0  2.2  1.0 ! A.183 at 5.43e+05
assign (resid 142 and name   HN) (resid 144 and name   HN)  5.0  3.2  1.0 ! B.1991 at 2.06e+05

! E143
assign (resid 143 and name   HN) (resid 143 and name  HB#)  3.0  1.2  1.5 ! A.1488 at 3.01e+06
assign (resid 143 and name   HN) (resid 143 and name  HG#)  3.0  1.2  1.5 ! A.1489 at 2.05e+06
assign (resid 143 and name   HA) (resid 143 and name  HG#)  3.0  1.2  1.3 ! A.1109 at 5.99e+05
assign (resid 143 and name   HN) (resid 144 and name   HN)  3.0  1.2  0.5 ! A.1491 at 1.96e+06
assign (resid 143 and name   HA) (resid 144 and name   HN)  4.0  2.2  1.0 ! A.1492 at 6.79e+05
assign (resid 143 and name  HB#) (resid 144 and name   HN)  5.0  3.2  2.0 

! L144
assign (resid 144 and name   HN) (resid 144 and name  HB#)  4.0  2.2  2.0 ! A.1495 at 5.92e+05
assign (resid 144 and name   HN) (resid 144 and name   HG)  3.0  1.2  0.3 
assign (resid 144 and name   HN) (resid 144 and name HD1#)  4.0  2.2  2.0 ! B.1679 at 9.07e+05
assign (resid 144 and name   HA) (resid 144 and name   HG)  3.0  1.2  0.3 ! A.2604 at 7.65e+05
assign (resid 144 and name   HA) (resid 144 and name HD1#)  4.0  2.2  2.0 ! A.1113 at 4.14e+05
assign (resid 144 and name   HA) (resid 144 and name HD2#)  2.5  0.7  1.2 ! A.1111 at 1.52e+06
assign (resid 144 and name  HB#) (resid 144 and name HD1#)  2.5  0.7  2.2 ! A.3461 at 2.37e+06
assign (resid 144 and name   HA) (resid 145 and name  HD#)  3.0  1.2  1.3 ! A.2603 at 8.36e+05
assign (resid 144 and name HD2#) (resid 145 and name  HD#)  3.0  1.2  2.2 ! A.5598 at 1.27e+06

! P145
assign (resid 145 and name   HA) (resid 145 and name  HG#)  3.0  1.2  1.2 ! A.3187 at 1.36e+06
assign (resid 145 and name   HA) (resid 145 and name  HD#)  4.0  2.2  2.0 ! A.5161 at 3.26e+05
assign (resid 145 and name   HA) (resid 146 and name   HN)  3.0  1.2  0.5 ! B.1199 at 5.76e+06
assign (resid 145 and name  HB#) (resid 146 and name   HN)  5.0  3.2  2.0 ! A.1498 at 4.07e+05
assign (resid 145 and name  HG#) (resid 146 and name   HN)  4.0  2.2  2.0 ! C.721 at 6.37e+05
assign (resid 145 and name   HA) (resid 147 and name   HN)  4.0  2.2  1.0 ! C.971 at 6.55e+05
assign (resid 145 and name  HB#) (resid 147 and name   HN)  5.0  3.2  2.0 ! A.1506 at 3.90e+05
assign (resid 145 and name  HB#) (resid 148 and name HG2#)  4.0  2.2  2.2 ! A.5622 at 9.29e+05

! A146
assign (resid 146 and name   HN) (resid 146 and name  HB#)  3.0  1.2  1.5 ! A.1499 at 2.69e+06
assign (resid 146 and name   HN) (resid 147 and name   HN)  4.0  2.2  1.0 ! A.1497 at 1.24e+06
assign (resid 146 and name   HA) (resid 147 and name   HN)  3.0  1.2  0.5 ! C.724 at 9.84e+05
assign (resid 146 and name  HB#) (resid 147 and name   HN)  4.0  2.2  2.0 ! A.1505 at 1.10e+06
assign (resid 146 and name  HB#) (resid 147 and name  HG#)  3.0  1.2  2.3 ! A.5613 at 7.01e+05

! E147
assign (resid 147 and name   HN) (resid 147 and name   HA)  2.5  0.7  0.4 ! C.mam
assign (resid 147 and name   HN) (resid 147 and name  HB#)  3.0  1.2  1.5 ! A.1504 at 2.22e+06
assign (resid 147 and name   HN) (resid 147 and name  HG#)  4.0  2.2  2.0 ! A.1507 at 6.40e+05
assign (resid 147 and name   HA) (resid 147 and name  HG#)  2.5  0.7  1.2 ! A.2621 at 1.58e+06
assign (resid 147 and name   HN) (resid 148 and name   HN)  4.0  2.2  1.0 ! A.1511 at 8.81e+05
assign (resid 147 and name   HA) (resid 148 and name   HN)  4.0  2.2  1.0 ! A.1513 at 8.34e+05
assign (resid 147 and name  HB#) (resid 148 and name   HN)  5.0  3.2  2.0 ! A.1514 at 3.81e+05
assign (resid 147 and name  HG#) (resid 148 and name   HN)  4.0  2.2  2.0 ! C.731 at 6.76e+05
assign (resid 147 and name  HG#) (resid 148 and name HD1#)  3.0  1.2  2.3 ! B.4622 at 2.84e+05

! I148
assign (resid 148 and name   HN) (resid 148 and name   HB)  4.0  2.2  1.0 ! A.1515 at 1.50e+06
assign (resid 148 and name   HN) (resid 148 and name HG1#)  4.0  2.2  2.0 ! A.1519 at 1.07e+06
assign (resid 148 and name   HN) (resid 148 and name HG2#)  5.0  3.2  2.0 ! A.1517 at 3.71e+05
assign (resid 148 and name   HN) (resid 148 and name HD1#)  4.0  2.2  2.0 ! C.735 at 4.73e+05
assign (resid 148 and name   HA) (resid 148 and name HG1#)  3.0  1.2  1.3 ! A.3550 at 7.22e+05
assign (resid 148 and name   HA) (resid 148 and name HG2#)  2.5  0.7  1.2 ! A.1137 at 3.12e+06
assign (resid 148 and name   HA) (resid 148 and name HD1#)  2.5  0.7  1.2 ! A.1313 at 5.25e+06
assign (resid 148 and name   HB) (resid 148 and name HD1#)  3.0  1.2  1.3 ! A.2625 at 6.91e+05
assign (resid 148 and name   HA) (resid 149 and name   HN)  3.0  1.2  0.5 ! A.1522 at 1.60e+06
assign (resid 148 and name HG2#) (resid 149 and name   HN)  4.0  2.2  2.0 ! A.1524 at 6.28e+05
assign (resid 148 and name HD1#) (resid 149 and name   HN)  4.0  2.2  2.0 ! C.740 at 4.86e+05
assign (resid 148 and name HG2#) (resid 150 and name  HB#)  4.0  2.2  3.0 ! A.4316 at 4.31e+05

! N149
assign (resid 149 and name   HN) (resid 149 and name  HB1)  4.0  2.2  1.0 ! B.1215 at 7.41e+05
assign (resid 149 and name   HN) (resid 149 and name  HB2)  5.0  3.2  1.0 ! A.1525 at 4.22e+05
assign (resid 149 and name  HB1) (resid 149 and name HD2#)  4.0  2.2  2.0 ! A.1532 at 9.11e+05
assign (resid 149 and name  HB2) (resid 149 and name HD2#)  4.0  2.2  2.0 ! A.1533 at 1.14e+06
assign (resid 149 and name   HA) (resid 150 and name   HN)  4.0  2.2  1.0 ! A.1536 at 1.22e+06
assign (resid 149 and name   HA) (resid 151 and name   HN)  5.0  3.2  1.0 ! A.1542 at 4.37e+05
assign (resid 149 and name   HA) (resid 152 and name HD1#)  4.0  2.2  2.0 ! A.5632 at 4.44e+05
assign (resid 149 and name  HB1) (resid 152 and name   HN)  5.0  3.2  1.0 ! B.1703 at 3.08e+05
assign (resid 149 and name  HB1) (resid 152 and name HD1#)  3.0  1.2  1.3 ! A.2641 at 8.39e+05
assign (resid 149 and name  HB1) (resid 152 and name HD2#)  3.0  1.2  1.3 ! A.4329 at 5.05e+05
assign (resid 149 and name  HB2) (resid 152 and name   HN)  5.0  3.2  1.0 ! A.1563 at 4.20e+05
assign (resid 149 and name  HB2) (resid 152 and name HD1#)  2.5  0.7  1.2 ! A.2643 at 9.62e+05
assign (resid 149 and name  HB2) (resid 152 and name HD2#)  4.0  2.2  2.0 ! B.4799 at -1.85e+05
assign (resid 149 and name HD2#) (resid 152 and name   HG)  5.0  3.2  2.0 
assign (resid 149 and name HD2#) (resid 152 and name HD1#)  4.0  2.2  3.0 ! A.1534 at 7.82e+05
assign (resid 149 and name HD2#) (resid 152 and name HD2#)  4.0  2.2  3.0 ! B.1694 at 7.85e+05

! E150
assign (resid 150 and name   HN) (resid 150 and name  HB#)  5.0  3.2  2.0 ! B.1221 at 3.66e+05
assign (resid 150 and name   HN) (resid 150 and name  HG#)  5.0  3.2  2.0 ! B.1696 at 4.87e+05
assign (resid 150 and name   HN) (resid 151 and name   HN)  4.0  2.2  1.0 ! B.357 at 1.10e+06
assign (resid 150 and name   HA) (resid 151 and name   HN)  5.0  3.2  1.0 ! A.1544 at 4.25e+05
assign (resid 150 and name  HB#) (resid 151 and name   HN)  5.0  3.2  2.0 ! A.1550 at 4.54e+05
assign (resid 150 and name  HG#) (resid 151 and name   HN)  4.0  2.2  2.0 ! A.1547 at 1.10e+06
assign (resid 150 and name   HA) (resid 153 and name   HN)  4.0  2.2  1.0 ! A.1569 at 5.11e+05
assign (resid 150 and name   HA) (resid 153 and name   HB)  4.0  2.2  1.0 ! A.1304 at 4.30e+05
assign (resid 150 and name   HA) (resid 153 and name HD1#)  2.5  0.7  1.2 ! A.2686 at 1.53e+06
assign (resid 150 and name   HA) (resid 154 and name   HN)  4.0  2.2  1.0 ! A.783 at 1.00e+06
assign (resid 150 and name  HG#) (resid 154 and name HG2#)  3.0  1.2  2.3 ! A.4320 at 9.13e+05

! A151
assign (resid 151 and name   HN) (resid 151 and name  HB#)  2.5  0.7  1.4 ! A.1549 at 5.72e+06
assign (resid 151 and name   HN) (resid 152 and name   HN)  3.0  1.2  0.5 ! A.1541 at 2.22e+06
assign (resid 151 and name   HA) (resid 152 and name   HN)  4.0  2.2  1.0 ! A.1556 at 5.56e+05
assign (resid 151 and name  HB#) (resid 152 and name   HN)  4.0  2.2  2.0 ! A.1559 at 1.04e+06
assign (resid 151 and name  HB#) (resid 152 and name HD1#)  3.0  1.2  2.2 ! A.2649 at 1.85e+06
assign (resid 151 and name   HN) (resid 154 and name   HB)  4.0  2.2  1.0 ! A.1548 at 5.22e+05
assign (resid 151 and name   HN) (resid 154 and name HG2#)  5.0  3.2  2.0 ! B.2002 at 4.39e+05
assign (resid 151 and name   HA) (resid 154 and name   HN)  4.0  2.2  1.0 ! C.759 at 5.70e+05
assign (resid 151 and name   HA) (resid 154 and name   HB)  3.0  1.2  0.2 ! A.1186 at 1.35e+06
assign (resid 151 and name   HA) (resid 154 and name HG2#)  2.5  0.7  1.2 ! A.1548 at 1.71e+06
assign (resid 151 and name  HB#) (resid 154 and name   HB)  3.0  1.2  1.2 ! A.2651 at 1.38e+06
assign (resid 151 and name  HB#) (resid 154 and name HG2#)  3.0  1.2  2.3 ! B.3388 at 2.16e+05

! L152
assign (resid 152 and name   HN) (resid 152 and name  HB1)  4.0  2.2  1.0 ! A.1560 at 8.38e+05
assign (resid 152 and name   HN) (resid 152 and name  HB2)  3.0  1.2  0.5 ! A.1557 at 1.75e+06
assign (resid 152 and name   HN) (resid 152 and name HD1#)  4.0  2.2  2.0 ! A.1561 at 8.53e+05
assign (resid 152 and name   HN) (resid 152 and name HD2#)  3.0  1.2  1.5 ! C.752 at 7.15e+05
assign (resid 152 and name  HB1) (resid 152 and name HD1#)  3.0  1.2  1.2 ! A.3216 at 2.64e+06
assign (resid 152 and name  HB1) (resid 152 and name HD2#)  2.5  0.7  1.2 ! A.2655 at 1.15e+06
assign (resid 152 and name  HB2) (resid 152 and name HD1#)  2.5  0.7  1.2 ! A.3215 at 3.98e+06
assign (resid 152 and name  HB2) (resid 152 and name HD2#)  2.5  0.7  1.2 ! A.4321 at 1.09e+06
assign (resid 152 and name   HN) (resid 153 and name   HN)  4.0  2.2  1.0 ! A.1566 at 1.28e+06
assign (resid 152 and name  HB1) (resid 153 and name   HN)  5.0  3.2  1.0 ! A.1664 at 3.43e+05
assign (resid 152 and name  HB2) (resid 153 and name   HN)  4.0  2.2  1.0 ! A.1573 at 5.71e+05
assign (resid 152 and name HD1#) (resid 153 and name   HN)  4.0  2.2  2.0 ! A.1574 at 1.13e+06
assign (resid 152 and name   HA) (resid 155 and name   HN)  4.0  2.2  1.0 ! A.1583 at 6.76e+05

! I153
assign (resid 153 and name   HN) (resid 153 and name   HB)  3.0  1.2  0.5 ! A.1571 at 1.81e+06
assign (resid 153 and name   HN) (resid 153 and name HG1#)  4.0  2.2  2.0 ! A.1572 at 1.28e+06
assign (resid 153 and name   HN) (resid 153 and name HG2#)  4.0  2.2  2.0 ! C.756 at 5.65e+05
assign (resid 153 and name   HN) (resid 153 and name HD1#)  4.0  2.2  2.0 ! A.1575 at 5.55e+05
assign (resid 153 and name   HA) (resid 153 and name HG1#)  4.0  2.2  2.0 ! A.1159 at 4.29e+05
assign (resid 153 and name   HA) (resid 153 and name HG2#)  2.5  0.7  1.2 ! A.1165 at 2.63e+06
assign (resid 153 and name   HA) (resid 153 and name HD1#)  4.0  2.2  2.0 ! A.1174 at 8.64e+05
assign (resid 153 and name   HB) (resid 153 and name HD1#)  2.5  0.7  1.2 ! A.1177 at 2.61e+06
assign (resid 153 and name   HN) (resid 154 and name   HN)  4.0  2.2  1.0 ! A.1578 at 1.54e+06
assign (resid 153 and name   HA) (resid 154 and name   HN)  5.0  3.2  1.0 ! B.1706 at 3.46e+05
assign (resid 153 and name   HB) (resid 154 and name   HN)  4.0  2.2  1.0 ! C.760 at 4.40e+05
assign (resid 153 and name HG2#) (resid 154 and name   HN)  4.0  2.2  2.0 ! C.762 at 6.60e+05
assign (resid 153 and name   HA) (resid 155 and name   HN)  5.0  3.2  1.0 ! B.1738 at 2.94e+05
assign (resid 153 and name   HA) (resid 156 and name   HN)  4.0  2.2  1.0 ! A.1589 at 1.12e+06
assign (resid 153 and name   HA) (resid 156 and name  HB1)  4.0  2.2  1.0 ! A.1331 at 2.71e+05
assign (resid 153 and name   HA) (resid 156 and name  HB2)  4.0  2.2  1.0 ! A.1329 at 3.03e+05
assign (resid 153 and name   HA) (resid 156 and name  HD#)  4.0  2.2  3.4 ! A.4330 at 3.20e+05
assign (resid 153 and name HG2#) (resid 156 and name  HB1)  3.0  1.2  1.3 ! A.4338 at 5.31e+05
assign (resid 153 and name HG2#) (resid 156 and name  HB2)  3.0  1.2  1.3 ! A.4337 at 4.59e+05
assign (resid 153 and name   HA) (resid 157 and name   HN)  5.0  3.2  1.0 ! B.2099 at 2.36e+05
assign (resid 153 and name HG2#) (resid 157 and name   HN)  5.0  3.2  2.0 ! B.2011 at 2.27e+05
assign (resid 153 and name HG2#) (resid 157 and name  HD#)  4.0  2.2  3.6 ! A.1169 at 1.83e+06
assign (resid 153 and name HG2#) (resid 157 and name  HE#)  2.5  0.7  3.6 ! A.1170 at 1.93e+06

! V154
assign (resid 154 and name   HN) (resid 154 and name   HB)  3.0  1.2  0.5 ! A.1580 at 2.32e+06
assign (resid 154 and name   HN) (resid 154 and name HG1#)  3.0  1.2  1.5 ! C.764 at 1.16e+06
assign (resid 154 and name   HN) (resid 154 and name HG2#)  3.0  1.2  1.5 ! A.789 at 2.91e+06
assign (resid 154 and name   HA) (resid 154 and name HG1#)  2.5  0.7  1.2 ! A.1179 at 3.30e+06
assign (resid 154 and name   HA) (resid 154 and name HG2#)  2.5  0.7  1.2 ! A.1545 at 3.94e+06
assign (resid 154 and name   HN) (resid 155 and name   HN)  4.0  2.2  1.0 ! A.1577 at 1.22e+06
assign (resid 154 and name   HB) (resid 155 and name   HN)  3.0  1.2  0.5 ! A.155 at 2.11e+06
assign (resid 154 and name HG1#) (resid 155 and name   HN)  4.0  2.2  2.0 ! A.153 at 1.50e+06
assign (resid 154 and name HG1#) (resid 155 and name  HG#)  4.0  2.2  3.0 ! A.4843 at 4.34e+05
assign (resid 154 and name HG2#) (resid 155 and name   HN)  3.0  1.2  1.5 ! C.769 at 9.02e+05

! E155
assign (resid 155 and name   HN) (resid 155 and name  HB#)  3.0  1.2  1.5 ! A.156 at 2.54e+06
assign (resid 155 and name   HN) (resid 155 and name  HG#)  4.0  2.2  2.0 ! A.154 at 1.38e+06
assign (resid 155 and name   HA) (resid 155 and name  HG#)  3.0  1.2  1.2 ! A.2699 at 2.06e+06
assign (resid 155 and name   HN) (resid 156 and name   HN)  4.0  2.2  1.0 ! D.371 at 4.99e+05
assign (resid 155 and name   HA) (resid 156 and name   HN)  4.0  2.2  1.0 ! C.771 at 6.83e+05
assign (resid 155 and name  HB#) (resid 156 and name   HN)  3.0  1.2  1.5 ! A.1592 at 1.67e+06
assign (resid 155 and name  HB#) (resid 156 and name   HA)  4.0  2.2  2.0 ! A.4358 at 4.17e+05
assign (resid 155 and name  HG#) (resid 156 and name   HN)  5.0  3.2  2.0 ! B.2009 at 3.77e+05
assign (resid 155 and name   HA) (resid 158 and name   HA)  4.0  2.2  1.0 ! A.3990 at 3.88e+05
assign (resid 155 and name   HA) (resid 158 and name  HB#)  2.5  0.7  1.2 ! B.9280 at 5.72e+05

! F156
assign (resid 156 and name   HN) (resid 156 and name  HB1)  3.0  1.2  0.5 ! A.1591 at 2.19e+06
assign (resid 156 and name   HN) (resid 156 and name  HB2)  3.0  1.2  0.5 ! A.1590 at 2.15e+06
assign (resid 156 and name   HN) (resid 156 and name  HD#)  4.0  2.2  3.4 ! A.1587 at 7.38e+05
assign (resid 156 and name   HA) (resid 156 and name  HD#)  4.0  2.2  3.4 ! A.2701 at 3.12e+05
assign (resid 156 and name  HB2) (resid 156 and name  HD#)  4.0  2.2  3.4 ! A.4361 at 2.85e+05
assign (resid 156 and name   HN) (resid 157 and name   HN)  4.0  2.2  1.0 ! A.1586 at 1.05e+06
assign (resid 156 and name   HA) (resid 157 and name   HN)  4.0  2.2  1.0 ! A.1598 at 5.92e+05
assign (resid 156 and name  HB1) (resid 157 and name  HD#)  3.0  1.2  2.7 ! A.4359 at 5.39e+05
assign (resid 156 and name  HB2) (resid 157 and name   HN)  4.0  2.2  1.0 ! A.1601 at 5.18e+05
assign (resid 156 and name  HD#) (resid 157 and name   HN)  4.0  2.2  3.4 ! A.1596 at 1.06e+06
assign (resid 156 and name  HE#) (resid 157 and name   HA)  3.0  1.2  2.7 ! A.4363 at 4.49e+05
assign (resid 156 and name  HE#) (resid 157 and name  HE#)  3.0  1.2  5.1 ! A.2715 at 7.01e+05
assign (resid 156 and name   HA) (resid 159 and name  HD#)  3.0  1.2  1.3 ! A.4382 at 7.02e+05

! Y157
assign (resid 157 and name   HN) (resid 157 and name  HB1)  3.0  1.2  0.5 ! A.1599 at 1.60e+06
assign (resid 157 and name   HN) (resid 157 and name  HB2)  3.0  1.2  0.5 ! A.1600 at 2.25e+06
assign (resid 157 and name   HN) (resid 157 and name  HD#)  4.0  2.2  3.4 ! B.2167 at 8.90e+05
assign (resid 157 and name   HA) (resid 157 and name  HD#)  2.5  0.7  2.6 ! A.1211 at 9.41e+05
assign (resid 157 and name   HA) (resid 157 and name  HE#)  4.0  2.2  2.7 ! A.1859 at 7.13e+05
assign (resid 157 and name  HB1) (resid 157 and name  HD#)  4.0  2.2  2.7 ! A.1210 at 5.70e+05
assign (resid 157 and name  HB2) (resid 157 and name  HD#)  4.0  2.2  2.7 ! A.1208 at 7.26e+05
assign (resid 157 and name  HB2) (resid 157 and name  HE#)  3.0  1.2  2.7 ! A.2717 at 6.36e+05
assign (resid 157 and name   HN) (resid 158 and name   HN)  2.5  0.7  0.4 ! A.640 at 4.66e+06
assign (resid 157 and name   HA) (resid 158 and name   HN)  4.0  2.2  1.0 ! A.642 at 7.15e+05
assign (resid 157 and name  HB1) (resid 158 and name   HN)  5.0  3.2  1.0 ! A.644 at 4.02e+05
assign (resid 157 and name   HA) (resid 159 and name   HN)  4.0  2.2  1.0 ! A.1605 at 6.10e+05

! S158
assign (resid 158 and name   HN) (resid 158 and name  HB#)  3.0  1.2  1.5 ! A.635 at 2.62e+06
assign (resid 158 and name   HN) (resid 159 and name   HN)  3.0  1.2  0.5 ! A.1603 at 2.34e+06
assign (resid 158 and name   HA) (resid 159 and name   HN)  4.0  2.2  1.0 ! A.1609 at 1.53e+06
assign (resid 158 and name  HB#) (resid 159 and name   HN)  4.0  2.2  2.0 ! A.1608 at 9.30e+05

! R159
assign (resid 159 and name   HN) (resid 159 and name  HB#)  2.5  0.7  1.4 ! C.782 at 4.43e+06
assign (resid 159 and name   HN) (resid 159 and name  HB1)  4.0  2.2  1.0 ! A.1607 at 9.47e+05
assign (resid 159 and name   HN) (resid 159 and name  HG#)  3.0  1.2  1.5 ! A.1606 at 2.54e+06
assign (resid 159 and name   HN) (resid 159 and name  HD#)  4.0  2.2  2.0 ! C.1121 at 5.26e+05
assign (resid 159 and name   HA) (resid 159 and name  HG#)  2.5  0.7  1.2 ! B.860 at 1.12e+06
assign (resid 159 and name   HA) (resid 159 and name  HD#)  3.0  1.2  1.3 ! A.2722 at 8.86e+05
assign (resid 159 and name  HB1) (resid 159 and name  HD#)  2.5  0.7  1.2 ! A.2723 at 2.24e+06
assign (resid 159 and name  HB2) (resid 159 and name  HD#)  2.5  0.7  1.2 ! A.1310 at 1.65e+06

!! Hydrogen bonds based on exchange data and calculated structures 1-8-98 
! helix 1
assign (resid  15 and name    HN) (resid  11 and name     O)  1.95 0.35 0.35
assign (resid  15 and name     N) (resid  11 and name     O)  2.90 0.40 0.40
assign (resid  16 and name    HN) (resid  12 and name     O)  1.95 0.35 0.35
assign (resid  16 and name     N) (resid  12 and name     O)  2.90 0.40 0.40
! helix 2
assign (resid  30 and name    HN) (resid  26 and name     O)  1.95 0.35 0.35
assign (resid  30 and name     N) (resid  26 and name     O)  2.90 0.40 0.40
assign (resid  31 and name    HN) (resid  27 and name     O)  1.95 0.35 0.35
assign (resid  31 and name     N) (resid  27 and name     O)  2.90 0.40 0.40
assign (resid  32 and name    HN) (resid  28 and name     O)  1.95 0.35 0.35
assign (resid  32 and name     N) (resid  28 and name     O)  2.90 0.40 0.40
assign (resid  33 and name    HN) (resid  29 and name     O)  1.95 0.35 0.35
assign (resid  33 and name     N) (resid  29 and name     O)  2.90 0.40 0.40
assign (resid  34 and name    HN) (resid  30 and name     O)  1.95 0.35 0.35
assign (resid  34 and name     N) (resid  30 and name     O)  2.90 0.40 0.40
! helix 3
assign (resid  44 and name    HN) (resid  40 and name     O)  1.95 0.35 0.35
assign (resid  44 and name     N) (resid  40 and name     O)  2.90 0.40 0.40
assign (resid  45 and name    HN) (resid  41 and name     O)  1.95 0.35 0.35
assign (resid  45 and name     N) (resid  41 and name     O)  2.90 0.40 0.40
assign (resid  46 and name    HN) (resid  42 and name     O)  1.95 0.35 0.35
assign (resid  46 and name     N) (resid  42 and name     O)  2.90 0.40 0.40
assign (resid  48 and name    HN) (resid  44 and name     O)  1.95 0.35 0.35
assign (resid  48 and name     N) (resid  44 and name     O)  2.90 0.40 0.40
assign (resid  49 and name    HN) (resid  45 and name     O)  1.95 0.35 0.35
assign (resid  49 and name     N) (resid  45 and name     O)  2.90 0.40 0.40
assign (resid  51 and name    HN) (resid  47 and name     O)  1.95 0.35 0.35
assign (resid  51 and name     N) (resid  47 and name     O)  2.90 0.40 0.40
! helix 4
assign (resid  56 and name    HN) (resid  52 and name     O)  1.95 0.35 0.35
assign (resid  56 and name     N) (resid  52 and name     O)  2.90 0.40 0.40
assign (resid  57 and name    HN) (resid  53 and name     O)  1.95 0.35 0.35
assign (resid  57 and name     N) (resid  53 and name     O)  2.90 0.40 0.40
assign (resid  58 and name    HN) (resid  54 and name     O)  1.95 0.35 0.35
assign (resid  58 and name     N) (resid  54 and name     O)  2.90 0.40 0.40
assign (resid  59 and name    HN) (resid  55 and name     O)  1.95 0.35 0.35
assign (resid  59 and name     N) (resid  55 and name     O)  2.90 0.40 0.40
assign (resid  60 and name    HN) (resid  56 and name     O)  1.95 0.35 0.35
assign (resid  60 and name     N) (resid  56 and name     O)  2.90 0.40 0.40
! helix 5
assign (resid  69 and name    HN) (resid  65 and name     O)  1.95 0.35 0.35
assign (resid  69 and name     N) (resid  65 and name     O)  2.90 0.40 0.40
assign (resid  70 and name    HN) (resid  66 and name     O)  1.95 0.35 0.35
assign (resid  70 and name     N) (resid  66 and name     O)  2.90 0.40 0.40
assign (resid  72 and name    HN) (resid  68 and name     O)  1.95 0.35 0.35
assign (resid  72 and name     N) (resid  68 and name     O)  2.90 0.40 0.40
assign (resid  73 and name    HN) (resid  69 and name     O)  1.95 0.35 0.35
assign (resid  73 and name     N) (resid  69 and name     O)  2.90 0.40 0.40
assign (resid  74 and name    HN) (resid  70 and name     O)  1.95 0.35 0.35
assign (resid  74 and name     N) (resid  70 and name     O)  2.90 0.40 0.40
assign (resid  75 and name    HN) (resid  71 and name     O)  1.95 0.35 0.35
assign (resid  75 and name     N) (resid  71 and name     O)  2.90 0.40 0.40
! antiparallel sheet 
assign (resid  79 and name    HN) (resid  99 and name     O)  1.95 0.35 0.35
assign (resid  79 and name     N) (resid  99 and name     O)  2.90 0.40 0.40
assign (resid  80 and name    HN) (resid  83 and name     O)  1.95 0.35 0.35
assign (resid  80 and name     N) (resid  83 and name     O)  2.90 0.40 0.40
assign (resid  81 and name    HN) (resid  97 and name     O)  1.95 0.35 0.35
assign (resid  81 and name     N) (resid  97 and name     O)  2.90 0.40 0.40
assign (resid  85 and name    HN) (resid  78 and name     O)  1.95 0.35 0.35
assign (resid  85 and name     N) (resid  78 and name     O)  2.90 0.40 0.40
assign (resid  98 and name    HN) (resid 133 and name     O)  1.95 0.35 0.35
assign (resid  98 and name     N) (resid 133 and name     O)  2.90 0.40 0.40
assign (resid  99 and name    HN) (resid  79 and name     O)  1.95 0.35 0.35
assign (resid  99 and name     N) (resid  79 and name     O)  2.90 0.40 0.40
assign (resid 100 and name    HN) (resid 131 and name     O)  1.95 0.35 0.35
assign (resid 100 and name     N) (resid 131 and name     O)  2.90 0.40 0.40
assign (resid 101 and name    HN) (resid  77 and name     O)  1.95 0.35 0.35
assign (resid 101 and name     N) (resid  77 and name     O)  2.90 0.40 0.40
assign (resid 125 and name    HN) (resid 134 and name     O)  1.95 0.35 0.35
assign (resid 125 and name     N) (resid 134 and name     O)  2.90 0.40 0.40
assign (resid 132 and name    HN) (resid 127 and name     O)  1.95 0.35 0.35
assign (resid 132 and name     N) (resid 127 and name     O)  2.90 0.40 0.40
assign (resid 133 and name    HN) (resid  98 and name     O)  1.95 0.35 0.35
assign (resid 133 and name     N) (resid  98 and name     O)  2.90 0.40 0.40
assign (resid 134 and name    HN) (resid 125 and name     O)  1.95 0.35 0.35
assign (resid 134 and name     N) (resid 125 and name     O)  2.90 0.40 0.40
assign (resid 135 and name    HN) (resid  96 and name     O)  1.95 0.35 0.35
assign (resid 135 and name     N) (resid  96 and name     O)  2.90 0.40 0.40
assign (resid 136 and name    HN) (resid 123 and name     O)  1.95 0.35 0.35
assign (resid 136 and name     N) (resid 123 and name     O)  2.90 0.40 0.40
! helix 6
assign (resid 111 and name    HN) (resid 107 and name     O)  1.95 0.35 0.35
assign (resid 111 and name     N) (resid 107 and name     O)  2.90 0.40 0.40
assign (resid 112 and name    HN) (resid 108 and name     O)  1.95 0.35 0.35
assign (resid 112 and name     N) (resid 108 and name     O)  2.90 0.40 0.40
assign (resid 113 and name    HN) (resid 109 and name     O)  1.95 0.35 0.35
assign (resid 113 and name     N) (resid 109 and name     O)  2.90 0.40 0.40
assign (resid 114 and name    HN) (resid 110 and name     O)  1.95 0.35 0.35
assign (resid 114 and name     N) (resid 110 and name     O)  2.90 0.40 0.40
! helix 7
assign (resid 154 and name    HN) (resid 150 and name     O)  1.95 0.35 0.35
assign (resid 154 and name     N) (resid 150 and name     O)  2.90 0.40 0.40

!! Dihedral angle restraints
! backbone phi
!  extended
assign (resid  21 and name     C) (resid  22 and name     N)
       (resid  22 and name    CA) (resid  22 and name     C) 1.0 -120.0   40.0 2
assign (resid  78 and name     C) (resid  79 and name     N)
       (resid  79 and name    CA) (resid  79 and name     C) 1.0 -120.0   40.0 2
assign (resid  82 and name     C) (resid  83 and name     N)
       (resid  83 and name    CA) (resid  83 and name     C) 1.0 -120.0   40.0 2
assign (resid  84 and name     C) (resid  85 and name     N)
       (resid  85 and name    CA) (resid  85 and name     C) 1.0 -120.0   40.0 2
assign (resid  97 and name     C) (resid  98 and name     N)
       (resid  98 and name    CA) (resid  98 and name     C) 1.0 -120.0   40.0 2
assign (resid 103 and name     C) (resid 104 and name     N)
       (resid 104 and name    CA) (resid 104 and name     C) 1.0 -120.0   40.0 2
assign (resid 105 and name     C) (resid 106 and name     N)
       (resid 106 and name    CA) (resid 106 and name     C) 1.0 -120.0   40.0 2
assign (resid 117 and name     C) (resid 118 and name     N)
       (resid 118 and name    CA) (resid 118 and name     C) 1.0 -120.0   40.0 2
assign (resid 122 and name     C) (resid 123 and name     N)
       (resid 123 and name    CA) (resid 123 and name     C) 1.0 -120.0   40.0 2
assign (resid 124 and name     C) (resid 125 and name     N)
       (resid 125 and name    CA) (resid 125 and name     C) 1.0 -120.0   40.0 2
assign (resid 126 and name     C) (resid 127 and name     N)
       (resid 127 and name    CA) (resid 127 and name     C) 1.0 -120.0   40.0 2
assign (resid 133 and name     C) (resid 134 and name     N)
       (resid 134 and name    CA) (resid 134 and name     C) 1.0 -120.0   40.0 2
assign (resid 139 and name     C) (resid 140 and name     N)
       (resid 140 and name    CA) (resid 140 and name     C) 1.0 -120.0   40.0 2
assign (resid 148 and name     C) (resid 149 and name     N)
       (resid 149 and name    CA) (resid 149 and name     C) 1.0 -120.0   40.0 2
!  helical
assign (resid   4 and name     C) (resid   5 and name     N)
       (resid   5 and name    CA) (resid   5 and name     C) 1.0  -65.0   25.0 2
assign (resid   5 and name     C) (resid   6 and name     N)
       (resid   6 and name    CA) (resid   6 and name     C) 1.0  -65.0   25.0 2
assign (resid   7 and name     C) (resid   8 and name     N)
       (resid   8 and name    CA) (resid   8 and name     C) 1.0  -65.0   25.0 2
assign (resid   9 and name     C) (resid  10 and name     N)
       (resid  10 and name    CA) (resid  10 and name     C) 1.0  -65.0   25.0 2
assign (resid  10 and name     C) (resid  11 and name     N)
       (resid  11 and name    CA) (resid  11 and name     C) 1.0  -65.0   25.0 2
assign (resid  11 and name     C) (resid  12 and name     N)
       (resid  12 and name    CA) (resid  12 and name     C) 1.0  -65.0   25.0 2
assign (resid  12 and name     C) (resid  13 and name     N)
       (resid  13 and name    CA) (resid  13 and name     C) 1.0  -65.0   25.0 2
assign (resid  13 and name     C) (resid  14 and name     N)
       (resid  14 and name    CA) (resid  14 and name     C) 1.0  -65.0   25.0 2
assign (resid  15 and name     C) (resid  16 and name     N)
       (resid  16 and name    CA) (resid  16 and name     C) 1.0  -65.0   25.0 2
assign (resid  16 and name     C) (resid  17 and name     N)
       (resid  17 and name    CA) (resid  17 and name     C) 1.0  -65.0   25.0 2
assign (resid  18 and name     C) (resid  19 and name     N)
       (resid  19 and name    CA) (resid  19 and name     C) 1.0  -65.0   25.0 2
assign (resid  25 and name     C) (resid  26 and name     N)
       (resid  26 and name    CA) (resid  26 and name     C) 1.0  -65.0   25.0 2
assign (resid  26 and name     C) (resid  27 and name     N)
       (resid  27 and name    CA) (resid  27 and name     C) 1.0  -65.0   25.0 2
assign (resid  27 and name     C) (resid  28 and name     N)
       (resid  28 and name    CA) (resid  28 and name     C) 1.0  -65.0   25.0 2
assign (resid  30 and name     C) (resid  31 and name     N)
       (resid  31 and name    CA) (resid  31 and name     C) 1.0  -65.0   25.0 2
assign (resid  31 and name     C) (resid  32 and name     N)
       (resid  32 and name    CA) (resid  32 and name     C) 1.0  -65.0   25.0 2
assign (resid  32 and name     C) (resid  33 and name     N)
       (resid  33 and name    CA) (resid  33 and name     C) 1.0  -65.0   25.0 2
assign (resid  33 and name     C) (resid  34 and name     N)
       (resid  34 and name    CA) (resid  34 and name     C) 1.0  -65.0   25.0 2
assign (resid  42 and name     C) (resid  43 and name     N)
       (resid  43 and name    CA) (resid  43 and name     C) 1.0  -65.0   25.0 2
assign (resid  43 and name     C) (resid  44 and name     N)
       (resid  44 and name    CA) (resid  44 and name     C) 1.0  -65.0   25.0 2
assign (resid  44 and name     C) (resid  45 and name     N)
       (resid  45 and name    CA) (resid  45 and name     C) 1.0  -65.0   25.0 2
assign (resid  45 and name     C) (resid  46 and name     N)
       (resid  46 and name    CA) (resid  46 and name     C) 1.0  -65.0   25.0 2
assign (resid  47 and name     C) (resid  48 and name     N)
       (resid  48 and name    CA) (resid  48 and name     C) 1.0  -65.0   25.0 2
assign (resid  50 and name     C) (resid  51 and name     N)
       (resid  51 and name    CA) (resid  51 and name     C) 1.0  -65.0   25.0 2
assign (resid  51 and name     C) (resid  52 and name     N)
       (resid  52 and name    CA) (resid  52 and name     C) 1.0  -65.0   25.0 2
assign (resid  53 and name     C) (resid  54 and name     N)
       (resid  54 and name    CA) (resid  54 and name     C) 1.0  -65.0   25.0 2
assign (resid  54 and name     C) (resid  55 and name     N)
       (resid  55 and name    CA) (resid  55 and name     C) 1.0  -65.0   25.0 2
assign (resid  55 and name     C) (resid  56 and name     N)
       (resid  56 and name    CA) (resid  56 and name     C) 1.0  -65.0   25.0 2
assign (resid  56 and name     C) (resid  57 and name     N)
       (resid  57 and name    CA) (resid  57 and name     C) 1.0  -65.0   25.0 2
assign (resid  57 and name     C) (resid  58 and name     N)
       (resid  58 and name    CA) (resid  58 and name     C) 1.0  -65.0   25.0 2
assign (resid  58 and name     C) (resid  59 and name     N)
       (resid  59 and name    CA) (resid  59 and name     C) 1.0  -65.0   25.0 2
assign (resid  59 and name     C) (resid  60 and name     N)
       (resid  60 and name    CA) (resid  60 and name     C) 1.0  -65.0   25.0 2
assign (resid  61 and name     C) (resid  62 and name     N)
       (resid  62 and name    CA) (resid  62 and name     C) 1.0  -65.0   25.0 2
assign (resid  63 and name     C) (resid  64 and name     N)
       (resid  64 and name    CA) (resid  64 and name     C) 1.0  -65.0   25.0 2
assign (resid  66 and name     C) (resid  67 and name     N)
       (resid  67 and name    CA) (resid  67 and name     C) 1.0  -65.0   25.0 2
assign (resid  67 and name     C) (resid  68 and name     N)
       (resid  68 and name    CA) (resid  68 and name     C) 1.0  -65.0   25.0 2
assign (resid  68 and name     C) (resid  69 and name     N)
       (resid  69 and name    CA) (resid  69 and name     C) 1.0  -65.0   25.0 2
assign (resid  70 and name     C) (resid  71 and name     N)
       (resid  71 and name    CA) (resid  71 and name     C) 1.0  -65.0   25.0 2
assign (resid  72 and name     C) (resid  73 and name     N)
       (resid  73 and name    CA) (resid  73 and name     C) 1.0  -65.0   25.0 2
assign (resid  73 and name     C) (resid  74 and name     N)
       (resid  74 and name    CA) (resid  74 and name     C) 1.0  -65.0   25.0 2
assign (resid  83 and name     C) (resid  84 and name     N)
       (resid  84 and name    CA) (resid  84 and name     C) 1.0  -65.0   25.0 2
assign (resid  89 and name     C) (resid  90 and name     N)
       (resid  90 and name    CA) (resid  90 and name     C) 1.0  -65.0   25.0 2
assign (resid 106 and name     C) (resid 107 and name     N)
       (resid 107 and name    CA) (resid 107 and name     C) 1.0  -65.0   25.0 2
assign (resid 108 and name     C) (resid 109 and name     N)
       (resid 109 and name    CA) (resid 109 and name     C) 1.0  -65.0   25.0 2
assign (resid 110 and name     C) (resid 111 and name     N)
       (resid 111 and name    CA) (resid 111 and name     C) 1.0  -65.0   25.0 2
assign (resid 111 and name     C) (resid 112 and name     N)
       (resid 112 and name    CA) (resid 112 and name     C) 1.0  -65.0   25.0 2
assign (resid 112 and name     C) (resid 113 and name     N)
       (resid 113 and name    CA) (resid 113 and name     C) 1.0  -65.0   25.0 2
assign (resid 113 and name     C) (resid 114 and name     N)
       (resid 114 and name    CA) (resid 114 and name     C) 1.0  -65.0   25.0 2
assign (resid 114 and name     C) (resid 115 and name     N)
       (resid 115 and name    CA) (resid 115 and name     C) 1.0  -65.0   25.0 2
assign (resid 121 and name     C) (resid 122 and name     N)
       (resid 122 and name    CA) (resid 122 and name     C) 1.0  -65.0   25.0 2
assign (resid 137 and name     C) (resid 138 and name     N)
       (resid 138 and name    CA) (resid 138 and name     C) 1.0  -65.0   25.0 2
assign (resid 141 and name     C) (resid 142 and name     N)
       (resid 142 and name    CA) (resid 142 and name     C) 1.0  -65.0   25.0 2
assign (resid 150 and name     C) (resid 151 and name     N)
       (resid 151 and name    CA) (resid 151 and name     C) 1.0  -65.0   25.0 2
assign (resid 151 and name     C) (resid 152 and name     N)
       (resid 152 and name    CA) (resid 152 and name     C) 1.0  -65.0   25.0 2
assign (resid 152 and name     C) (resid 153 and name     N)
       (resid 153 and name    CA) (resid 153 and name     C) 1.0  -65.0   25.0 2
assign (resid 153 and name     C) (resid 154 and name     N)
       (resid 154 and name    CA) (resid 154 and name     C) 1.0  -65.0   25.0 2
assign (resid 154 and name     C) (resid 155 and name     N)
       (resid 155 and name    CA) (resid 155 and name     C) 1.0  -65.0   25.0 2
assign (resid 155 and name     C) (resid 156 and name     N)
       (resid 156 and name    CA) (resid 156 and name     C) 1.0  -65.0   25.0 2
! chi one                                                                     
!  LEU   3
assign (resid   3 and name     N) (resid   3 and name    CA)
       (resid   3 and name    CB) (resid   3 and name    CG) 1.0  -60.0   40.0 2
!  THR  30
assign (resid  30 and name     N) (resid  30 and name    CA)
       (resid  30 and name    CB) (resid  30 and name   OG1) 1.0  -60.0   40.0 2
!  GLU  33
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   40.0 2
!  LYS  36
assign (resid  36 and name     N) (resid  36 and name    CA)
       (resid  36 and name    CB) (resid  36 and name    CG) 1.0  -60.0   40.0 2
!  MET  37
assign (resid  37 and name     N) (resid  37 and name    CA)
       (resid  37 and name    CB) (resid  37 and name    CG) 1.0  -60.0   40.0 2
!  LYS  40
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   40.0 2
!  ILE  47
assign (resid  47 and name     N) (resid  47 and name    CA)
       (resid  47 and name    CB) (resid  47 and name   CG1) 1.0  -60.0   40.0 2
!  VAL  57
assign (resid  57 and name     N) (resid  57 and name    CA)
       (resid  57 and name    CB) (resid  57 and name   CG2) 1.0  -60.0   40.0 2
!  TYR  58
assign (resid  58 and name     N) (resid  58 and name    CA)
       (resid  58 and name    CB) (resid  58 and name    CG) 1.0  180.0   40.0 2
!  LEU  62
assign (resid  62 and name     N) (resid  62 and name    CA)
       (resid  62 and name    CB) (resid  62 and name    CG) 1.0  -60.0   40.0 2
!  ARG  64
assign (resid  64 and name     N) (resid  64 and name    CA)
       (resid  64 and name    CB) (resid  64 and name    CG) 1.0  -60.0   40.0 2
!  THR  65
assign (resid  65 and name     N) (resid  65 and name    CA)
       (resid  65 and name    CB) (resid  65 and name   OG1) 1.0   60.0   40.0 2
!  GLN  71
assign (resid  71 and name     N) (resid  71 and name    CA)
       (resid  71 and name    CB) (resid  71 and name    CG) 1.0  -60.0   40.0 2
!  LEU  72
assign (resid  72 and name     N) (resid  72 and name    CA)
       (resid  72 and name    CB) (resid  72 and name    CG) 1.0  -60.0   40.0 2
!  VAL  73
assign (resid  73 and name     N) (resid  73 and name    CA)
       (resid  73 and name    CB) (resid  73 and name   CG2) 1.0  -60.0   40.0 2
!  HIS  75
assign (resid  75 and name     N) (resid  75 and name    CA)
       (resid  75 and name    CB) (resid  75 and name    CG) 1.0  -60.0   40.0 2
!  HIS  77
assign (resid  77 and name     N) (resid  77 and name    CA)
       (resid  77 and name    CB) (resid  77 and name    CG) 1.0  -60.0   40.0 2
!  VAL  80
assign (resid  80 and name     N) (resid  80 and name    CA)
       (resid  80 and name    CB) (resid  80 and name   CG2) 1.0  -60.0   40.0 2
!  SER  83
assign (resid  83 and name     N) (resid  83 and name    CA)
       (resid  83 and name    CB) (resid  83 and name    OG) 1.0  -60.0   40.0 2
!  ILE  87
assign (resid  87 and name     N) (resid  87 and name    CA)
       (resid  87 and name    CB) (resid  87 and name   CG1) 1.0  -60.0   40.0 2
!  VAL  92
assign (resid  92 and name     N) (resid  92 and name    CA)
       (resid  92 and name    CB) (resid  92 and name   CG2) 1.0  -60.0   40.0 2
!  VAL 100
assign (resid 100 and name     N) (resid 100 and name    CA)
       (resid 100 and name    CB) (resid 100 and name   CG2) 1.0  -60.0   40.0 2
!  SER 104
assign (resid 104 and name     N) (resid 104 and name    CA)
       (resid 104 and name    CB) (resid 104 and name    OG) 1.0  -60.0   40.0 2
!  ASN 106
assign (resid 106 and name     N) (resid 106 and name    CA)
       (resid 106 and name    CB) (resid 106 and name    CG) 1.0  -60.0   40.0 2
!  LEU 107
assign (resid 107 and name     N) (resid 107 and name    CA)
       (resid 107 and name    CB) (resid 107 and name    CG) 1.0  -60.0   40.0 2
!  VAL 109
assign (resid 109 and name     N) (resid 109 and name    CA)
       (resid 109 and name    CB) (resid 109 and name   CG2) 1.0  180.0   40.0 2
!  ILE 110
assign (resid 110 and name     N) (resid 110 and name    CA)
       (resid 110 and name    CB) (resid 110 and name   CG1) 1.0  -60.0   40.0 2
!  LEU 114
assign (resid 114 and name     N) (resid 114 and name    CA)
       (resid 114 and name    CB) (resid 114 and name    CG) 1.0  -60.0   40.0 2
!  ILE 120
assign (resid 120 and name     N) (resid 120 and name    CA)
       (resid 120 and name    CB) (resid 120 and name   CG1) 1.0  -60.0   40.0 2
!  LEU 124
assign (resid 124 and name     N) (resid 124 and name    CA)
       (resid 124 and name    CB) (resid 124 and name    CG) 1.0  -60.0   40.0 2
!  LYS 130
assign (resid 130 and name     N) (resid 130 and name    CA)
       (resid 130 and name    CB) (resid 130 and name    CG) 1.0  -60.0   40.0 2
!  THR 134
assign (resid 134 and name     N) (resid 134 and name    CA)
       (resid 134 and name    CB) (resid 134 and name   OG1) 1.0  -60.0   40.0 2
!  GLU 140
assign (resid 140 and name     N) (resid 140 and name    CA)
       (resid 140 and name    CB) (resid 140 and name    CG) 1.0  -60.0   40.0 2
!  SER 142
assign (resid 142 and name     N) (resid 142 and name    CA)
       (resid 142 and name    CB) (resid 142 and name    OG) 1.0   60.0   40.0 2
!  ILE 148
assign (resid 148 and name     N) (resid 148 and name    CA)
       (resid 148 and name    CB) (resid 148 and name   CG1) 1.0  -60.0   40.0 2
!  ASN 149
assign (resid 149 and name     N) (resid 149 and name    CA)
       (resid 149 and name    CB) (resid 149 and name    CG) 1.0  180.0   40.0 2
!  LEU 152
assign (resid 152 and name     N) (resid 152 and name    CA)
       (resid 152 and name    CB) (resid 152 and name    CG) 1.0  -60.0   40.0 2
!  ILE 153
assign (resid 153 and name     N) (resid 153 and name    CA)
       (resid 153 and name    CB) (resid 153 and name   CG1) 1.0  -60.0   40.0 2
!  VAL 154
assign (resid 154 and name     N) (resid 154 and name    CA)
       (resid 154 and name    CB) (resid 154 and name   CG2) 1.0  -60.0   40.0 2
!  PHE 156
assign (resid 156 and name     N) (resid 156 and name    CA)
       (resid 156 and name    CB) (resid 156 and name    CG) 1.0  180.0   40.0 2
!  TYR 157
assign (resid 157 and name     N) (resid 157 and name    CA)
       (resid 157 and name    CB) (resid 157 and name    CG) 1.0  -60.0   40.0 2
!  ARG 159
assign (resid 159 and name     N) (resid 159 and name    CA)
       (resid 159 and name    CB) (resid 159 and name    CG) 1.0  -60.0   40.0 2
! chi two
!  EXAMPLE  00
!assign (resid  00 and name    CA) (resid  00 and name    CB)
!       (resid  00 and name    CG) (resid  00 and name   CD1) 1.0  180.0   40.0 

!! Dipolar coupling restraints
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name    N)
       ( resid     6 and name   HN) -25.9540  7.0000  7.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name    N)
       ( resid     7 and name   HN) -21.3490  2.3880  2.3880

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name    N)
       ( resid     8 and name   HN) -26.6520  2.9440  2.9440

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name    N)
       ( resid    12 and name   HN) -25.1380  2.3460  2.3460

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name    N)
       ( resid    13 and name   HN) -21.1090  2.2650  2.2650

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name    N)
       ( resid    14 and name   HN) -26.8570  2.1820  2.1820

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name    N)
       ( resid    20 and name   HN) -13.6360  7.0000  7.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name    N)
       ( resid    21 and name   HN) -21.8760  3.2810  3.2810

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name    N)
       ( resid    22 and name   HN) -13.8260  1.1690  1.1690

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name    N)
       ( resid    23 and name   HN) -21.0150  1.1370  1.1370

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name    N)
       ( resid    24 and name   HN) 19.5070  2.0500  2.0500

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name    N)
       ( resid    25 and name   HN)  9.2550  1.6990  1.6990

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    26 and name    N)
       ( resid    26 and name   HN)  4.5950  3.0840  3.0840

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    27 and name    N)
       ( resid    27 and name   HN) 22.7480  2.3210  2.3210

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    35 and name    N)
       ( resid    35 and name   HN) 24.5700  1.0020  1.0020

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name    N)
       ( resid    36 and name   HN) -1.2950  2.7100  2.7100

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name    N)
       ( resid    37 and name   HN)  9.1280  4.9160  4.9160

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name    N)
       ( resid    39 and name   HN) -9.0210  1.0640  1.0640

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name    N)
       ( resid    40 and name   HN) -2.3500  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name    N)
       ( resid    41 and name   HN) -15.3890  2.6080  2.6080

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name    N)
       ( resid    42 and name   HN) -16.2070  1.7260  1.7260

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name    N)
       ( resid    43 and name   HN) -7.1660  2.2340  2.2340

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name    N)
       ( resid    52 and name   HN) -23.0720  1.8280  1.8280

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    53 and name    N)
       ( resid    53 and name   HN)  2.8400  1.7540  1.7540

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    54 and name    N)
       ( resid    54 and name   HN)  0.4550  1.7470  1.7470

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    55 and name    N)
       ( resid    55 and name   HN) -0.7650  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    57 and name    N)
       ( resid    57 and name   HN) 11.0740  1.7170  1.7170

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    58 and name    N)
       ( resid    58 and name   HN)  7.5320  5.2810  5.2810

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name    N)
       ( resid    59 and name   HN)  5.0180  2.8070  2.8070

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name    N)
       ( resid    61 and name   HN) -6.3210  2.7830  2.7830

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    63 and name    N)
       ( resid    63 and name   HN)  4.2970  4.7880  4.7880

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    64 and name    N)
       ( resid    64 and name   HN)  1.8770  1.1850  1.1850

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name    N)
       ( resid    65 and name   HN) -11.6840  1.7120  1.7120

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    68 and name    N)
       ( resid    68 and name   HN) -2.7940  2.3910  2.3910

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name    N)
       ( resid    69 and name   HN) -13.9800  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    71 and name    N)
       ( resid    71 and name   HN) -4.2880  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    72 and name    N)
       ( resid    72 and name   HN) -11.3620  2.4500  2.4500

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    74 and name    N)
       ( resid    74 and name   HN) -14.2430  2.8190  2.8190

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    75 and name    N)
       ( resid    75 and name   HN)  0.9270  2.1500  2.1500

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    76 and name    N)
       ( resid    76 and name   HN) -16.8410  4.1320  4.1320

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    77 and name    N)
       ( resid    77 and name   HN) -18.4390  2.9140  2.9140

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    78 and name    N)
       ( resid    78 and name   HN)  9.8090  1.6180  1.6180

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    79 and name    N)
       ( resid    79 and name   HN)  8.2840  1.8100  1.8100

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    81 and name    N)
       ( resid    81 and name   HN) -2.9290  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    82 and name    N)
       ( resid    82 and name   HN) -6.0730  1.8990  1.8990

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    83 and name    N)
       ( resid    83 and name   HN) -9.0910  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    84 and name    N)
       ( resid    84 and name   HN) -16.6920  5.1410  5.1410

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    85 and name    N)
       ( resid    85 and name   HN)  1.4220  1.0410  1.0410

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    87 and name    N)
       ( resid    87 and name   HN) 15.3220  2.8390  2.8390

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    89 and name    N)
       ( resid    89 and name   HN) 11.9110  2.9620  2.9620

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    90 and name    N)
       ( resid    90 and name   HN) -6.1070  1.9140  1.9140

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    92 and name    N)
       ( resid    92 and name   HN) -4.7950  1.7680  1.7680

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    93 and name    N)
       ( resid    93 and name   HN) -21.8190  1.1780  1.1780

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    95 and name    N)
       ( resid    95 and name   HN)  0.4970  4.8430  4.8430

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    97 and name    N)
       ( resid    97 and name   HN) -5.0230  1.3910  1.3910

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    98 and name    N)
       ( resid    98 and name   HN) 12.8150  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    99 and name    N)
       ( resid    99 and name   HN) 11.0860  1.0860  1.0860

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   100 and name    N)
       ( resid   100 and name   HN) 15.1290  1.0320  1.0320

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   101 and name    N)
       ( resid   101 and name   HN)  1.2640  1.1340  1.1340

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   102 and name    N)
       ( resid   102 and name   HN)  0.9370  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   104 and name    N)
       ( resid   104 and name   HN)  8.2910  2.4030  2.4030

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   105 and name    N)
       ( resid   105 and name   HN) -16.7570  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   106 and name    N)
       ( resid   106 and name   HN)  0.2400  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   107 and name    N)
       ( resid   107 and name   HN)  2.2960  1.0230  1.0230

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   108 and name    N)
       ( resid   108 and name   HN)  8.9660  1.8600  1.8600

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   109 and name    N)
       ( resid   109 and name   HN) 13.4430  2.1040  2.1040

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   110 and name    N)
       ( resid   110 and name   HN) -15.0560  2.3270  2.3270

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   111 and name    N)
       ( resid   111 and name   HN)  6.2210  1.5400  1.5400

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   113 and name    N)
       ( resid   113 and name   HN) -2.5670  3.2960  3.2960

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   115 and name    N)
       ( resid   115 and name   HN) 16.7970  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   116 and name    N)
       ( resid   116 and name   HN)  8.4370  1.4960  1.4960

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   120 and name    N)
       ( resid   120 and name   HN) 15.4750  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   122 and name    N)
       ( resid   122 and name   HN) -19.2130  3.6270  3.6270

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   123 and name    N)
       ( resid   123 and name   HN) -1.3760  2.4580  2.4580

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   124 and name    N)
       ( resid   124 and name   HN) -2.9010  2.0950  2.0950

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   125 and name    N)
       ( resid   125 and name   HN)  5.5460  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   126 and name    N)
       ( resid   126 and name   HN)  7.5490  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   127 and name    N)
       ( resid   127 and name   HN) 13.4540  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   129 and name    N)
       ( resid   129 and name   HN) 12.3570  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   130 and name    N)
       ( resid   130 and name   HN)  2.1900  2.6670  2.6670

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   131 and name    N)
       ( resid   131 and name   HN) 11.3090  2.2810  2.2810

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   132 and name    N)
       ( resid   132 and name   HN) 14.1670  7.0000  7.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   133 and name    N)
       ( resid   133 and name   HN) 19.0010  1.4530  1.4530

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   134 and name    N)
       ( resid   134 and name   HN)  6.0620  1.5700  1.5700

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   135 and name    N)
       ( resid   135 and name   HN) -5.1170  4.4560  4.4560

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   136 and name    N)
       ( resid   136 and name   HN) -1.3310  2.3500  2.3500

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   137 and name    N)
       ( resid   137 and name   HN) 13.6010  1.5560  1.5560

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   138 and name    N)
       ( resid   138 and name   HN) 14.6630  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   140 and name    N)
       ( resid   140 and name   HN) -8.4210  2.3260  2.3260

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   141 and name    N)
       ( resid   141 and name   HN)  2.9200  1.0000  1.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   142 and name    N)
       ( resid   142 and name   HN) 11.6440  3.2880  3.2880

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   146 and name    N)
       ( resid   146 and name   HN) -3.4700  6.3420  6.3420

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   147 and name    N)
       ( resid   147 and name   HN) -20.2160  2.9660  2.9660

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   148 and name    N)
       ( resid   148 and name   HN) 10.7810  1.4710  1.4710

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   149 and name    N)
       ( resid   149 and name   HN) 26.0590  2.1990  2.1990

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   150 and name    N)
       ( resid   150 and name   HN)  8.4040  7.0000  7.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   151 and name    N)
       ( resid   151 and name   HN)  9.8150  1.5070  1.5070

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   153 and name    N)
       ( resid   153 and name   HN) 17.3450  3.0940  3.0940

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   155 and name    N)
       ( resid   155 and name   HN) 12.0360  1.5770  1.5770

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   156 and name    N)
       ( resid   156 and name   HN)  5.2230  3.1020  3.1020

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid   157 and name    N)
       ( resid   157 and name   HN) 18.1160  1.3180  1.3180

  Entry H atom name         Submitted Coord H atom name
    1   1H    MET   1           HT1      MET   1  32.200  -4.709  16.412
    2   2H    MET   1           HT2      MET   1  33.148  -5.101  17.766
    3   3H    MET   1           HT3      MET   1  33.524  -3.736  16.828
    4    HA   MET   1           HA       MET   1  31.111  -4.120  18.508
    5   1HB   MET   1           HB2      MET   1  32.363  -1.793  19.332
    6   2HB   MET   1           HB1      MET   1  32.561  -3.356  20.110
    7   1HG   MET   1           HG2      MET   1  34.306  -2.432  17.814
    8   2HG   MET   1           HG1      MET   1  34.721  -2.161  19.504
    9   1HE   MET   1           HE1      MET   1  35.456  -5.336  21.081
   10   2HE   MET   1           HE2      MET   1  33.709  -5.255  20.873
   11   3HE   MET   1           HE3      MET   1  34.619  -3.782  21.199
   12    H    LYS   2           HN       LYS   2  32.924  -1.747  16.520
   13    HA   LYS   2           HA       LYS   2  30.559  -0.086  16.162
   14   1HB   LYS   2           HB2      LYS   2  33.218  -0.087  14.700
   15   2HB   LYS   2           HB1      LYS   2  31.987   1.170  14.571
   16   1HG   LYS   2           HG2      LYS   2  32.161   1.377  17.126
   17   2HG   LYS   2           HG1      LYS   2  33.634   0.416  16.991
   18   1HD   LYS   2           HD2      LYS   2  33.124   3.006  15.495
   19   2HD   LYS   2           HD1      LYS   2  34.089   2.870  16.966
   20   1HE   LYS   2           HE2      LYS   2  35.467   1.104  15.696
   21   2HE   LYS   2           HE1      LYS   2  34.666   1.699  14.242
   22   1HZ   LYS   2           HZ1      LYS   2  35.715   3.693  14.361
   23   2HZ   LYS   2           HZ2      LYS   2  36.907   2.734  15.100
   24   3HZ   LYS   2           HZ3      LYS   2  35.852   3.665  16.051
   25    H    LEU   3           HN       LEU   3  28.898  -0.932  14.976
   26    HA   LEU   3           HA       LEU   3  29.206  -2.919  12.942
   27   1HB   LEU   3           HB2      LEU   3  27.006  -1.091  13.825
   28   2HB   LEU   3           HB1      LEU   3  26.818  -1.926  12.285
   29    HG   LEU   3           HG       LEU   3  27.678  -3.511  14.704
   30   1HD1  LEU   3          HD11      LEU   3  25.240  -3.957  15.131
   31   2HD1  LEU   3          HD12      LEU   3  24.869  -2.594  14.074
   32   3HD1  LEU   3          HD13      LEU   3  25.775  -2.334  15.566
   33   1HD2  LEU   3          HD21      LEU   3  25.788  -4.242  12.454
   34   2HD2  LEU   3          HD22      LEU   3  26.675  -5.328  13.524
   35   3HD2  LEU   3          HD23      LEU   3  27.537  -4.402  12.296
   36    H    SER   4           HN       SER   4  29.598  -2.716  10.758
   37    HA   SER   4           HA       SER   4  30.521  -0.129   9.773
   38   1HB   SER   4           HB2      SER   4  31.728  -1.995   8.938
   39   2HB   SER   4           HB1      SER   4  30.254  -2.879   8.552
   40    HG   SER   4           HG       SER   4  29.851  -1.410   6.906
   41    H    GLU   5           HN       GLU   5  29.678   0.350   7.352
   42    HA   GLU   5           HA       GLU   5  26.907   1.122   7.656
   43   1HB   GLU   5           HB2      GLU   5  28.685   2.355   6.307
   44   2HB   GLU   5           HB1      GLU   5  28.495   1.101   5.081
   45   1HG   GLU   5           HG2      GLU   5  26.056   1.619   4.981
   46   2HG   GLU   5           HG1      GLU   5  26.320   2.941   6.119
   47    H    TYR   6           HN       TYR   6  28.588  -1.480   5.977
   48    HA   TYR   6           HA       TYR   6  26.624  -2.446   4.255
   49   1HB   TYR   6           HB2      TYR   6  28.916  -3.432   4.603
   50   2HB   TYR   6           HB1      TYR   6  28.306  -4.193   6.072
   51    HD1  TYR   6           HD1      TYR   6  28.484  -4.377   2.464
   52    HD2  TYR   6           HD2      TYR   6  26.330  -5.782   5.905
   53    HE1  TYR   6           HE1      TYR   6  27.548  -6.239   1.119
   54    HE2  TYR   6           HE2      TYR   6  25.394  -7.643   4.560
   55    HH   TYR   6           HH       TYR   6  26.613  -8.512   1.529
   56    H    GLY   7           HN       GLY   7  26.767  -2.760   7.777
   57   1HA   GLY   7           HA2      GLY   7  24.471  -4.555   7.894
   58   2HA   GLY   7           HA1      GLY   7  25.237  -3.765   9.272
   59    H    LEU   8           HN       LEU   8  25.004  -1.067   8.229
   60    HA   LEU   8           HA       LEU   8  22.366  -0.442   9.175
   61   1HB   LEU   8           HB2      LEU   8  24.124   1.361   7.499
   62   2HB   LEU   8           HB1      LEU   8  22.897   1.842   8.671
   63    HG   LEU   8           HG       LEU   8  25.455   0.348   9.323
   64   1HD1  LEU   8          HD11      LEU   8  25.618   2.814   8.647
   65   2HD1  LEU   8          HD12      LEU   8  26.266   2.398  10.234
   66   3HD1  LEU   8          HD13      LEU   8  24.685   3.167  10.101
   67   1HD2  LEU   8          HD21      LEU   8  23.096   1.279  10.969
   68   2HD2  LEU   8          HD22      LEU   8  24.685   1.058  11.703
   69   3HD2  LEU   8          HD23      LEU   8  23.866  -0.308  10.951
   70    H    GLN   9           HN       GLN   9  23.721  -0.848   5.935
   71    HA   GLN   9           HA       GLN   9  21.547   0.239   4.449
   72   1HB   GLN   9           HB2      GLN   9  23.172  -2.204   3.655
   73   2HB   GLN   9           HB1      GLN   9  22.350  -1.078   2.581
   74   1HG   GLN   9           HG2      GLN   9  23.996   0.658   3.935
   75   2HG   GLN   9           HG1      GLN   9  24.975  -0.801   3.968
   76   1HE2  GLN   9          HE21      GLN   9  25.756   1.493   2.440
   77   2HE2  GLN   9          HE22      GLN   9  25.684   1.085   0.794
   78    H    LEU  10           HN       LEU  10  22.159  -3.251   5.042
   79    HA   LEU  10           HA       LEU  10  19.564  -4.083   4.264
   80   1HB   LEU  10           HB2      LEU  10  21.919  -5.323   5.233
   81   2HB   LEU  10           HB1      LEU  10  20.664  -5.800   6.372
   82    HG   LEU  10           HG       LEU  10  19.248  -6.388   4.296
   83   1HD1  LEU  10          HD11      LEU  10  20.293  -6.622   2.213
   84   2HD1  LEU  10          HD12      LEU  10  21.914  -6.625   2.906
   85   3HD1  LEU  10          HD13      LEU  10  21.001  -5.123   2.804
   86   1HD2  LEU  10          HD21      LEU  10  21.762  -7.905   5.037
   87   2HD2  LEU  10          HD22      LEU  10  20.500  -8.574   4.002
   88   3HD2  LEU  10          HD23      LEU  10  20.135  -8.146   5.673
   89    H    GLN  11           HN       GLN  11  20.761  -2.929   7.390
   90    HA   GLN  11           HA       GLN  11  18.594  -3.648   9.038
   91   1HB   GLN  11           HB2      GLN  11  20.652  -2.429   9.803
   92   2HB   GLN  11           HB1      GLN  11  20.019  -0.967   9.047
   93   1HG   GLN  11           HG2      GLN  11  17.999  -1.118  10.480
   94   2HG   GLN  11           HG1      GLN  11  18.679  -2.545  11.263
   95   1HE2  GLN  11          HE21      GLN  11  21.001  -0.141  10.329
   96   2HE2  GLN  11          HE22      GLN  11  21.252   0.519  11.873
   97    H    GLU  12           HN       GLU  12  18.956  -0.753   7.003
   98    HA   GLU  12           HA       GLU  12  16.426   0.408   7.455
   99   1HB   GLU  12           HB2      GLU  12  18.180   0.363   4.989
  100   2HB   GLU  12           HB1      GLU  12  16.696   1.312   5.081
  101   1HG   GLU  12           HG2      GLU  12  18.879   1.532   7.161
  102   2HG   GLU  12           HG1      GLU  12  18.852   2.539   5.713
  103    H    LYS  13           HN       LYS  13  17.365  -2.121   5.116
  104    HA   LYS  13           HA       LYS  13  14.833  -2.368   3.832
  105   1HB   LYS  13           HB2      LYS  13  16.856  -3.448   2.948
  106   2HB   LYS  13           HB1      LYS  13  16.916  -4.510   4.354
  107   1HG   LYS  13           HG2      LYS  13  14.950  -5.661   3.725
  108   2HG   LYS  13           HG1      LYS  13  14.455  -4.390   2.608
  109   1HD   LYS  13           HD2      LYS  13  15.376  -6.439   1.473
  110   2HD   LYS  13           HD1      LYS  13  16.237  -4.954   1.072
  111   1HE   LYS  13           HE2      LYS  13  18.062  -5.500   2.485
  112   2HE   LYS  13           HE1      LYS  13  17.145  -6.752   3.323
  113   1HZ   LYS  13           HZ1      LYS  13  18.700  -6.962   0.970
  114   2HZ   LYS  13           HZ2      LYS  13  17.096  -7.414   0.641
  115   3HZ   LYS  13           HZ3      LYS  13  17.965  -8.192   1.876
  116    H    GLN  14           HN       GLN  14  16.133  -3.867   6.774
  117    HA   GLN  14           HA       GLN  14  14.042  -5.698   7.285
  118   1HB   GLN  14           HB2      GLN  14  16.202  -5.508   8.570
  119   2HB   GLN  14           HB1      GLN  14  15.529  -4.092   9.378
  120   1HG   GLN  14           HG2      GLN  14  13.633  -5.464  10.186
  121   2HG   GLN  14           HG1      GLN  14  14.338  -6.881   9.407
  122   1HE2  GLN  14          HE21      GLN  14  16.752  -7.290  10.124
  123   2HE2  GLN  14          HE22      GLN  14  17.085  -7.062  11.773
  124    H    LYS  15           HN       LYS  15  14.292  -2.250   8.108
  125    HA   LYS  15           HA       LYS  15  11.801  -2.162   9.559
  126   1HB   LYS  15           HB2      LYS  15  12.849   0.249   8.093
  127   2HB   LYS  15           HB1      LYS  15  12.145   0.142   9.708
  128   1HG   LYS  15           HG2      LYS  15  14.210  -1.203  10.371
  129   2HG   LYS  15           HG1      LYS  15  14.909  -0.709   8.831
  130   1HD   LYS  15           HD2      LYS  15  14.036   1.077  11.114
  131   2HD   LYS  15           HD1      LYS  15  15.663   0.880  10.467
  132   1HE   LYS  15           HE2      LYS  15  14.660   1.731   8.233
  133   2HE   LYS  15           HE1      LYS  15  13.304   2.283   9.216
  134   1HZ   LYS  15           HZ1      LYS  15  15.981   2.944  10.161
  135   2HZ   LYS  15           HZ2      LYS  15  14.548   3.855  10.225
  136   3HZ   LYS  15           HZ3      LYS  15  15.437   3.765   8.780
  137    H    LEU  16           HN       LEU  16  12.520  -0.672   6.387
  138    HA   LEU  16           HA       LEU  16   9.909  -0.203   5.578
  139   1HB   LEU  16           HB2      LEU  16  12.028   0.445   4.353
  140   2HB   LEU  16           HB1      LEU  16  12.082  -1.198   3.721
  141    HG   LEU  16           HG       LEU  16   9.838  -0.871   2.712
  142   1HD1  LEU  16          HD11      LEU  16   8.644   0.737   3.870
  143   2HD1  LEU  16          HD12      LEU  16   9.269   1.758   2.580
  144   3HD1  LEU  16          HD13      LEU  16  10.059   1.748   4.157
  145   1HD2  LEU  16          HD21      LEU  16  10.601   0.477   0.877
  146   2HD2  LEU  16          HD22      LEU  16  12.030  -0.321   1.536
  147   3HD2  LEU  16          HD23      LEU  16  11.712   1.371   1.913
  148    H    ARG  17           HN       ARG  17  11.402  -3.248   6.055
  149    HA   ARG  17           HA       ARG  17   9.619  -4.723   4.249
  150   1HB   ARG  17           HB2      ARG  17  11.889  -5.568   4.756
  151   2HB   ARG  17           HB1      ARG  17  11.448  -5.720   6.457
  152   1HG   ARG  17           HG2      ARG  17   9.752  -7.369   5.935
  153   2HG   ARG  17           HG1      ARG  17   9.989  -7.126   4.204
  154   1HD   ARG  17           HD2      ARG  17  11.198  -9.118   4.792
  155   2HD   ARG  17           HD1      ARG  17  12.398  -7.850   4.540
  156    HE   ARG  17           HE       ARG  17  11.863  -7.723   7.256
  157   1HH1  ARG  17          HH11      ARG  17  13.021  -8.923   8.782
  158   2HH1  ARG  17          HH12      ARG  17  13.803 -10.391   8.297
  159   1HH2  ARG  17          HH21      ARG  17  12.771 -10.162   4.994
  160   2HH2  ARG  17          HH22      ARG  17  13.662 -11.092   6.153
  161    H    HIS  18           HN       HIS  18  10.037  -4.604   7.812
  162    HA   HIS  18           HA       HIS  18   7.427  -5.875   8.213
  163   1HB   HIS  18           HB2      HIS  18   9.469  -4.688  10.108
  164   2HB   HIS  18           HB1      HIS  18   7.944  -5.387  10.652
  165    HD1  HIS  18           HD1      HIS  18  11.284  -6.363  10.429
  166    HD2  HIS  18           HD2      HIS  18   7.752  -8.169   9.137
  167    HE1  HIS  18           HE1      HIS  18  11.801  -8.828  10.142
  168    HE2  HIS  18           HE2      HIS  18   9.658  -9.936   9.356
  169    H    MET  19           HN       MET  19   7.988  -2.999   7.035
  170    HA   MET  19           HA       MET  19   6.677  -1.177   8.850
  171   1HB   MET  19           HB2      MET  19   8.137  -0.406   7.040
  172   2HB   MET  19           HB1      MET  19   7.018  -1.039   5.840
  173   1HG   MET  19           HG2      MET  19   5.480   0.660   6.176
  174   2HG   MET  19           HG1      MET  19   5.889   0.846   7.880
  175   1HE   MET  19           HE1      MET  19   7.983   1.445   8.708
  176   2HE   MET  19           HE2      MET  19   8.712   2.984   8.260
  177   3HE   MET  19           HE3      MET  19   9.384   1.484   7.629
  178    H    TYR  20           HN       TYR  20   5.322  -1.559   5.639
  179    HA   TYR  20           HA       TYR  20   2.625  -1.677   6.773
  180   1HB   TYR  20           HB2      TYR  20   3.424  -1.971   3.865
  181   2HB   TYR  20           HB1      TYR  20   1.862  -1.459   4.505
  182    HD1  TYR  20           HD1      TYR  20   4.872  -0.284   3.124
  183    HD2  TYR  20           HD2      TYR  20   2.023   0.608   6.214
  184    HE1  TYR  20           HE1      TYR  20   5.631   2.076   3.143
  185    HE2  TYR  20           HE2      TYR  20   2.784   2.968   6.232
  186    HH   TYR  20           HH       TYR  20   4.725   4.292   3.790
  187    H    GLY  21           HN       GLY  21   4.890  -3.967   6.566
  188   1HA   GLY  21           HA2      GLY  21   4.635  -6.308   6.839
  189   2HA   GLY  21           HA1      GLY  21   2.914  -6.132   6.488
  190    H    VAL  22           HN       VAL  22   5.976  -5.527   4.719
  191    HA   VAL  22           HA       VAL  22   4.688  -6.600   2.261
  192    HB   VAL  22           HB       VAL  22   7.510  -5.636   2.110
  193   1HG1  VAL  22          HG11      VAL  22   5.768  -6.208   0.225
  194   2HG1  VAL  22          HG12      VAL  22   6.857  -4.841   0.025
  195   3HG1  VAL  22          HG13      VAL  22   5.189  -4.570   0.529
  196   1HG2  VAL  22          HG21      VAL  22   5.270  -3.686   2.723
  197   2HG2  VAL  22          HG22      VAL  22   6.934  -3.274   2.315
  198   3HG2  VAL  22          HG23      VAL  22   6.585  -4.094   3.826
  199    H    ASN  23           HN       ASN  23   4.820  -8.811   2.220
  200    HA   ASN  23           HA       ASN  23   6.717 -10.407   3.557
  201   1HB   ASN  23           HB2      ASN  23   5.247 -10.968   0.963
  202   2HB   ASN  23           HB1      ASN  23   6.104 -12.185   1.910
  203   1HD2  ASN  23          HD21      ASN  23   3.920 -13.246   2.175
  204   2HD2  ASN  23          HD22      ASN  23   2.858 -12.654   3.360
  205    H    GLU  24           HN       GLU  24   8.533 -11.671   2.591
  206    HA   GLU  24           HA       GLU  24  10.430  -9.976   1.297
  207   1HB   GLU  24           HB2      GLU  24  11.088 -11.919   2.669
  208   2HB   GLU  24           HB1      GLU  24  10.381 -13.005   1.472
  209   1HG   GLU  24           HG2      GLU  24  11.975 -12.345  -0.197
  210   2HG   GLU  24           HG1      GLU  24  12.557 -11.011   0.801
  211    H    ARG  25           HN       ARG  25   8.582 -12.761   0.005
  212    HA   ARG  25           HA       ARG  25   9.466 -12.642  -2.655
  213   1HB   ARG  25           HB2      ARG  25   7.924 -14.379  -1.722
  214   2HB   ARG  25           HB1      ARG  25   6.620 -13.191  -1.758
  215   1HG   ARG  25           HG2      ARG  25   6.664 -13.051  -4.130
  216   2HG   ARG  25           HG1      ARG  25   8.229 -13.858  -4.229
  217   1HD   ARG  25           HD2      ARG  25   7.284 -15.961  -3.569
  218   2HD   ARG  25           HD1      ARG  25   5.753 -15.205  -3.128
  219    HE   ARG  25           HE       ARG  25   6.039 -14.595  -5.815
  220   1HH1  ARG  25          HH11      ARG  25   5.247 -15.930  -7.458
  221   2HH1  ARG  25          HH12      ARG  25   5.027 -17.621  -7.151
  222   1HH2  ARG  25          HH21      ARG  25   6.137 -17.441  -3.871
  223   2HH2  ARG  25          HH22      ARG  25   5.531 -18.476  -5.121
  224    H    GLN  26           HN       GLN  26   6.731 -10.874  -1.179
  225    HA   GLN  26           HA       GLN  26   6.076  -9.395  -3.552
  226   1HB   GLN  26           HB2      GLN  26   4.603  -9.674  -1.510
  227   2HB   GLN  26           HB1      GLN  26   5.640  -8.508  -0.687
  228   1HG   GLN  26           HG2      GLN  26   3.775  -7.282  -1.593
  229   2HG   GLN  26           HG1      GLN  26   5.181  -6.901  -2.588
  230   1HE2  GLN  26          HE21      GLN  26   4.473  -6.774  -4.726
  231   2HE2  GLN  26          HE22      GLN  26   3.433  -7.889  -5.472
  232    H    PHE  27           HN       PHE  27   8.444  -8.938  -1.007
  233    HA   PHE  27           HA       PHE  27   9.033  -6.169  -1.589
  234   1HB   PHE  27           HB2      PHE  27   9.670  -7.659   0.488
  235   2HB   PHE  27           HB1      PHE  27  11.073  -8.105  -0.478
  236    HD1  PHE  27           HD1      PHE  27   9.825  -5.763   1.853
  237    HD2  PHE  27           HD2      PHE  27  12.336  -6.047  -1.622
  238    HE1  PHE  27           HE1      PHE  27  10.938  -3.643   2.486
  239    HE2  PHE  27           HE2      PHE  27  13.448  -3.925  -0.987
  240    HZ   PHE  27           HZ       PHE  27  12.752  -2.724   1.067
  241    H    ARG  28           HN       ARG  28  10.965  -9.113  -2.290
  242    HA   ARG  28           HA       ARG  28  12.707  -7.830  -4.149
  243   1HB   ARG  28           HB2      ARG  28  13.213 -10.008  -3.098
  244   2HB   ARG  28           HB1      ARG  28  11.899 -10.750  -4.012
  245   1HG   ARG  28           HG2      ARG  28  13.003 -10.409  -6.089
  246   2HG   ARG  28           HG1      ARG  28  14.148  -9.268  -5.383
  247   1HD   ARG  28           HD2      ARG  28  15.300 -10.987  -4.210
  248   2HD   ARG  28           HD1      ARG  28  14.003 -12.149  -4.485
  249    HE   ARG  28           HE       ARG  28  14.841 -11.480  -7.039
  250   1HH1  ARG  28          HH11      ARG  28  16.477 -12.607  -8.117
  251   2HH1  ARG  28          HH12      ARG  28  17.669 -13.465  -7.199
  252   1HH2  ARG  28          HH21      ARG  28  16.322 -12.584  -4.128
  253   2HH2  ARG  28          HH22      ARG  28  17.582 -13.452  -4.941
  254    H    LYS  29           HN       LYS  29   9.672  -9.637  -4.648
  255    HA   LYS  29           HA       LYS  29   9.737  -9.541  -7.507
  256   1HB   LYS  29           HB2      LYS  29   8.191 -10.967  -6.077
  257   2HB   LYS  29           HB1      LYS  29   7.256  -9.507  -5.765
  258   1HG   LYS  29           HG2      LYS  29   6.105 -10.344  -7.608
  259   2HG   LYS  29           HG1      LYS  29   7.272  -9.304  -8.419
  260   1HD   LYS  29           HD2      LYS  29   8.782 -11.320  -8.648
  261   2HD   LYS  29           HD1      LYS  29   7.460 -12.305  -8.025
  262   1HE   LYS  29           HE2      LYS  29   7.191 -10.498 -10.439
  263   2HE   LYS  29           HE1      LYS  29   7.599 -12.210 -10.549
  264   1HZ   LYS  29           HZ1      LYS  29   5.343 -12.309 -10.711
  265   2HZ   LYS  29           HZ2      LYS  29   5.086 -10.941  -9.736
  266   3HZ   LYS  29           HZ3      LYS  29   5.501 -12.429  -9.027
  267    H    THR  30           HN       THR  30   7.717  -7.570  -5.304
  268    HA   THR  30           HA       THR  30   6.840  -5.660  -7.144
  269    HB   THR  30           HB       THR  30   7.689  -5.088  -4.289
  270    HG1  THR  30           HG1      THR  30   6.121  -6.897  -4.904
  271   1HG2  THR  30          HG21      THR  30   7.197  -3.033  -5.370
  272   2HG2  THR  30          HG22      THR  30   5.717  -3.465  -4.513
  273   3HG2  THR  30          HG23      THR  30   5.840  -3.735  -6.251
  274    H    PHE  31           HN       PHE  31  10.055  -6.123  -5.892
  275    HA   PHE  31           HA       PHE  31  11.021  -3.449  -6.485
  276   1HB   PHE  31           HB2      PHE  31  12.077  -5.173  -4.889
  277   2HB   PHE  31           HB1      PHE  31  12.733  -5.936  -6.336
  278    HD1  PHE  31           HD1      PHE  31  12.840  -2.970  -4.162
  279    HD2  PHE  31           HD2      PHE  31  14.404  -4.796  -7.723
  280    HE1  PHE  31           HE1      PHE  31  14.676  -1.304  -4.211
  281    HE2  PHE  31           HE2      PHE  31  16.239  -3.130  -7.771
  282    HZ   PHE  31           HZ       PHE  31  16.376  -1.384  -6.015
  283    H    GLU  32           HN       GLU  32  12.248  -6.442  -8.001
  284    HA   GLU  32           HA       GLU  32  13.184  -5.261 -10.355
  285   1HB   GLU  32           HB2      GLU  32  12.014  -8.009  -9.872
  286   2HB   GLU  32           HB1      GLU  32  12.722  -7.543 -11.419
  287   1HG   GLU  32           HG2      GLU  32  14.865  -7.153 -10.426
  288   2HG   GLU  32           HG1      GLU  32  14.201  -7.258  -8.795
  289    H    GLU  33           HN       GLU  33   9.964  -5.546  -9.317
  290    HA   GLU  33           HA       GLU  33   8.781  -5.441 -12.021
  291   1HB   GLU  33           HB2      GLU  33   7.790  -5.648  -9.207
  292   2HB   GLU  33           HB1      GLU  33   6.676  -4.998 -10.395
  293   1HG   GLU  33           HG2      GLU  33   8.160  -7.618 -10.747
  294   2HG   GLU  33           HG1      GLU  33   6.530  -7.503 -10.082
  295    H    ALA  34           HN       ALA  34   9.610  -3.280  -9.374
  296    HA   ALA  34           HA       ALA  34   8.093  -1.035 -10.450
  297   1HB   ALA  34           HB1      ALA  34   9.129  -1.589  -7.988
  298   2HB   ALA  34           HB2      ALA  34   8.679   0.033  -8.497
  299   3HB   ALA  34           HB3      ALA  34  10.362  -0.487  -8.594
  300    H    GLY  35           HN       GLY  35  11.239  -2.398 -10.989
  301   1HA   GLY  35           HA2      GLY  35  12.537  -0.041 -12.007
  302   2HA   GLY  35           HA1      GLY  35  13.007  -1.702 -12.374
  303    H    LYS  36           HN       LYS  36   9.763  -1.351 -13.065
  304    HA   LYS  36           HA       LYS  36  10.317  -1.307 -15.961
  305   1HB   LYS  36           HB2      LYS  36   7.689  -1.571 -14.466
  306   2HB   LYS  36           HB1      LYS  36   7.928  -1.851 -16.189
  307   1HG   LYS  36           HG2      LYS  36   9.560  -3.380 -14.159
  308   2HG   LYS  36           HG1      LYS  36   7.927  -3.903 -14.563
  309   1HD   LYS  36           HD2      LYS  36   8.591  -3.939 -16.982
  310   2HD   LYS  36           HD1      LYS  36  10.244  -3.570 -16.492
  311   1HE   LYS  36           HE2      LYS  36  10.446  -5.628 -15.290
  312   2HE   LYS  36           HE1      LYS  36   8.715  -5.944 -15.407
  313   1HZ   LYS  36           HZ1      LYS  36   9.398  -7.198 -17.136
  314   2HZ   LYS  36           HZ2      LYS  36  10.809  -6.290 -17.400
  315   3HZ   LYS  36           HZ3      LYS  36   9.313  -5.723 -17.970
  316    H    MET  37           HN       MET  37   8.452   0.626 -13.601
  317    HA   MET  37           HA       MET  37   7.703   2.581 -15.616
  318   1HB   MET  37           HB2      MET  37   7.648   3.082 -12.642
  319   2HB   MET  37           HB1      MET  37   6.561   3.702 -13.884
  320   1HG   MET  37           HG2      MET  37   5.821   1.312 -14.287
  321   2HG   MET  37           HG1      MET  37   6.735   0.864 -12.847
  322   1HE   MET  37           HE1      MET  37   6.133   3.656 -10.943
  323   2HE   MET  37           HE2      MET  37   6.622   1.976 -10.739
  324   3HE   MET  37           HE3      MET  37   5.158   2.560  -9.953
  325    HA   PRO  38           HA       PRO  38  11.582   4.833 -15.235
  326   1HB   PRO  38           HB2      PRO  38  11.013   6.972 -16.783
  327   2HB   PRO  38           HB1      PRO  38  11.219   5.349 -17.478
  328   1HG   PRO  38           HG2      PRO  38   8.693   6.792 -16.788
  329   2HG   PRO  38           HG1      PRO  38   9.101   5.888 -18.258
  330   1HD   PRO  38           HD2      PRO  38   7.609   4.819 -16.236
  331   2HD   PRO  38           HD1      PRO  38   8.668   3.838 -17.278
  332    H    GLY  39           HN       GLY  39  12.284   6.182 -13.599
  333   1HA   GLY  39           HA2      GLY  39  11.765   8.651 -12.808
  334   2HA   GLY  39           HA1      GLY  39  10.268   7.910 -12.242
  335    H    LYS  40           HN       LYS  40  13.814   7.484 -12.001
  336    HA   LYS  40           HA       LYS  40  15.115   6.690 -10.225
  337   1HB   LYS  40           HB2      LYS  40  12.894   8.221  -8.892
  338   2HB   LYS  40           HB1      LYS  40  14.129   7.418  -7.921
  339   1HG   LYS  40           HG2      LYS  40  15.835   8.812  -8.666
  340   2HG   LYS  40           HG1      LYS  40  15.055   9.128 -10.214
  341   1HD   LYS  40           HD2      LYS  40  14.985  11.135  -8.848
  342   2HD   LYS  40           HD1      LYS  40  13.351  10.502  -9.043
  343   1HE   LYS  40           HE2      LYS  40  13.370   9.543  -6.840
  344   2HE   LYS  40           HE1      LYS  40  15.096   9.852  -6.656
  345   1HZ   LYS  40           HZ1      LYS  40  14.206  12.301  -7.177
  346   2HZ   LYS  40           HZ2      LYS  40  14.358  11.678  -5.604
  347   3HZ   LYS  40           HZ3      LYS  40  12.848  11.667  -6.383
  348    H    HIS  41           HN       HIS  41  15.067   4.464 -10.265
  349    HA   HIS  41           HA       HIS  41  12.932   2.719  -9.916
  350   1HB   HIS  41           HB2      HIS  41  15.395   2.172 -10.412
  351   2HB   HIS  41           HB1      HIS  41  15.637   2.197  -8.666
  352    HD1  HIS  41           HD1      HIS  41  15.296  -0.237 -11.067
  353    HD2  HIS  41           HD2      HIS  41  13.105   0.501  -7.596
  354    HE1  HIS  41           HE1      HIS  41  14.157  -2.418 -10.459
  355    HE2  HIS  41           HE2      HIS  41  12.819  -1.978  -8.350
  356    H    GLY  42           HN       GLY  42  15.032   3.986  -7.308
  357   1HA   GLY  42           HA2      GLY  42  13.865   2.769  -5.101
  358   2HA   GLY  42           HA1      GLY  42  14.498   4.414  -5.055
  359    H    GLU  43           HN       GLU  43  12.827   5.938  -6.428
  360    HA   GLU  43           HA       GLU  43  10.587   6.357  -4.818
  361   1HB   GLU  43           HB2      GLU  43  11.526   7.848  -6.694
  362   2HB   GLU  43           HB1      GLU  43  10.533   6.891  -7.793
  363   1HG   GLU  43           HG2      GLU  43   9.176   8.753  -7.197
  364   2HG   GLU  43           HG1      GLU  43   8.571   7.414  -6.222
  365    H    ASN  44           HN       ASN  44  10.617   4.609  -7.946
  366    HA   ASN  44           HA       ASN  44   7.949   3.819  -8.075
  367   1HB   ASN  44           HB2      ASN  44  10.154   1.848  -8.681
  368   2HB   ASN  44           HB1      ASN  44   8.634   2.109  -9.540
  369   1HD2  ASN  44          HD21      ASN  44  10.857   2.167 -11.139
  370   2HD2  ASN  44          HD22      ASN  44  11.252   3.757 -11.580
  371    H    PHE  45           HN       PHE  45  10.554   1.917  -6.469
  372    HA   PHE  45           HA       PHE  45   8.894  -0.069  -5.356
  373   1HB   PHE  45           HB2      PHE  45  11.421  -0.008  -5.286
  374   2HB   PHE  45           HB1      PHE  45  11.295   1.159  -3.970
  375    HD1  PHE  45           HD1      PHE  45   9.834  -2.168  -4.952
  376    HD2  PHE  45           HD2      PHE  45  11.358   0.307  -1.789
  377    HE1  PHE  45           HE1      PHE  45   9.537  -4.030  -3.347
  378    HE2  PHE  45           HE2      PHE  45  11.053  -1.558  -0.188
  379    HZ   PHE  45           HZ       PHE  45  10.143  -3.726  -0.966
  380    H    MET  46           HN       MET  46   9.718   3.145  -4.070
  381    HA   MET  46           HA       MET  46   8.189   2.822  -1.626
  382   1HB   MET  46           HB2      MET  46   9.286   5.229  -3.105
  383   2HB   MET  46           HB1      MET  46   8.366   5.387  -1.616
  384   1HG   MET  46           HG2      MET  46  10.210   3.490  -0.856
  385   2HG   MET  46           HG1      MET  46  11.151   4.419  -2.019
  386   1HE   MET  46           HE1      MET  46   8.794   6.038   1.505
  387   2HE   MET  46           HE2      MET  46   9.744   4.593   1.832
  388   3HE   MET  46           HE3      MET  46   8.540   4.573   0.548
  389    H    ILE  47           HN       ILE  47   7.285   3.264  -4.867
  390    HA   ILE  47           HA       ILE  47   4.750   4.663  -4.183
  391    HB   ILE  47           HB       ILE  47   6.087   3.908  -6.782
  392   1HG1  ILE  47          HG12      ILE  47   5.170   6.595  -5.744
  393   2HG1  ILE  47          HG11      ILE  47   6.785   5.956  -5.445
  394   1HG2  ILE  47          HG21      ILE  47   4.152   5.150  -7.849
  395   2HG2  ILE  47          HG22      ILE  47   3.304   4.960  -6.314
  396   3HG2  ILE  47          HG23      ILE  47   3.782   3.538  -7.240
  397   1HD1  ILE  47          HD11      ILE  47   7.382   6.050  -7.716
  398   2HD1  ILE  47          HD12      ILE  47   6.426   7.514  -7.505
  399   3HD1  ILE  47          HD13      ILE  47   5.704   6.093  -8.257
  400    H    LEU  48           HN       LEU  48   5.932   1.491  -5.278
  401    HA   LEU  48           HA       LEU  48   3.248   0.440  -5.713
  402   1HB   LEU  48           HB2      LEU  48   5.772  -1.157  -5.192
  403   2HB   LEU  48           HB1      LEU  48   4.308  -1.710  -6.000
  404    HG   LEU  48           HG       LEU  48   6.340   0.292  -7.012
  405   1HD1  LEU  48          HD11      LEU  48   6.335  -1.296  -8.956
  406   2HD1  LEU  48          HD12      LEU  48   5.265  -2.350  -8.038
  407   3HD1  LEU  48          HD13      LEU  48   6.897  -2.026  -7.455
  408   1HD2  LEU  48          HD21      LEU  48   3.518  -0.267  -7.937
  409   2HD2  LEU  48          HD22      LEU  48   4.743   0.355  -9.043
  410   3HD2  LEU  48          HD23      LEU  48   4.277   1.293  -7.627
  411    H    LEU  49           HN       LEU  49   5.613   0.282  -3.055
  412    HA   LEU  49           HA       LEU  49   4.372  -1.541  -1.351
  413   1HB   LEU  49           HB2      LEU  49   5.744   1.079  -0.711
  414   2HB   LEU  49           HB1      LEU  49   5.220  -0.045   0.540
  415    HG   LEU  49           HG       LEU  49   7.085  -0.772  -1.740
  416   1HD1  LEU  49          HD11      LEU  49   8.778  -0.832   0.199
  417   2HD1  LEU  49          HD12      LEU  49   7.601   0.121   1.101
  418   3HD1  LEU  49          HD13      LEU  49   8.295   0.758  -0.391
  419   1HD2  LEU  49          HD21      LEU  49   7.546  -2.639   0.162
  420   2HD2  LEU  49          HD22      LEU  49   6.295  -2.843  -1.061
  421   3HD2  LEU  49          HD23      LEU  49   5.861  -2.280   0.550
  422    H    GLU  50           HN       GLU  50   3.414   1.796  -2.028
  423    HA   GLU  50           HA       GLU  50   1.271   1.714  -0.010
  424   1HB   GLU  50           HB2      GLU  50   2.584   3.805  -0.646
  425   2HB   GLU  50           HB1      GLU  50   1.687   3.796  -2.165
  426   1HG   GLU  50           HG2      GLU  50  -0.434   3.917  -0.947
  427   2HG   GLU  50           HG1      GLU  50   0.425   3.848   0.592
  428    H    SER  51           HN       SER  51   1.603   1.457  -3.525
  429    HA   SER  51           HA       SER  51  -1.149   1.622  -4.211
  430   1HB   SER  51           HB2      SER  51   0.852  -0.202  -5.561
  431   2HB   SER  51           HB1      SER  51  -0.549   0.586  -6.282
  432    HG   SER  51           HG       SER  51   0.551   2.386  -6.448
  433    H    ARG  52           HN       ARG  52   0.586  -0.819  -2.504
  434    HA   ARG  52           HA       ARG  52  -0.646  -3.215  -3.076
  435   1HB   ARG  52           HB2      ARG  52  -0.066  -2.037  -0.347
  436   2HB   ARG  52           HB1      ARG  52  -0.516  -3.722  -0.606
  437   1HG   ARG  52           HG2      ARG  52   1.433  -3.856  -2.250
  438   2HG   ARG  52           HG1      ARG  52   1.943  -2.287  -1.629
  439   1HD   ARG  52           HD2      ARG  52   1.868  -4.945  -0.232
  440   2HD   ARG  52           HD1      ARG  52   3.140  -3.723  -0.234
  441    HE   ARG  52           HE       ARG  52   1.030  -2.472   1.051
  442   1HH1  ARG  52          HH11      ARG  52   0.721  -2.591   3.287
  443   2HH1  ARG  52          HH12      ARG  52   1.373  -3.932   4.168
  444   1HH2  ARG  52          HH21      ARG  52   2.748  -5.445   1.368
  445   2HH2  ARG  52          HH22      ARG  52   2.520  -5.548   3.082
  446    H    LEU  53           HN       LEU  53  -2.690  -3.900  -3.186
  447    HA   LEU  53           HA       LEU  53  -4.991  -2.408  -2.937
  448   1HB   LEU  53           HB2      LEU  53  -4.487  -5.342  -2.502
  449   2HB   LEU  53           HB1      LEU  53  -6.111  -4.696  -2.305
  450    HG   LEU  53           HG       LEU  53  -5.647  -5.597  -4.600
  451   1HD1  LEU  53          HD11      LEU  53  -6.937  -3.999  -5.650
  452   2HD1  LEU  53          HD12      LEU  53  -6.042  -2.646  -4.968
  453   3HD1  LEU  53          HD13      LEU  53  -7.206  -3.523  -3.977
  454   1HD2  LEU  53          HD21      LEU  53  -4.131  -4.437  -6.071
  455   2HD2  LEU  53          HD22      LEU  53  -3.245  -4.844  -4.608
  456   3HD2  LEU  53          HD23      LEU  53  -3.821  -3.197  -4.864
  457    H    ASP  54           HN       ASP  54  -3.601  -4.399  -0.301
  458    HA   ASP  54           HA       ASP  54  -5.582  -3.671   1.629
  459   1HB   ASP  54           HB2      ASP  54  -3.892  -4.416   3.311
  460   2HB   ASP  54           HB1      ASP  54  -4.101  -5.577   1.999
  461    H    ASN  55           HN       ASN  55  -2.301  -2.321   1.091
  462    HA   ASN  55           HA       ASN  55  -2.253  -0.379   3.080
  463   1HB   ASN  55           HB2      ASN  55  -0.371  -0.700   1.564
  464   2HB   ASN  55           HB1      ASN  55  -1.326  -0.101   0.207
  465   1HD2  ASN  55          HD21      ASN  55  -2.278   2.230   0.642
  466   2HD2  ASN  55          HD22      ASN  55  -1.227   3.329   1.396
  467    H    LEU  56           HN       LEU  56  -3.291   0.405  -0.260
  468    HA   LEU  56           HA       LEU  56  -4.400   2.868   0.145
  469   1HB   LEU  56           HB2      LEU  56  -4.454   0.951  -1.879
  470   2HB   LEU  56           HB1      LEU  56  -6.162   1.155  -1.512
  471    HG   LEU  56           HG       LEU  56  -4.296   3.484  -2.029
  472   1HD1  LEU  56          HD11      LEU  56  -4.325   2.139  -4.042
  473   2HD1  LEU  56          HD12      LEU  56  -5.393   3.519  -4.299
  474   3HD1  LEU  56          HD13      LEU  56  -6.072   1.933  -3.936
  475   1HD2  LEU  56          HD21      LEU  56  -7.315   3.150  -1.986
  476   2HD2  LEU  56          HD22      LEU  56  -6.485   4.628  -2.468
  477   3HD2  LEU  56          HD23      LEU  56  -6.345   4.038  -0.813
  478    H    VAL  57           HN       VAL  57  -6.279  -0.186   0.567
  479    HA   VAL  57           HA       VAL  57  -8.667   0.984   1.449
  480    HB   VAL  57           HB       VAL  57  -7.382  -1.574   2.458
  481   1HG1  VAL  57          HG11      VAL  57  -9.353  -0.734   3.801
  482   2HG1  VAL  57          HG12      VAL  57  -9.635  -2.282   3.011
  483   3HG1  VAL  57          HG13      VAL  57 -10.311  -0.809   2.323
  484   1HG2  VAL  57          HG21      VAL  57  -9.433  -1.283   0.263
  485   2HG2  VAL  57          HG22      VAL  57  -8.418  -2.678   0.629
  486   3HG2  VAL  57          HG23      VAL  57  -7.710  -1.230  -0.079
  487    H    TYR  58           HN       TYR  58  -6.090  -0.268   3.622
  488    HA   TYR  58           HA       TYR  58  -7.155   0.865   5.983
  489   1HB   TYR  58           HB2      TYR  58  -5.426  -0.743   6.253
  490   2HB   TYR  58           HB1      TYR  58  -4.340   0.122   5.169
  491    HD1  TYR  58           HD1      TYR  58  -6.398   1.188   8.142
  492    HD2  TYR  58           HD2      TYR  58  -2.494   0.934   6.360
  493    HE1  TYR  58           HE1      TYR  58  -5.437   2.414  10.067
  494    HE2  TYR  58           HE2      TYR  58  -1.537   2.155   8.293
  495    HH   TYR  58           HH       TYR  58  -3.134   2.572  11.179
  496    H    ARG  59           HN       ARG  59  -4.825   2.249   3.654
  497    HA   ARG  59           HA       ARG  59  -4.185   4.618   4.981
  498   1HB   ARG  59           HB2      ARG  59  -3.184   4.060   2.824
  499   2HB   ARG  59           HB1      ARG  59  -4.746   4.211   2.029
  500   1HG   ARG  59           HG2      ARG  59  -3.268   6.222   1.737
  501   2HG   ARG  59           HG1      ARG  59  -4.825   6.587   2.472
  502   1HD   ARG  59           HD2      ARG  59  -2.676   7.606   3.536
  503   2HD   ARG  59           HD1      ARG  59  -3.887   6.903   4.604
  504    HE   ARG  59           HE       ARG  59  -2.172   4.793   4.079
  505   1HH1  ARG  59          HH11      ARG  59  -0.357   4.352   5.350
  506   2HH1  ARG  59          HH12      ARG  59   0.378   5.631   6.258
  507   1HH2  ARG  59          HH21      ARG  59  -1.869   8.043   5.184
  508   2HH2  ARG  59          HH22      ARG  59  -0.478   7.721   6.163
  509    H    LEU  60           HN       LEU  60  -6.973   4.142   2.772
  510    HA   LEU  60           HA       LEU  60  -8.146   6.693   3.203
  511   1HB   LEU  60           HB2      LEU  60  -9.600   4.077   2.689
  512   2HB   LEU  60           HB1      LEU  60 -10.224   5.695   2.376
  513    HG   LEU  60           HG       LEU  60  -7.674   4.690   1.095
  514   1HD1  LEU  60          HD11      LEU  60 -10.532   4.384   0.158
  515   2HD1  LEU  60          HD12      LEU  60  -9.333   3.112   0.391
  516   3HD1  LEU  60          HD13      LEU  60  -9.148   4.268  -0.928
  517   1HD2  LEU  60          HD21      LEU  60  -8.406   6.403  -0.645
  518   2HD2  LEU  60          HD22      LEU  60  -7.910   7.068   0.910
  519   3HD2  LEU  60          HD23      LEU  60  -9.623   6.936   0.513
  520    H    GLY  61           HN       GLY  61 -10.338   4.249   4.288
  521   1HA   GLY  61           HA2      GLY  61  -9.810   4.420   7.112
  522   2HA   GLY  61           HA1      GLY  61 -11.053   5.585   6.657
  523    H    LEU  62           HN       LEU  62 -10.652   2.495   5.027
  524    HA   LEU  62           HA       LEU  62 -13.413   1.764   5.802
  525   1HB   LEU  62           HB2      LEU  62 -11.504   0.344   3.934
  526   2HB   LEU  62           HB1      LEU  62 -13.235   0.059   4.079
  527    HG   LEU  62           HG       LEU  62 -12.011   2.709   3.256
  528   1HD1  LEU  62          HD11      LEU  62 -12.973   2.028   0.982
  529   2HD1  LEU  62          HD12      LEU  62 -13.082   0.393   1.634
  530   3HD1  LEU  62          HD13      LEU  62 -11.512   1.183   1.495
  531   1HD2  LEU  62          HD21      LEU  62 -14.172   3.156   4.105
  532   2HD2  LEU  62          HD22      LEU  62 -14.832   1.642   3.487
  533   3HD2  LEU  62          HD23      LEU  62 -14.457   2.960   2.378
  534    H    ALA  63           HN       ALA  63 -10.249   1.143   6.868
  535    HA   ALA  63           HA       ALA  63 -11.269  -1.012   8.618
  536   1HB   ALA  63           HB1      ALA  63  -9.333  -1.443   6.412
  537   2HB   ALA  63           HB2      ALA  63 -10.385  -2.602   7.209
  538   3HB   ALA  63           HB3      ALA  63  -8.856  -2.139   7.953
  539    H    ARG  64           HN       ARG  64  -9.991  -1.260  10.505
  540    HA   ARG  64           HA       ARG  64  -8.674   1.185  11.328
  541   1HB   ARG  64           HB2      ARG  64  -9.250  -1.477  12.620
  542   2HB   ARG  64           HB1      ARG  64  -8.215  -0.306  13.434
  543   1HG   ARG  64           HG2      ARG  64 -11.015   0.303  12.430
  544   2HG   ARG  64           HG1      ARG  64 -10.636  -0.141  14.092
  545   1HD   ARG  64           HD2      ARG  64  -8.848   1.879  13.758
  546   2HD   ARG  64           HD1      ARG  64 -10.122   2.413  12.660
  547    HE   ARG  64           HE       ARG  64 -11.514   1.762  14.945
  548   1HH1  ARG  64          HH11      ARG  64 -11.897   3.238  16.613
  549   2HH1  ARG  64          HH12      ARG  64 -10.807   4.563  16.847
  550   1HH2  ARG  64          HH21      ARG  64  -8.735   3.670  14.215
  551   2HH2  ARG  64          HH22      ARG  64  -9.017   4.808  15.489
  552    H    THR  65           HN       THR  65  -7.530  -2.109  10.609
  553    HA   THR  65           HA       THR  65  -4.790  -0.987  10.293
  554    HB   THR  65           HB       THR  65  -3.790  -2.396  11.874
  555    HG1  THR  65           HG1      THR  65  -5.519  -4.051  12.778
  556   1HG2  THR  65          HG21      THR  65  -6.542  -1.892  13.061
  557   2HG2  THR  65          HG22      THR  65  -5.255  -0.690  12.975
  558   3HG2  THR  65          HG23      THR  65  -5.045  -2.135  13.956
  559    H    ARG  66           HN       ARG  66  -3.291  -2.805   9.454
  560    HA   ARG  66           HA       ARG  66  -4.192  -3.763   6.986
  561   1HB   ARG  66           HB2      ARG  66  -2.247  -5.228   6.981
  562   2HB   ARG  66           HB1      ARG  66  -1.802  -3.694   7.730
  563   1HG   ARG  66           HG2      ARG  66  -2.378  -4.803   9.973
  564   2HG   ARG  66           HG1      ARG  66  -2.384  -6.329   9.089
  565   1HD   ARG  66           HD2      ARG  66  -0.078  -5.978   8.380
  566   2HD   ARG  66           HD1      ARG  66  -0.058  -4.386   9.138
  567    HE   ARG  66           HE       ARG  66  -0.716  -6.095  11.215
  568   1HH1  ARG  66          HH11      ARG  66   0.843  -7.065  12.534
  569   2HH1  ARG  66          HH12      ARG  66   2.448  -7.300  11.925
  570   1HH2  ARG  66          HH21      ARG  66   1.764  -5.898   8.828
  571   2HH2  ARG  66          HH22      ARG  66   2.969  -6.639   9.827
  572    H    ARG  67           HN       ARG  67  -4.214  -5.438  10.131
  573    HA   ARG  67           HA       ARG  67  -5.144  -7.958   9.237
  574   1HB   ARG  67           HB2      ARG  67  -5.912  -6.519  11.799
  575   2HB   ARG  67           HB1      ARG  67  -6.034  -8.253  11.514
  576   1HG   ARG  67           HG2      ARG  67  -3.380  -6.855  11.179
  577   2HG   ARG  67           HG1      ARG  67  -3.939  -7.310  12.786
  578   1HD   ARG  67           HD2      ARG  67  -3.578  -9.192  10.432
  579   2HD   ARG  67           HD1      ARG  67  -2.540  -9.093  11.853
  580    HE   ARG  67           HE       ARG  67  -5.052  -9.581  12.911
  581   1HH1  ARG  67          HH11      ARG  67  -5.838 -11.670  13.266
  582   2HH1  ARG  67          HH12      ARG  67  -5.213 -12.987  12.331
  583   1HH2  ARG  67          HH21      ARG  67  -3.029 -11.004  10.508
  584   2HH2  ARG  67          HH22      ARG  67  -3.623 -12.610  10.770
  585    H    GLN  68           HN       GLN  68  -6.801  -4.906   9.627
  586    HA   GLN  68           HA       GLN  68  -9.457  -6.127   9.186
  587   1HB   GLN  68           HB2      GLN  68  -8.458  -3.368   9.822
  588   2HB   GLN  68           HB1      GLN  68 -10.101  -3.605   9.236
  589   1HG   GLN  68           HG2      GLN  68  -9.925  -3.582  11.722
  590   2HG   GLN  68           HG1      GLN  68 -10.608  -5.074  11.077
  591   1HE2  GLN  68          HE21      GLN  68  -9.709  -6.920  11.997
  592   2HE2  GLN  68          HE22      GLN  68  -8.131  -7.038  12.611
  593    H    ALA  69           HN       ALA  69  -7.242  -3.884   7.501
  594    HA   ALA  69           HA       ALA  69  -8.941  -3.624   5.197
  595   1HB   ALA  69           HB1      ALA  69  -7.344  -1.934   5.293
  596   2HB   ALA  69           HB2      ALA  69  -6.608  -3.013   4.110
  597   3HB   ALA  69           HB3      ALA  69  -6.064  -3.039   5.786
  598    H    ARG  70           HN       ARG  70  -5.988  -5.602   5.688
  599    HA   ARG  70           HA       ARG  70  -5.961  -6.938   3.237
  600   1HB   ARG  70           HB2      ARG  70  -4.270  -7.224   5.061
  601   2HB   ARG  70           HB1      ARG  70  -5.430  -8.230   5.929
  602   1HG   ARG  70           HG2      ARG  70  -5.488  -9.824   4.080
  603   2HG   ARG  70           HG1      ARG  70  -4.415  -8.797   3.129
  604   1HD   ARG  70           HD2      ARG  70  -3.732 -10.141   5.760
  605   2HD   ARG  70           HD1      ARG  70  -3.122 -10.597   4.169
  606    HE   ARG  70           HE       ARG  70  -2.402  -7.933   4.412
  607   1HH1  ARG  70          HH11      ARG  70  -0.431  -7.282   5.306
  608   2HH1  ARG  70          HH12      ARG  70   0.385  -8.325   6.423
  609   1HH2  ARG  70          HH21      ARG  70  -2.034 -10.806   6.282
  610   2HH2  ARG  70          HH22      ARG  70  -0.523 -10.320   6.975
  611    H    GLN  71           HN       GLN  71  -7.797  -7.870   6.154
  612    HA   GLN  71           HA       GLN  71  -9.027 -10.181   5.046
  613   1HB   GLN  71           HB2      GLN  71  -9.897  -8.269   7.223
  614   2HB   GLN  71           HB1      GLN  71 -10.819  -9.715   6.809
  615   1HG   GLN  71           HG2      GLN  71  -8.851 -11.119   7.255
  616   2HG   GLN  71           HG1      GLN  71  -7.903  -9.682   7.639
  617   1HE2  GLN  71          HE21      GLN  71  -8.050 -11.499   9.680
  618   2HE2  GLN  71          HE22      GLN  71  -9.127 -10.984  10.886
  619    H    LEU  72           HN       LEU  72  -9.935  -6.757   4.821
  620    HA   LEU  72           HA       LEU  72 -12.557  -7.189   3.746
  621   1HB   LEU  72           HB2      LEU  72 -10.606  -4.909   3.453
  622   2HB   LEU  72           HB1      LEU  72 -12.186  -4.889   2.681
  623    HG   LEU  72           HG       LEU  72 -11.754  -5.288   5.655
  624   1HD1  LEU  72          HD11      LEU  72 -12.322  -2.995   5.958
  625   2HD1  LEU  72          HD12      LEU  72 -12.793  -2.815   4.269
  626   3HD1  LEU  72          HD13      LEU  72 -11.097  -3.014   4.694
  627   1HD2  LEU  72          HD21      LEU  72 -13.878  -6.165   5.303
  628   2HD2  LEU  72          HD22      LEU  72 -14.168  -5.184   3.867
  629   3HD2  LEU  72          HD23      LEU  72 -14.299  -4.466   5.470
  630    H    VAL  73           HN       VAL  73  -9.454  -6.564   2.076
  631    HA   VAL  73           HA       VAL  73 -10.354  -6.815  -0.570
  632    HB   VAL  73           HB       VAL  73  -7.741  -7.744   0.665
  633   1HG1  VAL  73          HG11      VAL  73  -7.904  -8.936  -1.385
  634   2HG1  VAL  73          HG12      VAL  73  -6.951  -7.506  -1.774
  635   3HG1  VAL  73          HG13      VAL  73  -8.656  -7.571  -2.209
  636   1HG2  VAL  73          HG21      VAL  73  -8.339  -5.298  -1.021
  637   2HG2  VAL  73          HG22      VAL  73  -6.866  -5.644  -0.114
  638   3HG2  VAL  73          HG23      VAL  73  -8.365  -5.280   0.743
  639    H    THR  74           HN       THR  74  -8.770  -9.466   1.226
  640    HA   THR  74           HA       THR  74  -9.307 -11.600  -0.404
  641    HB   THR  74           HB       THR  74  -9.527 -12.938   1.761
  642    HG1  THR  74           HG1      THR  74  -9.116 -11.714   3.637
  643   1HG2  THR  74          HG21      THR  74  -7.367 -12.561   0.676
  644   2HG2  THR  74          HG22      THR  74  -7.185 -12.435   2.426
  645   3HG2  THR  74          HG23      THR  74  -7.245 -10.975   1.439
  646    H    HIS  75           HN       HIS  75 -11.634 -10.080   1.813
  647    HA   HIS  75           HA       HIS  75 -13.714 -12.033   1.335
  648   1HB   HIS  75           HB2      HIS  75 -13.986  -9.154   2.251
  649   2HB   HIS  75           HB1      HIS  75 -15.192 -10.428   2.431
  650    HD1  HIS  75           HD1      HIS  75 -14.426  -9.302   5.036
  651    HD2  HIS  75           HD2      HIS  75 -12.114 -12.278   3.245
  652    HE1  HIS  75           HE1      HIS  75 -13.086 -10.387   6.894
  653    HE2  HIS  75           HE2      HIS  75 -11.676 -12.198   5.815
  654    H    GLY  76           HN       GLY  76 -12.290 -10.359  -0.923
  655   1HA   GLY  76           HA2      GLY  76 -12.914  -9.312  -2.943
  656   2HA   GLY  76           HA1      GLY  76 -14.166 -10.553  -2.936
  657    H    HIS  77           HN       HIS  77 -13.696  -7.687  -0.854
  658    HA   HIS  77           HA       HIS  77 -16.524  -6.902  -1.441
  659   1HB   HIS  77           HB2      HIS  77 -14.626  -6.236   0.822
  660   2HB   HIS  77           HB1      HIS  77 -16.174  -5.421   0.596
  661    HD1  HIS  77           HD1      HIS  77 -17.447  -8.255  -0.521
  662    HD2  HIS  77           HD2      HIS  77 -15.702  -7.507   3.194
  663    HE1  HIS  77           HE1      HIS  77 -18.370 -10.000   1.070
  664    HE2  HIS  77           HE2      HIS  77 -17.317  -9.551   3.334
  665    H    ILE  78           HN       ILE  78 -13.193  -5.812  -1.622
  666    HA   ILE  78           HA       ILE  78 -13.891  -3.064  -2.304
  667    HB   ILE  78           HB       ILE  78 -11.369  -4.697  -2.180
  668   1HG1  ILE  78          HG12      ILE  78 -10.664  -3.010  -0.645
  669   2HG1  ILE  78          HG11      ILE  78 -11.929  -1.901  -1.162
  670   1HG2  ILE  78          HG21      ILE  78 -10.970  -3.597  -4.265
  671   2HG2  ILE  78          HG22      ILE  78 -10.134  -2.634  -3.047
  672   3HG2  ILE  78          HG23      ILE  78 -11.685  -2.091  -3.687
  673   1HD1  ILE  78          HD11      ILE  78 -12.640  -4.572   0.038
  674   2HD1  ILE  78          HD12      ILE  78 -13.608  -3.100  -0.029
  675   3HD1  ILE  78          HD13      ILE  78 -12.240  -3.203   1.072
  676    H    LEU  79           HN       LEU  79 -14.661  -2.437  -4.208
  677    HA   LEU  79           HA       LEU  79 -14.369  -4.194  -6.595
  678   1HB   LEU  79           HB2      LEU  79 -16.084  -1.733  -6.169
  679   2HB   LEU  79           HB1      LEU  79 -16.126  -2.781  -7.578
  680    HG   LEU  79           HG       LEU  79 -16.711  -3.756  -4.765
  681   1HD1  LEU  79          HD11      LEU  79 -18.526  -2.642  -6.912
  682   2HD1  LEU  79          HD12      LEU  79 -18.398  -2.142  -5.226
  683   3HD1  LEU  79          HD13      LEU  79 -19.120  -3.699  -5.631
  684   1HD2  LEU  79          HD21      LEU  79 -17.013  -4.908  -7.556
  685   2HD2  LEU  79          HD22      LEU  79 -17.929  -5.540  -6.189
  686   3HD2  LEU  79          HD23      LEU  79 -16.169  -5.606  -6.174
  687    H    VAL  80           HN       VAL  80 -12.310  -3.658  -7.426
  688    HA   VAL  80           HA       VAL  80 -11.461  -0.869  -7.574
  689    HB   VAL  80           HB       VAL  80 -10.339  -3.490  -8.542
  690   1HG1  VAL  80          HG11      VAL  80  -9.447  -0.708  -9.320
  691   2HG1  VAL  80          HG12      VAL  80  -9.768  -2.081 -10.379
  692   3HG1  VAL  80          HG13      VAL  80  -8.344  -2.083  -9.339
  693   1HG2  VAL  80          HG21      VAL  80  -8.998  -1.344  -6.897
  694   2HG2  VAL  80          HG22      VAL  80  -8.647  -3.069  -6.944
  695   3HG2  VAL  80          HG23      VAL  80 -10.109  -2.491  -6.148
  696    H    ASP  81           HN       ASP  81 -11.729   0.502  -9.298
  697    HA   ASP  81           HA       ASP  81 -12.827   1.317 -11.228
  698   1HB   ASP  81           HB2      ASP  81 -10.756   0.160 -12.110
  699   2HB   ASP  81           HB1      ASP  81 -11.759  -1.258 -12.417
  700    H    GLY  82           HN       GLY  82 -14.249  -0.743  -9.448
  701   1HA   GLY  82           HA2      GLY  82 -16.533  -1.427  -9.504
  702   2HA   GLY  82           HA1      GLY  82 -16.559  -1.124 -11.243
  703    H    SER  83           HN       SER  83 -14.236  -3.099  -9.418
  704    HA   SER  83           HA       SER  83 -15.392  -5.580 -10.563
  705   1HB   SER  83           HB2      SER  83 -12.655  -4.478 -11.211
  706   2HB   SER  83           HB1      SER  83 -12.989  -6.205 -11.305
  707    HG   SER  83           HG       SER  83 -13.365  -4.664 -13.220
  708    H    ARG  84           HN       ARG  84 -15.216  -7.219  -9.134
  709    HA   ARG  84           HA       ARG  84 -14.180  -6.805  -6.504
  710   1HB   ARG  84           HB2      ARG  84 -15.951  -8.507  -7.381
  711   2HB   ARG  84           HB1      ARG  84 -14.567  -9.540  -7.728
  712   1HG   ARG  84           HG2      ARG  84 -13.863  -9.438  -5.386
  713   2HG   ARG  84           HG1      ARG  84 -15.179  -8.323  -5.018
  714   1HD   ARG  84           HD2      ARG  84 -16.020 -10.434  -4.354
  715   2HD   ARG  84           HD1      ARG  84 -16.743 -10.172  -5.939
  716    HE   ARG  84           HE       ARG  84 -14.395 -11.533  -6.499
  717   1HH1  ARG  84          HH11      ARG  84 -14.291 -13.789  -6.593
  718   2HH1  ARG  84          HH12      ARG  84 -15.452 -14.733  -5.720
  719   1HH2  ARG  84          HH21      ARG  84 -17.120 -11.978  -4.435
  720   2HH2  ARG  84          HH22      ARG  84 -17.053 -13.708  -4.498
  721    H    VAL  85           HN       VAL  85 -12.088  -6.845  -5.851
  722    HA   VAL  85           HA       VAL  85 -10.114  -8.501  -7.402
  723    HB   VAL  85           HB       VAL  85  -9.862  -5.697  -6.284
  724   1HG1  VAL  85          HG11      VAL  85  -7.771  -6.350  -5.540
  725   2HG1  VAL  85          HG12      VAL  85  -7.346  -6.183  -7.237
  726   3HG1  VAL  85          HG13      VAL  85  -7.729  -7.771  -6.582
  727   1HG2  VAL  85          HG21      VAL  85  -9.374  -6.989  -8.987
  728   2HG2  VAL  85          HG22      VAL  85  -8.926  -5.329  -8.608
  729   3HG2  VAL  85          HG23      VAL  85 -10.622  -5.813  -8.572
  730    H    ASN  86           HN       ASN  86 -10.842 -10.098  -5.714
  731    HA   ASN  86           HA       ASN  86 -10.168  -9.633  -2.937
  732   1HB   ASN  86           HB2      ASN  86 -10.339 -12.199  -2.843
  733   2HB   ASN  86           HB1      ASN  86 -11.790 -11.331  -3.345
  734   1HD2  ASN  86          HD21      ASN  86  -9.679 -13.843  -4.242
  735   2HD2  ASN  86          HD22      ASN  86 -10.140 -13.978  -5.870
  736    H    ILE  87           HN       ILE  87  -8.171  -9.543  -5.403
  737    HA   ILE  87           HA       ILE  87  -6.073 -11.356  -4.373
  738    HB   ILE  87           HB       ILE  87  -6.157  -9.490  -6.762
  739   1HG1  ILE  87          HG12      ILE  87  -6.180 -11.683  -8.010
  740   2HG1  ILE  87          HG11      ILE  87  -6.395 -12.502  -6.466
  741   1HG2  ILE  87          HG21      ILE  87  -4.108 -10.851  -7.421
  742   2HG2  ILE  87          HG22      ILE  87  -4.055 -11.402  -5.747
  743   3HG2  ILE  87          HG23      ILE  87  -3.879  -9.691  -6.118
  744   1HD1  ILE  87          HD11      ILE  87  -8.576 -11.790  -6.236
  745   2HD1  ILE  87          HD12      ILE  87  -8.480 -11.802  -7.993
  746   3HD1  ILE  87          HD13      ILE  87  -8.304 -10.285  -7.115
  747    HA   PRO  88           HA       PRO  88  -4.666  -7.631  -2.143
  748   1HB   PRO  88           HB2      PRO  88  -2.864  -8.792  -0.488
  749   2HB   PRO  88           HB1      PRO  88  -4.614  -8.978  -0.250
  750   1HG   PRO  88           HG2      PRO  88  -2.661 -10.880  -1.468
  751   2HG   PRO  88           HG1      PRO  88  -4.014 -11.206  -0.369
  752   1HD   PRO  88           HD2      PRO  88  -4.132 -11.564  -3.119
  753   2HD   PRO  88           HD1      PRO  88  -5.557 -11.285  -2.092
  754    H    SER  89           HN       SER  89  -2.524  -9.912  -3.789
  755    HA   SER  89           HA       SER  89  -0.226  -8.105  -3.714
  756   1HB   SER  89           HB2      SER  89  -0.062 -10.624  -3.846
  757   2HB   SER  89           HB1      SER  89  -0.651 -10.513  -5.502
  758    HG   SER  89           HG       SER  89   1.602 -10.500  -5.489
  759    H    TYR  90           HN       TYR  90  -3.051  -8.276  -5.578
  760    HA   TYR  90           HA       TYR  90  -2.160  -7.563  -8.167
  761   1HB   TYR  90           HB2      TYR  90  -4.522  -8.072  -7.693
  762   2HB   TYR  90           HB1      TYR  90  -4.657  -6.605  -6.725
  763    HD1  TYR  90           HD1      TYR  90  -3.410  -7.608 -10.133
  764    HD2  TYR  90           HD2      TYR  90  -5.611  -4.747  -7.800
  765    HE1  TYR  90           HE1      TYR  90  -3.908  -6.308 -12.184
  766    HE2  TYR  90           HE2      TYR  90  -6.105  -3.452  -9.850
  767    HH   TYR  90           HH       TYR  90  -6.087  -3.533 -12.120
  768    H    ARG  91           HN       ARG  91  -2.740  -5.145  -9.009
  769    HA   ARG  91           HA       ARG  91  -1.699  -3.130  -7.078
  770   1HB   ARG  91           HB2      ARG  91  -0.424  -3.872  -9.720
  771   2HB   ARG  91           HB1      ARG  91  -0.144  -2.314  -8.941
  772   1HG   ARG  91           HG2      ARG  91   0.648  -3.469  -6.908
  773   2HG   ARG  91           HG1      ARG  91   0.378  -5.027  -7.690
  774   1HD   ARG  91           HD2      ARG  91   2.173  -2.911  -8.892
  775   2HD   ARG  91           HD1      ARG  91   2.776  -4.128  -7.767
  776    HE   ARG  91           HE       ARG  91   1.442  -5.612  -9.689
  777   1HH1  ARG  91          HH11      ARG  91   2.464  -6.398 -11.545
  778   2HH1  ARG  91          HH12      ARG  91   3.876  -5.595 -12.147
  779   1HH2  ARG  91          HH21      ARG  91   3.889  -3.183  -9.655
  780   2HH2  ARG  91          HH22      ARG  91   4.683  -3.775 -11.076
  781    H    VAL  92           HN       VAL  92  -2.607  -1.150  -7.379
  782    HA   VAL  92           HA       VAL  92  -4.577  -0.879  -9.610
  783    HB   VAL  92           HB       VAL  92  -4.306   0.755  -7.069
  784   1HG1  VAL  92          HG11      VAL  92  -6.452   0.518  -9.194
  785   2HG1  VAL  92          HG12      VAL  92  -5.491   1.947  -8.810
  786   3HG1  VAL  92          HG13      VAL  92  -6.681   1.348  -7.656
  787   1HG2  VAL  92          HG21      VAL  92  -6.342  -1.411  -7.652
  788   2HG2  VAL  92          HG22      VAL  92  -6.024  -0.607  -6.116
  789   3HG2  VAL  92          HG23      VAL  92  -4.848  -1.738  -6.774
  790    H    LYS  93           HN       LYS  93  -4.707   1.202 -10.711
  791    HA   LYS  93           HA       LYS  93  -2.292   2.939 -10.505
  792   1HB   LYS  93           HB2      LYS  93  -3.274   1.449 -12.943
  793   2HB   LYS  93           HB1      LYS  93  -2.351   2.941 -13.112
  794   1HG   LYS  93           HG2      LYS  93  -0.543   1.943 -11.715
  795   2HG   LYS  93           HG1      LYS  93  -1.454   0.433 -11.661
  796   1HD   LYS  93           HD2      LYS  93  -1.434   0.493 -14.218
  797   2HD   LYS  93           HD1      LYS  93  -0.229   1.774 -14.078
  798   1HE   LYS  93           HE2      LYS  93   0.979  -0.293 -14.297
  799   2HE   LYS  93           HE1      LYS  93   1.118   0.204 -12.610
  800   1HZ   LYS  93           HZ1      LYS  93  -0.305  -2.045 -13.771
  801   2HZ   LYS  93           HZ2      LYS  93  -1.114  -1.233 -12.517
  802   3HZ   LYS  93           HZ3      LYS  93   0.429  -1.892 -12.250
  803    HA   PRO  94           HA       PRO  94  -4.949   6.479 -10.725
  804   1HB   PRO  94           HB2      PRO  94  -3.570   7.017 -13.347
  805   2HB   PRO  94           HB1      PRO  94  -3.970   8.151 -12.038
  806   1HG   PRO  94           HG2      PRO  94  -1.503   7.152 -12.310
  807   2HG   PRO  94           HG1      PRO  94  -2.215   7.457 -10.716
  808   1HD   PRO  94           HD2      PRO  94  -1.636   4.858 -12.018
  809   2HD   PRO  94           HD1      PRO  94  -1.912   5.216 -10.299
  810    H    GLY  95           HN       GLY  95  -6.948   7.038 -11.674
  811   1HA   GLY  95           HA2      GLY  95  -8.647   7.013 -13.367
  812   2HA   GLY  95           HA1      GLY  95  -7.698   5.838 -14.279
  813    H    GLN  96           HN       GLN  96  -7.407   4.473 -11.455
  814    HA   GLN  96           HA       GLN  96  -9.832   2.778 -11.796
  815   1HB   GLN  96           HB2      GLN  96  -7.205   2.413 -10.342
  816   2HB   GLN  96           HB1      GLN  96  -8.560   1.304 -10.129
  817   1HG   GLN  96           HG2      GLN  96  -8.602   0.950 -12.604
  818   2HG   GLN  96           HG1      GLN  96  -7.161   1.958 -12.738
  819   1HE2  GLN  96          HE21      GLN  96  -8.342  -1.211 -11.788
  820   2HE2  GLN  96          HE22      GLN  96  -6.823  -1.885 -11.447
  821    H    THR  97           HN       THR  97 -11.352   2.539 -10.145
  822    HA   THR  97           HA       THR  97 -11.084   4.402  -7.823
  823    HB   THR  97           HB       THR  97 -13.681   3.234  -8.830
  824    HG1  THR  97           HG1      THR  97 -12.505   5.717  -9.524
  825   1HG2  THR  97          HG21      THR  97 -13.689   4.154  -6.600
  826   2HG2  THR  97          HG22      THR  97 -14.596   5.200  -7.695
  827   3HG2  THR  97          HG23      THR  97 -12.974   5.652  -7.187
  828    H    ILE  98           HN       ILE  98 -11.199   3.611  -5.805
  829    HA   ILE  98           HA       ILE  98 -11.462   0.652  -5.433
  830    HB   ILE  98           HB       ILE  98 -10.779   2.778  -3.368
  831   1HG1  ILE  98          HG12      ILE  98  -9.116   2.960  -5.111
  832   2HG1  ILE  98          HG11      ILE  98  -8.400   2.080  -3.764
  833   1HG2  ILE  98          HG21      ILE  98 -10.157  -0.184  -3.450
  834   2HG2  ILE  98          HG22      ILE  98 -11.524   0.516  -2.583
  835   3HG2  ILE  98          HG23      ILE  98  -9.875   0.920  -2.105
  836   1HD1  ILE  98          HD11      ILE  98  -9.161  -0.053  -4.996
  837   2HD1  ILE  98          HD12      ILE  98  -7.789   0.827  -5.661
  838   3HD1  ILE  98          HD13      ILE  98  -9.379   0.995  -6.398
  839    H    ALA  99           HN       ALA  99 -13.561  -0.027  -4.886
  840    HA   ALA  99           HA       ALA  99 -15.211   1.828  -3.231
  841   1HB   ALA  99           HB1      ALA  99 -16.912   1.994  -4.760
  842   2HB   ALA  99           HB2      ALA  99 -16.673   0.351  -5.350
  843   3HB   ALA  99           HB3      ALA  99 -15.619   1.646  -5.907
  844    H    VAL 100           HN       VAL 100 -16.237   0.922  -1.590
  845    HA   VAL 100           HA       VAL 100 -15.790  -1.836  -0.923
  846    HB   VAL 100           HB       VAL 100 -17.806   0.153   0.170
  847   1HG1  VAL 100          HG11      VAL 100 -18.554  -2.021   0.800
  848   2HG1  VAL 100          HG12      VAL 100 -17.658  -1.408   2.190
  849   3HG1  VAL 100          HG13      VAL 100 -16.908  -2.578   1.104
  850   1HG2  VAL 100          HG21      VAL 100 -16.182   0.628   1.859
  851   2HG2  VAL 100          HG22      VAL 100 -15.305   0.685   0.330
  852   3HG2  VAL 100          HG23      VAL 100 -15.172  -0.732   1.371
  853    H    ARG 101           HN       ARG 101 -17.152  -3.628  -1.148
  854    HA   ARG 101           HA       ARG 101 -19.073  -3.561  -3.293
  855   1HB   ARG 101           HB2      ARG 101 -17.892  -5.621  -2.839
  856   2HB   ARG 101           HB1      ARG 101 -18.485  -5.654  -1.179
  857   1HG   ARG 101           HG2      ARG 101 -20.716  -6.098  -1.875
  858   2HG   ARG 101           HG1      ARG 101 -20.356  -5.679  -3.550
  859   1HD   ARG 101           HD2      ARG 101 -18.991  -7.639  -3.831
  860   2HD   ARG 101           HD1      ARG 101 -19.048  -7.995  -2.105
  861    HE   ARG 101           HE       ARG 101 -21.710  -8.020  -2.869
  862   1HH1  ARG 101          HH11      ARG 101 -22.751  -9.893  -3.589
  863   2HH1  ARG 101          HH12      ARG 101 -21.818 -11.173  -4.289
  864   1HH2  ARG 101          HH21      ARG 101 -18.790  -9.522  -3.922
  865   2HH2  ARG 101          HH22      ARG 101 -19.575 -10.962  -4.478
  866    H    GLU 102           HN       GLU 102 -21.339  -3.506  -3.172
  867    HA   GLU 102           HA       GLU 102 -22.628  -2.000  -1.234
  868   1HB   GLU 102           HB2      GLU 102 -23.791  -4.288  -2.848
  869   2HB   GLU 102           HB1      GLU 102 -24.744  -3.071  -1.998
  870   1HG   GLU 102           HG2      GLU 102 -23.709  -1.294  -3.345
  871   2HG   GLU 102           HG1      GLU 102 -22.718  -2.491  -4.179
  872    H    LYS 103           HN       LYS 103 -23.450  -5.456  -1.373
  873    HA   LYS 103           HA       LYS 103 -24.480  -5.773   1.156
  874   1HB   LYS 103           HB2      LYS 103 -22.642  -7.753  -0.221
  875   2HB   LYS 103           HB1      LYS 103 -23.797  -8.139   1.052
  876   1HG   LYS 103           HG2      LYS 103 -24.770  -6.752  -1.443
  877   2HG   LYS 103           HG1      LYS 103 -24.462  -8.486  -1.486
  878   1HD   LYS 103           HD2      LYS 103 -26.022  -8.867   0.338
  879   2HD   LYS 103           HD1      LYS 103 -26.256  -7.134   0.552
  880   1HE   LYS 103           HE2      LYS 103 -28.122  -7.905  -0.733
  881   2HE   LYS 103           HE1      LYS 103 -27.059  -7.061  -1.859
  882   1HZ   LYS 103           HZ1      LYS 103 -26.043  -9.381  -2.209
  883   2HZ   LYS 103           HZ2      LYS 103 -27.527  -9.022  -2.954
  884   3HZ   LYS 103           HZ3      LYS 103 -27.489  -9.959  -1.537
  885    H    SER 104           HN       SER 104 -21.122  -5.240   0.399
  886    HA   SER 104           HA       SER 104 -20.292  -5.950   3.178
  887   1HB   SER 104           HB2      SER 104 -18.433  -4.935   1.035
  888   2HB   SER 104           HB1      SER 104 -18.099  -6.037   2.364
  889    HG   SER 104           HG       SER 104 -19.538  -7.529   1.277
  890    H    ARG 105           HN       ARG 105 -21.953  -3.729   3.138
  891    HA   ARG 105           HA       ARG 105 -20.053  -1.424   3.504
  892   1HB   ARG 105           HB2      ARG 105 -22.921  -1.527   2.558
  893   2HB   ARG 105           HB1      ARG 105 -22.241  -0.048   3.236
  894   1HG   ARG 105           HG2      ARG 105 -20.356  -0.265   1.542
  895   2HG   ARG 105           HG1      ARG 105 -21.292  -1.554   0.786
  896   1HD   ARG 105           HD2      ARG 105 -22.364   1.234   1.284
  897   2HD   ARG 105           HD1      ARG 105 -21.652   0.715  -0.243
  898    HE   ARG 105           HE       ARG 105 -23.605  -1.186   0.251
  899   1HH1  ARG 105          HH11      ARG 105 -25.732  -0.964  -0.480
  900   2HH1  ARG 105          HH12      ARG 105 -26.368   0.618  -0.787
  901   1HH2  ARG 105          HH21      ARG 105 -23.443   2.255   0.104
  902   2HH2  ARG 105          HH22      ARG 105 -25.072   2.440  -0.457
  903    H    ASN 106           HN       ASN 106 -22.716  -3.272   4.908
  904    HA   ASN 106           HA       ASN 106 -22.939  -1.490   7.220
  905   1HB   ASN 106           HB2      ASN 106 -24.076  -4.199   6.498
  906   2HB   ASN 106           HB1      ASN 106 -24.298  -3.510   8.103
  907   1HD2  ASN 106          HD21      ASN 106 -25.679  -3.633   5.020
  908   2HD2  ASN 106          HD22      ASN 106 -26.663  -2.254   5.128
  909    H    LEU 107           HN       LEU 107 -20.637  -3.619   6.209
  910    HA   LEU 107           HA       LEU 107 -19.939  -5.279   8.313
  911   1HB   LEU 107           HB2      LEU 107 -18.235  -3.604   6.495
  912   2HB   LEU 107           HB1      LEU 107 -17.532  -4.725   7.647
  913    HG   LEU 107           HG       LEU 107 -19.588  -5.497   5.564
  914   1HD1  LEU 107          HD11      LEU 107 -17.657  -4.883   4.352
  915   2HD1  LEU 107          HD12      LEU 107 -17.529  -6.633   4.537
  916   3HD1  LEU 107          HD13      LEU 107 -16.572  -5.566   5.564
  917   1HD2  LEU 107          HD21      LEU 107 -18.350  -7.799   6.184
  918   2HD2  LEU 107          HD22      LEU 107 -19.721  -7.215   7.114
  919   3HD2  LEU 107          HD23      LEU 107 -18.082  -6.962   7.712
  920    H    GLN 108           HN       GLN 108 -19.849  -4.789  10.461
  921    HA   GLN 108           HA       GLN 108 -19.690  -2.211  11.572
  922   1HB   GLN 108           HB2      GLN 108 -18.971  -3.331  13.664
  923   2HB   GLN 108           HB1      GLN 108 -20.311  -4.186  12.899
  924   1HG   GLN 108           HG2      GLN 108 -18.495  -5.623  11.751
  925   2HG   GLN 108           HG1      GLN 108 -17.387  -4.945  12.944
  926   1HE2  GLN 108          HE21      GLN 108 -19.486  -7.530  12.421
  927   2HE2  GLN 108          HE22      GLN 108 -19.745  -7.982  14.036
  928    H    VAL 109           HN       VAL 109 -17.055  -4.507  10.898
  929    HA   VAL 109           HA       VAL 109 -14.907  -3.022  11.908
  930    HB   VAL 109           HB       VAL 109 -14.470  -5.236  11.155
  931   1HG1  VAL 109          HG11      VAL 109 -15.391  -4.336   8.416
  932   2HG1  VAL 109          HG12      VAL 109 -16.302  -5.374   9.512
  933   3HG1  VAL 109          HG13      VAL 109 -14.785  -5.941   8.817
  934   1HG2  VAL 109          HG21      VAL 109 -13.217  -3.532   8.992
  935   2HG2  VAL 109          HG22      VAL 109 -12.550  -4.971   9.763
  936   3HG2  VAL 109          HG23      VAL 109 -12.684  -3.466  10.672
  937    H    ILE 110           HN       ILE 110 -16.732  -2.475   8.901
  938    HA   ILE 110           HA       ILE 110 -14.783  -0.456   7.998
  939    HB   ILE 110           HB       ILE 110 -17.488  -1.319   6.939
  940   1HG1  ILE 110          HG12      ILE 110 -14.659  -1.594   5.871
  941   2HG1  ILE 110          HG11      ILE 110 -15.591  -2.884   6.618
  942   1HG2  ILE 110          HG21      ILE 110 -15.573   0.830   5.967
  943   2HG2  ILE 110          HG22      ILE 110 -17.260   1.041   6.429
  944   3HG2  ILE 110          HG23      ILE 110 -16.857   0.160   4.964
  945   1HD1  ILE 110          HD11      ILE 110 -17.368  -2.302   4.780
  946   2HD1  ILE 110          HD12      ILE 110 -15.960  -3.270   4.349
  947   3HD1  ILE 110          HD13      ILE 110 -15.998  -1.551   3.964
  948    H    LYS 111           HN       LYS 111 -18.222  -0.477   8.868
  949    HA   LYS 111           HA       LYS 111 -18.723   2.264   9.069
  950   1HB   LYS 111           HB2      LYS 111 -19.680   0.023  10.876
  951   2HB   LYS 111           HB1      LYS 111 -20.368   1.647  10.877
  952   1HG   LYS 111           HG2      LYS 111 -20.131   0.145   8.275
  953   2HG   LYS 111           HG1      LYS 111 -21.449  -0.244   9.377
  954   1HD   LYS 111           HD2      LYS 111 -22.530   1.767   9.032
  955   2HD   LYS 111           HD1      LYS 111 -21.027   2.671   8.870
  956   1HE   LYS 111           HE2      LYS 111 -20.708   1.690   6.609
  957   2HE   LYS 111           HE1      LYS 111 -22.262   0.870   6.772
  958   1HZ   LYS 111           HZ1      LYS 111 -23.339   2.725   6.262
  959   2HZ   LYS 111           HZ2      LYS 111 -21.846   3.410   5.831
  960   3HZ   LYS 111           HZ3      LYS 111 -22.468   3.639   7.395
  961    H    GLU 112           HN       GLU 112 -16.809   0.220  11.112
  962    HA   GLU 112           HA       GLU 112 -16.580   2.194  13.277
  963   1HB   GLU 112           HB2      GLU 112 -16.481  -0.238  13.750
  964   2HB   GLU 112           HB1      GLU 112 -15.017  -0.358  12.774
  965   1HG   GLU 112           HG2      GLU 112 -13.791   1.048  14.281
  966   2HG   GLU 112           HG1      GLU 112 -15.258   1.502  15.149
  967    H    ALA 113           HN       ALA 113 -14.641   1.085  10.505
  968    HA   ALA 113           HA       ALA 113 -12.351   2.729  11.280
  969   1HB   ALA 113           HB1      ALA 113 -11.791   0.820   9.990
  970   2HB   ALA 113           HB2      ALA 113 -11.598   2.180   8.883
  971   3HB   ALA 113           HB3      ALA 113 -13.037   1.164   8.791
  972    H    LEU 114           HN       LEU 114 -15.286   3.279   9.443
  973    HA   LEU 114           HA       LEU 114 -14.424   5.423   7.796
  974   1HB   LEU 114           HB2      LEU 114 -17.090   5.167   9.211
  975   2HB   LEU 114           HB1      LEU 114 -16.748   6.179   7.819
  976    HG   LEU 114           HG       LEU 114 -16.888   3.177   7.952
  977   1HD1  LEU 114          HD11      LEU 114 -18.586   3.419   6.313
  978   2HD1  LEU 114          HD12      LEU 114 -18.132   5.091   5.988
  979   3HD1  LEU 114          HD13      LEU 114 -18.907   4.668   7.515
  980   1HD2  LEU 114          HD21      LEU 114 -16.212   3.303   5.474
  981   2HD2  LEU 114          HD22      LEU 114 -14.914   3.476   6.651
  982   3HD2  LEU 114          HD23      LEU 114 -15.573   4.903   5.848
  983    H    GLU 115           HN       GLU 115 -15.317   5.342  11.215
  984    HA   GLU 115           HA       GLU 115 -15.189   8.236  11.512
  985   1HB   GLU 115           HB2      GLU 115 -15.106   6.028  13.592
  986   2HB   GLU 115           HB1      GLU 115 -15.318   7.745  13.937
  987   1HG   GLU 115           HG2      GLU 115 -17.168   6.132  12.159
  988   2HG   GLU 115           HG1      GLU 115 -17.481   6.474  13.861
  989    H    ALA 116           HN       ALA 116 -12.978   5.528  12.020
  990    HA   ALA 116           HA       ALA 116 -10.923   6.989  13.364
  991   1HB   ALA 116           HB1      ALA 116  -9.509   5.118  12.873
  992   2HB   ALA 116           HB2      ALA 116 -10.494   4.655  11.485
  993   3HB   ALA 116           HB3      ALA 116 -11.127   4.463  13.119
  994    H    ASN 117           HN       ASN 117 -12.171   7.659  10.422
  995    HA   ASN 117           HA       ASN 117  -9.654   8.141   8.973
  996   1HB   ASN 117           HB2      ASN 117 -11.797   7.481   7.824
  997   2HB   ASN 117           HB1      ASN 117 -12.456   9.056   8.266
  998   1HD2  ASN 117          HD21      ASN 117 -11.282  11.001   7.382
  999   2HD2  ASN 117          HD22      ASN 117 -10.419  10.853   5.928
 1000    H    ASN 118           HN       ASN 118  -8.470   9.958   9.285
 1001    HA   ASN 118           HA       ASN 118  -9.783  12.547   9.677
 1002   1HB   ASN 118           HB2      ASN 118  -8.701  13.058  11.808
 1003   2HB   ASN 118           HB1      ASN 118  -9.684  11.605  11.992
 1004   1HD2  ASN 118          HD21      ASN 118  -8.615   9.675  12.598
 1005   2HD2  ASN 118          HD22      ASN 118  -6.932   9.543  12.771
 1006    H    TYR 119           HN       TYR 119  -7.904  11.130   7.848
 1007    HA   TYR 119           HA       TYR 119  -6.175  13.306   7.224
 1008   1HB   TYR 119           HB2      TYR 119  -4.842  12.761   9.148
 1009   2HB   TYR 119           HB1      TYR 119  -4.922  11.036   8.797
 1010    HD1  TYR 119           HD1      TYR 119  -3.607  14.290   7.530
 1011    HD2  TYR 119           HD2      TYR 119  -3.348  10.006   7.342
 1012    HE1  TYR 119           HE1      TYR 119  -1.556  14.473   6.147
 1013    HE2  TYR 119           HE2      TYR 119  -1.297  10.190   5.960
 1014    HH   TYR 119           HH       TYR 119  -0.120  13.333   4.831
 1015    H    ILE 120           HN       ILE 120  -7.061  12.737   5.153
 1016    HA   ILE 120           HA       ILE 120  -6.174  10.121   4.018
 1017    HB   ILE 120           HB       ILE 120  -8.113  12.074   2.787
 1018   1HG1  ILE 120          HG12      ILE 120  -8.525   9.885   4.839
 1019   2HG1  ILE 120          HG11      ILE 120  -9.107  11.547   4.884
 1020   1HG2  ILE 120          HG21      ILE 120  -7.848   9.074   2.449
 1021   2HG2  ILE 120          HG22      ILE 120  -6.981  10.222   1.431
 1022   3HG2  ILE 120          HG23      ILE 120  -8.744  10.200   1.430
 1023   1HD1  ILE 120          HD11      ILE 120 -11.035  10.401   4.276
 1024   2HD1  ILE 120          HD12      ILE 120 -10.148   9.214   3.322
 1025   3HD1  ILE 120          HD13      ILE 120 -10.392  10.846   2.695
 1026    HA   PRO 121           HA       PRO 121  -2.793  12.322   1.951
 1027   1HB   PRO 121           HB2      PRO 121  -3.500  10.360  -0.217
 1028   2HB   PRO 121           HB1      PRO 121  -1.902  10.821   0.406
 1029   1HG   PRO 121           HG2      PRO 121  -3.063   8.537   1.141
 1030   2HG   PRO 121           HG1      PRO 121  -2.099   9.494   2.279
 1031   1HD   PRO 121           HD2      PRO 121  -5.052   9.117   2.188
 1032   2HD   PRO 121           HD1      PRO 121  -4.007   9.536   3.564
 1033    H    ASP 122           HN       ASP 122  -2.479  13.391  -0.287
 1034    HA   ASP 122           HA       ASP 122  -4.961  14.836  -0.952
 1035   1HB   ASP 122           HB2      ASP 122  -2.086  15.160  -1.844
 1036   2HB   ASP 122           HB1      ASP 122  -3.406  16.179  -2.417
 1037    H    TYR 123           HN       TYR 123  -2.924  12.348  -2.378
 1038    HA   TYR 123           HA       TYR 123  -4.151  12.683  -5.031
 1039   1HB   TYR 123           HB2      TYR 123  -2.850  10.477  -5.455
 1040   2HB   TYR 123           HB1      TYR 123  -1.927  11.952  -5.186
 1041    HD1  TYR 123           HD1      TYR 123  -2.865   8.688  -3.832
 1042    HD2  TYR 123           HD2      TYR 123  -0.807  12.369  -3.026
 1043    HE1  TYR 123           HE1      TYR 123  -1.726   7.627  -1.903
 1044    HE2  TYR 123           HE2      TYR 123   0.332  11.309  -1.096
 1045    HH   TYR 123           HH       TYR 123   0.483   8.039  -0.620
 1046    H    LEU 124           HN       LEU 124  -5.216  11.340  -2.178
 1047    HA   LEU 124           HA       LEU 124  -6.868   9.264  -3.588
 1048   1HB   LEU 124           HB2      LEU 124  -6.145   9.531  -0.650
 1049   2HB   LEU 124           HB1      LEU 124  -7.258   8.332  -1.297
 1050    HG   LEU 124           HG       LEU 124  -4.315   8.594  -1.974
 1051   1HD1  LEU 124          HD11      LEU 124  -4.008   6.587  -0.728
 1052   2HD1  LEU 124          HD12      LEU 124  -5.743   6.289  -0.643
 1053   3HD1  LEU 124          HD13      LEU 124  -5.031   7.608   0.283
 1054   1HD2  LEU 124          HD21      LEU 124  -5.200   7.737  -3.963
 1055   2HD2  LEU 124          HD22      LEU 124  -6.539   6.933  -3.142
 1056   3HD2  LEU 124          HD23      LEU 124  -4.914   6.252  -3.062
 1057    H    SER 125           HN       SER 125  -8.931   9.793  -3.897
 1058    HA   SER 125           HA       SER 125 -10.142  11.986  -2.259
 1059   1HB   SER 125           HB2      SER 125 -10.641  12.634  -4.417
 1060   2HB   SER 125           HB1      SER 125 -10.490  10.998  -5.043
 1061    HG   SER 125           HG       SER 125 -12.693  12.338  -4.340
 1062    H    PHE 126           HN       PHE 126 -11.412  11.247  -0.591
 1063    HA   PHE 126           HA       PHE 126 -12.496   8.468  -0.753
 1064   1HB   PHE 126           HB2      PHE 126 -11.124   9.182   1.216
 1065   2HB   PHE 126           HB1      PHE 126 -12.399  10.330   1.627
 1066    HD1  PHE 126           HD1      PHE 126 -11.944   6.703   0.774
 1067    HD2  PHE 126           HD2      PHE 126 -14.129   9.622   3.046
 1068    HE1  PHE 126           HE1      PHE 126 -13.206   4.887   1.895
 1069    HE2  PHE 126           HE2      PHE 126 -15.390   7.806   4.166
 1070    HZ   PHE 126           HZ       PHE 126 -14.929   5.438   3.591
 1071    H    ASP 127           HN       ASP 127 -14.592   8.181  -1.224
 1072    HA   ASP 127           HA       ASP 127 -16.492  10.468  -0.932
 1073   1HB   ASP 127           HB2      ASP 127 -16.941   7.856  -2.395
 1074   2HB   ASP 127           HB1      ASP 127 -17.877   9.343  -2.537
 1075    HA   PRO 128           HA       PRO 128 -17.797   7.810   2.546
 1076   1HB   PRO 128           HB2      PRO 128 -19.151   9.662   3.980
 1077   2HB   PRO 128           HB1      PRO 128 -17.376   9.651   3.903
 1078   1HG   PRO 128           HG2      PRO 128 -19.319  11.372   2.427
 1079   2HG   PRO 128           HG1      PRO 128 -17.767  11.806   3.166
 1080   1HD   PRO 128           HD2      PRO 128 -18.119  11.304   0.460
 1081   2HD   PRO 128           HD1      PRO 128 -16.562  11.158   1.307
 1082    H    GLU 129           HN       GLU 129 -20.048   9.971   0.807
 1083    HA   GLU 129           HA       GLU 129 -22.476   8.821   1.672
 1084   1HB   GLU 129           HB2      GLU 129 -21.863   9.864  -1.109
 1085   2HB   GLU 129           HB1      GLU 129 -23.456   9.736  -0.363
 1086   1HG   GLU 129           HG2      GLU 129 -22.606  11.274   1.468
 1087   2HG   GLU 129           HG1      GLU 129 -21.175  11.542   0.472
 1088    H    LYS 130           HN       LYS 130 -20.605   7.990  -1.273
 1089    HA   LYS 130           HA       LYS 130 -22.156   5.461  -1.491
 1090   1HB   LYS 130           HB2      LYS 130 -20.364   7.026  -3.336
 1091   2HB   LYS 130           HB1      LYS 130 -20.740   5.349  -3.685
 1092   1HG   LYS 130           HG2      LYS 130 -22.978   7.258  -3.044
 1093   2HG   LYS 130           HG1      LYS 130 -22.264   7.285  -4.654
 1094   1HD   LYS 130           HD2      LYS 130 -23.072   4.638  -3.470
 1095   2HD   LYS 130           HD1      LYS 130 -24.315   5.695  -4.133
 1096   1HE   LYS 130           HE2      LYS 130 -23.060   5.795  -6.278
 1097   2HE   LYS 130           HE1      LYS 130 -21.871   4.676  -5.613
 1098   1HZ   LYS 130           HZ1      LYS 130 -24.676   4.186  -6.339
 1099   2HZ   LYS 130           HZ2      LYS 130 -23.948   3.235  -5.134
 1100   3HZ   LYS 130           HZ3      LYS 130 -23.297   3.269  -6.703
 1101    H    MET 131           HN       MET 131 -19.568   6.342   0.249
 1102    HA   MET 131           HA       MET 131 -17.613   5.252   0.987
 1103   1HB   MET 131           HB2      MET 131 -19.700   3.134   0.573
 1104   2HB   MET 131           HB1      MET 131 -18.056   2.591   0.901
 1105   1HG   MET 131           HG2      MET 131 -18.022   3.538   3.032
 1106   2HG   MET 131           HG1      MET 131 -19.271   4.718   2.645
 1107   1HE   MET 131           HE1      MET 131 -18.421   1.868   4.582
 1108   2HE   MET 131           HE2      MET 131 -18.579   0.836   3.166
 1109   3HE   MET 131           HE3      MET 131 -19.708   0.661   4.507
 1110    H    GLU 132           HN       GLU 132 -16.974   6.167  -1.360
 1111    HA   GLU 132           HA       GLU 132 -15.635   3.899  -2.745
 1112   1HB   GLU 132           HB2      GLU 132 -17.631   4.545  -4.068
 1113   2HB   GLU 132           HB1      GLU 132 -16.999   6.188  -4.172
 1114   1HG   GLU 132           HG2      GLU 132 -15.162   5.524  -5.470
 1115   2HG   GLU 132           HG1      GLU 132 -15.379   3.818  -5.068
 1116    H    GLY 133           HN       GLY 133 -13.529   4.207  -2.960
 1117   1HA   GLY 133           HA2      GLY 133 -12.416   6.947  -2.522
 1118   2HA   GLY 133           HA1      GLY 133 -11.524   5.439  -2.303
 1119    H    THR 134           HN       THR 134 -10.965   7.817  -4.101
 1120    HA   THR 134           HA       THR 134 -10.800   6.292  -6.676
 1121    HB   THR 134           HB       THR 134 -11.323   9.238  -6.312
 1122    HG1  THR 134           HG1      THR 134 -13.321   8.776  -6.984
 1123   1HG2  THR 134          HG21      THR 134 -10.777   7.543  -8.747
 1124   2HG2  THR 134          HG22      THR 134  -9.948   9.015  -8.239
 1125   3HG2  THR 134          HG23      THR 134 -11.600   9.100  -8.850
 1126    H    TYR 135           HN       TYR 135  -8.825   6.106  -7.525
 1127    HA   TYR 135           HA       TYR 135  -6.565   7.436  -6.177
 1128   1HB   TYR 135           HB2      TYR 135  -6.862   5.017  -7.518
 1129   2HB   TYR 135           HB1      TYR 135  -6.041   5.984  -8.730
 1130    HD1  TYR 135           HD1      TYR 135  -5.148   3.522  -6.861
 1131    HD2  TYR 135           HD2      TYR 135  -4.390   7.753  -6.883
 1132    HE1  TYR 135           HE1      TYR 135  -3.000   3.145  -5.684
 1133    HE2  TYR 135           HE2      TYR 135  -2.246   7.368  -5.695
 1134    HH   TYR 135           HH       TYR 135  -1.462   4.444  -4.210
 1135    H    THR 136           HN       THR 136  -7.039   9.657  -6.683
 1136    HA   THR 136           HA       THR 136  -7.485  10.422  -9.471
 1137    HB   THR 136           HB       THR 136  -8.425  12.256  -8.535
 1138    HG1  THR 136           HG1      THR 136  -7.043  13.579  -7.098
 1139   1HG2  THR 136          HG21      THR 136  -7.395  11.312  -5.847
 1140   2HG2  THR 136          HG22      THR 136  -8.814  10.633  -6.642
 1141   3HG2  THR 136          HG23      THR 136  -8.801  12.328  -6.157
 1142    H    ARG 137           HN       ARG 137  -4.668   9.855  -7.640
 1143    HA   ARG 137           HA       ARG 137  -3.010  10.752  -9.841
 1144   1HB   ARG 137           HB2      ARG 137  -3.526  12.941  -8.811
 1145   2HB   ARG 137           HB1      ARG 137  -2.891  12.364  -7.272
 1146   1HG   ARG 137           HG2      ARG 137  -0.677  12.321  -8.044
 1147   2HG   ARG 137           HG1      ARG 137  -1.162  12.242  -9.739
 1148   1HD   ARG 137           HD2      ARG 137  -2.020  14.571  -9.572
 1149   2HD   ARG 137           HD1      ARG 137  -1.454  14.641  -7.904
 1150    HE   ARG 137           HE       ARG 137   0.804  13.918  -9.336
 1151   1HH1  ARG 137          HH11      ARG 137   2.237  15.439 -10.199
 1152   2HH1  ARG 137          HH12      ARG 137   1.672  17.036 -10.556
 1153   1HH2  ARG 137          HH21      ARG 137  -1.571  16.412  -9.499
 1154   2HH2  ARG 137          HH22      ARG 137  -0.484  17.587 -10.160
 1155    H    LEU 138           HN       LEU 138  -0.583  10.644  -9.111
 1156    HA   LEU 138           HA       LEU 138  -0.274   8.114  -7.646
 1157   1HB   LEU 138           HB2      LEU 138   1.456   9.838  -9.380
 1158   2HB   LEU 138           HB1      LEU 138   2.257   8.718  -8.284
 1159    HG   LEU 138           HG       LEU 138   0.012   7.752 -10.061
 1160   1HD1  LEU 138          HD11      LEU 138   2.934   7.974 -10.815
 1161   2HD1  LEU 138          HD12      LEU 138   1.607   8.881 -11.541
 1162   3HD1  LEU 138          HD13      LEU 138   1.697   7.132 -11.748
 1163   1HD2  LEU 138          HD21      LEU 138   0.753   6.179  -8.369
 1164   2HD2  LEU 138          HD22      LEU 138   2.445   6.464  -8.776
 1165   3HD2  LEU 138          HD23      LEU 138   1.390   5.637  -9.918
 1166    HA   PRO 139           HA       PRO 139   1.015  10.081  -3.863
 1167   1HB   PRO 139           HB2      PRO 139   2.565   8.182  -2.720
 1168   2HB   PRO 139           HB1      PRO 139   0.827   7.929  -2.979
 1169   1HG   PRO 139           HG2      PRO 139   3.134   6.964  -4.621
 1170   2HG   PRO 139           HG1      PRO 139   1.691   6.081  -4.087
 1171   1HD   PRO 139           HD2      PRO 139   1.927   7.163  -6.601
 1172   2HD   PRO 139           HD1      PRO 139   0.365   6.954  -5.779
 1173    H    GLU 140           HN       GLU 140   3.003  10.754  -2.588
 1174    HA   GLU 140           HA       GLU 140   5.499  10.892  -4.226
 1175   1HB   GLU 140           HB2      GLU 140   4.649  13.353  -2.727
 1176   2HB   GLU 140           HB1      GLU 140   5.635  13.211  -4.181
 1177   1HG   GLU 140           HG2      GLU 140   3.546  12.448  -5.401
 1178   2HG   GLU 140           HG1      GLU 140   2.632  12.904  -3.963
 1179    H    ARG 141           HN       ARG 141   7.275  11.968  -2.720
 1180    HA   ARG 141           HA       ARG 141   7.490  10.253  -0.408
 1181   1HB   ARG 141           HB2      ARG 141   9.163  12.600  -1.342
 1182   2HB   ARG 141           HB1      ARG 141   9.595  11.556   0.013
 1183   1HG   ARG 141           HG2      ARG 141   9.415   9.589  -1.578
 1184   2HG   ARG 141           HG1      ARG 141   9.273  10.759  -2.890
 1185   1HD   ARG 141           HD2      ARG 141  11.444  11.725  -2.309
 1186   2HD   ARG 141           HD1      ARG 141  11.582  10.635  -0.929
 1187    HE   ARG 141           HE       ARG 141  11.245   8.928  -3.083
 1188   1HH1  ARG 141          HH11      ARG 141  12.985   8.113  -4.274
 1189   2HH1  ARG 141          HH12      ARG 141  14.476   8.993  -4.315
 1190   1HH2  ARG 141          HH21      ARG 141  13.330  11.551  -2.274
 1191   2HH2  ARG 141          HH22      ARG 141  14.672  10.939  -3.183
 1192    H    SER 142           HN       SER 142   6.572  13.642  -0.865
 1193    HA   SER 142           HA       SER 142   6.845  14.576   1.772
 1194   1HB   SER 142           HB2      SER 142   5.102  16.205   1.201
 1195   2HB   SER 142           HB1      SER 142   6.211  15.997  -0.151
 1196    HG   SER 142           HG       SER 142   3.544  15.393   0.071
 1197    H    GLU 143           HN       GLU 143   5.089  11.896   0.906
 1198    HA   GLU 143           HA       GLU 143   3.316  12.171   3.311
 1199   1HB   GLU 143           HB2      GLU 143   2.623  11.144   0.552
 1200   2HB   GLU 143           HB1      GLU 143   1.672  10.722   1.977
 1201   1HG   GLU 143           HG2      GLU 143   2.310  13.592   1.269
 1202   2HG   GLU 143           HG1      GLU 143   0.880  12.769   0.646
 1203    H    LEU 144           HN       LEU 144   5.342  10.154   1.281
 1204    HA   LEU 144           HA       LEU 144   4.753   7.724   2.808
 1205   1HB   LEU 144           HB2      LEU 144   6.940   8.324   0.796
 1206   2HB   LEU 144           HB1      LEU 144   6.564   6.728   1.431
 1207    HG   LEU 144           HG       LEU 144   4.480   8.419   0.037
 1208   1HD1  LEU 144          HD11      LEU 144   6.269   6.319  -1.218
 1209   2HD1  LEU 144          HD12      LEU 144   6.440   8.056  -1.470
 1210   3HD1  LEU 144          HD13      LEU 144   4.990   7.221  -2.027
 1211   1HD2  LEU 144          HD21      LEU 144   3.585   6.055  -0.433
 1212   2HD2  LEU 144          HD22      LEU 144   3.490   6.601   1.237
 1213   3HD2  LEU 144          HD23      LEU 144   4.762   5.483   0.746
 1214    HA   PRO 145           HA       PRO 145   7.492   8.061   6.291
 1215   1HB   PRO 145           HB2      PRO 145   8.870   5.704   5.018
 1216   2HB   PRO 145           HB1      PRO 145   8.466   5.973   6.727
 1217   1HG   PRO 145           HG2      PRO 145   6.951   4.416   5.174
 1218   2HG   PRO 145           HG1      PRO 145   6.238   5.456   6.421
 1219   1HD   PRO 145           HD2      PRO 145   6.103   5.738   3.473
 1220   2HD   PRO 145           HD1      PRO 145   5.054   6.449   4.718
 1221    H    ALA 146           HN       ALA 146   9.007   9.670   6.341
 1222    HA   ALA 146           HA       ALA 146  10.920   9.985   4.111
 1223   1HB   ALA 146           HB1      ALA 146  11.567  12.061   5.349
 1224   2HB   ALA 146           HB2      ALA 146  10.405  11.633   6.604
 1225   3HB   ALA 146           HB3      ALA 146   9.846  11.996   4.972
 1226    H    GLU 147           HN       GLU 147  10.861   8.889   7.434
 1227    HA   GLU 147           HA       GLU 147  13.713   9.033   7.877
 1228   1HB   GLU 147           HB2      GLU 147  13.067   7.223   9.676
 1229   2HB   GLU 147           HB1      GLU 147  12.478   8.875   9.862
 1230   1HG   GLU 147           HG2      GLU 147  10.318   8.323   9.059
 1231   2HG   GLU 147           HG1      GLU 147  10.870   6.788   8.387
 1232    H    ILE 148           HN       ILE 148  12.366   7.489   5.476
 1233    HA   ILE 148           HA       ILE 148  13.900   4.928   5.793
 1234    HB   ILE 148           HB       ILE 148  11.627   5.657   3.916
 1235   1HG1  ILE 148          HG12      ILE 148  10.845   5.293   6.203
 1236   2HG1  ILE 148          HG11      ILE 148  10.381   3.922   5.201
 1237   1HG2  ILE 148          HG21      ILE 148  11.725   3.183   3.383
 1238   2HG2  ILE 148          HG22      ILE 148  13.283   3.143   4.204
 1239   3HG2  ILE 148          HG23      ILE 148  13.070   4.137   2.762
 1240   1HD1  ILE 148          HD11      ILE 148  12.421   4.070   7.392
 1241   2HD1  ILE 148          HD12      ILE 148  12.692   2.925   6.080
 1242   3HD1  ILE 148          HD13      ILE 148  11.231   2.816   7.056
 1243    H    ASN 149           HN       ASN 149  15.194   4.240   3.982
 1244    HA   ASN 149           HA       ASN 149  15.729   6.231   1.852
 1245   1HB   ASN 149           HB2      ASN 149  17.247   6.655   3.884
 1246   2HB   ASN 149           HB1      ASN 149  17.999   5.123   3.516
 1247   1HD2  ASN 149          HD21      ASN 149  19.273   7.792   3.312
 1248   2HD2  ASN 149          HD22      ASN 149  19.712   7.994   1.685
 1249    H    GLU 150           HN       GLU 150  15.417   4.945   0.099
 1250    HA   GLU 150           HA       GLU 150  15.922   2.081   0.183
 1251   1HB   GLU 150           HB2      GLU 150  14.070   3.333  -1.097
 1252   2HB   GLU 150           HB1      GLU 150  15.314   3.696  -2.290
 1253   1HG   GLU 150           HG2      GLU 150  14.290   1.700  -3.068
 1254   2HG   GLU 150           HG1      GLU 150  15.791   1.167  -2.316
 1255    H    ALA 151           HN       ALA 151  17.839   4.808  -0.716
 1256    HA   ALA 151           HA       ALA 151  19.417   3.836  -2.808
 1257   1HB   ALA 151           HB1      ALA 151  21.328   5.100  -1.780
 1258   2HB   ALA 151           HB2      ALA 151  20.287   5.410  -0.390
 1259   3HB   ALA 151           HB3      ALA 151  19.846   6.033  -1.980
 1260    H    LEU 152           HN       LEU 152  20.447   3.497   0.613
 1261    HA   LEU 152           HA       LEU 152  22.480   1.619   0.276
 1262   1HB   LEU 152           HB2      LEU 152  20.573   1.137   2.541
 1263   2HB   LEU 152           HB1      LEU 152  22.326   1.238   2.534
 1264    HG   LEU 152           HG       LEU 152  21.897   3.767   1.893
 1265   1HD1  LEU 152          HD11      LEU 152  19.877   4.667   2.446
 1266   2HD1  LEU 152          HD12      LEU 152  19.489   3.424   3.638
 1267   3HD1  LEU 152          HD13      LEU 152  19.306   3.090   1.920
 1268   1HD2  LEU 152          HD21      LEU 152  22.993   2.987   3.977
 1269   2HD2  LEU 152          HD22      LEU 152  21.405   2.733   4.702
 1270   3HD2  LEU 152          HD23      LEU 152  21.928   4.361   4.273
 1271    H    ILE 153           HN       ILE 153  19.046   1.150  -0.075
 1272    HA   ILE 153           HA       ILE 153  19.332  -1.804  -0.196
 1273    HB   ILE 153           HB       ILE 153  16.776  -0.320  -0.814
 1274   1HG1  ILE 153          HG12      ILE 153  17.928  -0.876   1.941
 1275   2HG1  ILE 153          HG11      ILE 153  17.615   0.715   1.246
 1276   1HG2  ILE 153          HG21      ILE 153  17.280  -2.886   0.715
 1277   2HG2  ILE 153          HG22      ILE 153  17.043  -2.842  -1.031
 1278   3HG2  ILE 153          HG23      ILE 153  15.750  -2.319   0.048
 1279   1HD1  ILE 153          HD11      ILE 153  15.190   0.078   1.056
 1280   2HD1  ILE 153          HD12      ILE 153  15.771   0.159   2.716
 1281   3HD1  ILE 153          HD13      ILE 153  15.562  -1.400   1.928
 1282    H    VAL 154           HN       VAL 154  19.301   0.941  -2.283
 1283    HA   VAL 154           HA       VAL 154  18.338  -0.332  -4.680
 1284    HB   VAL 154           HB       VAL 154  20.066   2.110  -4.160
 1285   1HG1  VAL 154          HG11      VAL 154  19.699   2.562  -6.661
 1286   2HG1  VAL 154          HG12      VAL 154  19.313   0.847  -6.808
 1287   3HG1  VAL 154          HG13      VAL 154  20.912   1.347  -6.256
 1288   1HG2  VAL 154          HG21      VAL 154  17.485   1.975  -3.806
 1289   2HG2  VAL 154          HG22      VAL 154  17.392   1.964  -5.563
 1290   3HG2  VAL 154          HG23      VAL 154  18.129   3.331  -4.727
 1291    H    GLU 155           HN       GLU 155  21.708   0.630  -3.954
 1292    HA   GLU 155           HA       GLU 155  22.903  -1.022  -5.911
 1293   1HB   GLU 155           HB2      GLU 155  24.018  -0.073  -3.257
 1294   2HB   GLU 155           HB1      GLU 155  24.984  -0.776  -4.555
 1295   1HG   GLU 155           HG2      GLU 155  24.282   1.022  -6.075
 1296   2HG   GLU 155           HG1      GLU 155  23.274   1.717  -4.805
 1297    H    PHE 156           HN       PHE 156  21.307  -1.991  -3.063
 1298    HA   PHE 156           HA       PHE 156  22.872  -4.223  -2.260
 1299   1HB   PHE 156           HB2      PHE 156  20.892  -3.376  -0.985
 1300   2HB   PHE 156           HB1      PHE 156  19.845  -4.036  -2.242
 1301    HD1  PHE 156           HD1      PHE 156  22.765  -5.158  -0.146
 1302    HD2  PHE 156           HD2      PHE 156  18.948  -6.162  -1.853
 1303    HE1  PHE 156           HE1      PHE 156  22.872  -7.389   0.922
 1304    HE2  PHE 156           HE2      PHE 156  19.056  -8.391  -0.775
 1305    HZ   PHE 156           HZ       PHE 156  21.016  -9.004   0.619
 1306    H    TYR 157           HN       TYR 157  20.480  -3.888  -4.851
 1307    HA   TYR 157           HA       TYR 157  20.575  -6.725  -5.521
 1308   1HB   TYR 157           HB2      TYR 157  19.391  -4.278  -6.846
 1309   2HB   TYR 157           HB1      TYR 157  19.351  -5.863  -7.611
 1310    HD1  TYR 157           HD1      TYR 157  17.867  -3.717  -5.107
 1311    HD2  TYR 157           HD2      TYR 157  18.270  -7.802  -6.372
 1312    HE1  TYR 157           HE1      TYR 157  15.901  -4.338  -3.730
 1313    HE2  TYR 157           HE2      TYR 157  16.304  -8.423  -4.995
 1314    HH   TYR 157           HH       TYR 157  15.187  -6.939  -2.614
 1315    H    SER 158           HN       SER 158  22.481  -3.946  -6.228
 1316    HA   SER 158           HA       SER 158  23.519  -4.920  -8.777
 1317   1HB   SER 158           HB2      SER 158  23.485  -2.500  -8.186
 1318   2HB   SER 158           HB1      SER 158  24.648  -2.818  -6.902
 1319    HG   SER 158           HG       SER 158  26.182  -3.174  -8.361
 1320    H    ARG 159           HN       ARG 159  24.068  -5.688  -5.507
 1321    HA   ARG 159           HA       ARG 159  26.885  -6.348  -5.692
 1322   1HB   ARG 159           HB2      ARG 159  24.858  -7.521  -3.771
 1323   2HB   ARG 159           HB1      ARG 159  26.601  -7.378  -3.539
 1324   1HG   ARG 159           HG2      ARG 159  26.284  -4.851  -3.761
 1325   2HG   ARG 159           HG1      ARG 159  24.553  -5.155  -3.615
 1326   1HD   ARG 159           HD2      ARG 159  24.966  -6.324  -1.458
 1327   2HD   ARG 159           HD1      ARG 159  26.678  -5.921  -1.593
 1328    HE   ARG 159           HE       ARG 159  25.409  -3.470  -1.814
 1329   1HH1  ARG 159          HH11      ARG 159  24.943  -2.175  -0.021
 1330   2HH1  ARG 159          HH12      ARG 159  24.762  -2.909   1.537
 1331   1HH2  ARG 159          HH21      ARG 159  25.350  -6.125   0.384
 1332   2HH2  ARG 159          HH22      ARG 159  24.993  -5.145   1.767